*HEADER    HYDROLASE                               19-JAN-09   2KDW              
*TITLE     SOLUTION STRUCTURE OF RPPH MUTANT E53A FROM ESCHERICHIA COLI          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA PYROPHOSPHOHYDROLASE;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 1-164;                                            
*COMPND   5 SYNONYM: RPPH, (DI)NUCLEOSIDE POLYPHOSPHATE HYDROLASE, AP5A          
*COMPND   6 PYROPHOSPHATASE;                                                     
*COMPND   7 EC: 3.6.1.-;                                                         
*COMPND   8 ENGINEERED: YES;                                                     
*COMPND   9 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_TAXID: 83333;                                               
*SOURCE   4 STRAIN: K12;                                                         
*SOURCE   5 GENE: RPPH, NUDH, YGDP, B2830, JW2798;                               
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET21                                      
*KEYWDS    NUDIX FAMILY, HYDROLASE, MAGNESIUM, MANGANESE, ZINC                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    21                                                                    
*AUTHOR    H.LI, Y.BI, C.JIN                                                     
*REVDAT   1   26-JAN-10 2KDW    0                                                

#
#   95 GLN  HN            7 TYR  HD          4.50    (#      0:60  Unique         2.15, 4.48 A)
 &rst
  ixpk= 0, nxpk= 60, iat=1538,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:1        7 TYR  HD          5.50    (#      1:60  Single Ambig)
 &rst
  ixpk= 1, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1512,1218,
 igr2=  91, 100,
 &end
#
#    7 TYR  HN            7 TYR  HD          4.50    (#      2:60  Unique         3.16, 4.06 A)
 &rst
  ixpk= 2, nxpk= 60, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  91, 100,
 &end
#
#    7 TYR  HE            7 TYR  HD          2.80    (#      3:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 3, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  93,  98,
 igr2=  91, 100,
 &end
#
#   94 GLY  HA+           7 TYR  HD          5.50    (#      5:60  Unique         1.95, 4.73 A)
 &rst
  ixpk= 5, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1533,1534,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:6        7 TYR  HD          3.50    (#      6:60  Single Ambig)
 &rst
  ixpk= 6, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  87,  88,  68,  69,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:7        7 TYR  HD          5.50    (#      7:60  Single Ambig)
 &rst
  ixpk= 7, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  68,  69,  44,  45,
 igr2=  91, 100,
 &end
#
#    7 TYR  HB-           7 TYR  HD          4.50    (#      8:60  Unique         2.35, 3.08 A)
 &rst
  ixpk= 8, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  87,  88,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:9        7 TYR  HD          5.50    (#      9:60  Single Ambig)
 &rst
  ixpk= 9, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1559,1560,1198,1199,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:10       7 TYR  HD          5.50    (#     10:60  Single Ambig)
 &rst
  ixpk= 10, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1201,1202,1565,1566,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:11       7 TYR  HD          4.50    (#     11:60  Single Ambig)
 &rst
  ixpk= 11, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1522,1523,1525,1526,1527,
 igr2=  91, 100,
 &end
#
#    0 AMB  60-2:12       7 TYR  HE          5.50    (#     12:60  Single Ambig)
 &rst
  ixpk= 12, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1218,1512,
 igr2=  93,  98,
 &end
#
#   95 GLN  HN            7 TYR  HE          5.50    (#     13:60  Unique         2.73, 5.02 A)
 &rst
  ixpk= 13, nxpk= 60, iat=1538,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:14       7 TYR  HE          5.50    (#     14:60  Single Ambig)
 &rst
  ixpk= 14, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1261,  83,
 igr2=  93,  98,
 &end
#
#    7 TYR  HD            7 TYR  HE          2.80    (#     15:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 15, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  91, 100,
 igr2=  93,  98,
 &end
#
#   78 LYS  HA            7 TYR  HE          5.50    (#     16:60  Unique         3.23, 5.78 A)
 &rst
  ixpk= 16, nxpk= 60, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  93,  98,
 &end
#
#   94 GLY  HA+           7 TYR  HE          5.50    (#     17:60  Unique         1.99, 4.72 A)
 &rst
  ixpk= 17, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1533,1534,
 igr2=  93,  98,
 &end
#
#   94 GLY  HA-           7 TYR  HE          5.50    (#     18:60  Unique         1.99, 4.72 A)
 &rst
  ixpk= 18, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1533,1534,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:19       7 TYR  HE          4.50    (#     19:60  Single Ambig)
 &rst
  ixpk= 19, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  68,  69,1252,1253,1252,1253,
 igr2=  93,  98,
 &end
#
#   76 ARG  HD-           7 TYR  HE          5.50    (#     20:60  Unique         2.03, 5.36 A)
 &rst
  ixpk= 20, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:21       7 TYR  HE          5.50    (#     21:60  Single Ambig)
 &rst
  ixpk= 21, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1249,1250,1249,1250,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:22       7 TYR  HE          4.50    (#     22:60  Single Ambig)
 &rst
  ixpk= 22, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1198,1199,1246,1247,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:23       7 TYR  HE          4.50    (#     23:60  Single Ambig)
 &rst
  ixpk= 23, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1198,1199,1246,1247,
 igr2=  93,  98,
 &end
#
#    0 AMB  60-2:24       7 TYR  HE          4.50    (#     24:60  Single Ambig)
 &rst
  ixpk= 24, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1522,1523,1525,1526,1527,
 igr2=  93,  98,
 &end
#
#   24 TRP  HE1          24 TRP  HD1         4.50    (#     25:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 25, nxpk= 60, iat= 366, 364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 TYR  HE           24 TRP  HD1         4.50    (#     27:60  Unique         2.16, 6.43 A)
 &rst
  ixpk= 27, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2144,2149,
 &end
#
#   24 TRP  HB+          24 TRP  HD1         5.50    (#     28:60  Unique         2.55, 3.02 A)
 &rst
  ixpk= 28, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   24 TRP  HB-          24 TRP  HD1         5.50    (#     29:60  Unique         2.55, 3.02 A)
 &rst
  ixpk= 29, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#    0 AMB  60-2:30      24 TRP  HD1         5.50    (#     30:60  Single Ambig)
 &rst
  ixpk= 30, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2021,2022, 514, 515,
 &end
#
#  127 VAL  MGX          24 TRP  HD1         5.50    (#     31:60  Unique         2.31, 4.45 A)
 &rst
  ixpk= 31, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY          24 TRP  HD1         4.50    (#     32:60  Unique         2.31, 4.45 A)
 &rst
  ixpk= 32, nxpk= 60, iat=  -1, 364, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HE1         131 TYR  HE          4.50    (#     33:60  Unique         2.30, 5.75 A)
 &rst
  ixpk= 33, nxpk= 60, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2144,2149,
 &end
#
#  135 GLN  HE2-        131 TYR  HE          4.50    (#     34:60  Unique         2.24, 5.17 A)
 &rst
  ixpk= 34, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2221,2222,
 igr2=2144,2149,
 &end
#
#  135 GLN  HE2+        131 TYR  HE          5.50    (#     35:60  Unique         2.24, 5.17 A)
 &rst
  ixpk= 35, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2221,2222,
 igr2=2144,2149,
 &end
#
#    0 AMB  60-2:36     131 TYR  HE          2.80    (#     36:60  Single Ambig)
 &rst
  ixpk= 36, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 364,2142,2151,
 igr2=2144,2149,
 &end
#
#    0 AMB  60-2:37     131 TYR  HE          5.50    (#     37:60  Single Ambig)
 &rst
  ixpk= 37, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2138,2139,2024,2025,
 igr2=2144,2149,
 &end
#
#  127 VAL  HB          131 TYR  HE          5.50    (#     38:60  Unique         3.25, 5.06 A)
 &rst
  ixpk= 38, nxpk= 60, iat=2066,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2144,2149,
 &end
#
#  135 GLN  HG+         131 TYR  HE          5.50    (#     39:60  Unique         1.95, 4.52 A)
 &rst
  ixpk= 39, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2216,2217,
 igr2=2144,2149,
 &end
#
#  135 GLN  HG-         131 TYR  HE          5.50    (#     40:60  Unique         1.95, 4.52 A)
 &rst
  ixpk= 40, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2216,2217,
 igr2=2144,2149,
 &end
#
#  127 VAL  MGX         131 TYR  HE          4.50    (#     41:60  Unique         2.01, 5.65 A)
 &rst
  ixpk= 41, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2144,2149,
 &end
#
#  127 VAL  MGY         131 TYR  HE          4.50    (#     42:60  Unique         2.01, 5.65 A)
 &rst
  ixpk= 42, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2144,2149,
 &end
#
#   28 PHE  HE           28 PHE  HD          2.80    (#     44:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 44, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 448, 452,
 igr2= 446, 454,
 &end
#
#  122 ASP  HA           28 PHE  HD          5.50    (#     45:60  Unique         3.77, 6.22 A)
 &rst
  ixpk= 45, nxpk= 60, iat=1973,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 446, 454,
 &end
#
#    0 AMB  60-2:46       0 AMB  60-1:46     5.50    (#     46:60  Double Ambig)
 &rst
  ixpk= 46, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 440, 861,
 igr2= 446, 454, 847, 855,
 &end
#
#    0 AMB  60-2:47      28 PHE  HD          5.50    (#     47:60  Single Ambig)
 &rst
  ixpk= 47, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 442, 443,1923,1924,
 igr2= 446, 454,
 &end
#
#   28 PHE  HB-          28 PHE  HD          4.50    (#     48:60  Unique         2.29, 3.04 A)
 &rst
  ixpk= 48, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 442, 443,
 igr2= 446, 454,
 &end
#
#    0 AMB  60-2:49      31 HIS  HD2         4.50    (#     49:60  Single Ambig)
 &rst
  ixpk= 49, nxpk= 60, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 482, 458,
 &end
#
#   30 GLN  HN           31 HIS  HD2         5.50    (#     50:60  Unique         2.74, 4.04 A)
 &rst
  ixpk= 50, nxpk= 60, iat= 465, 495, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HA           31 HIS  HD2         4.50    (#     51:60  Unique         2.40, 2.82 A)
 &rst
  ixpk= 51, nxpk= 60, iat= 484, 495, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 HIS  HB+          31 HIS  HD2         5.50    (#     54:60  Unique         2.98, 3.61 A)
 &rst
  ixpk= 54, nxpk= 60, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#    0 AMB  60-2:55      31 HIS  HD2         5.50    (#     55:60  Single Ambig)
 &rst
  ixpk= 55, nxpk= 60, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 460, 461, 486, 487,
 &end
#
#    0 AMB  60-2:56      31 HIS  HD2         5.50    (#     56:60  Single Ambig)
 &rst
  ixpk= 56, nxpk= 60, iat=  -1, 495, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 472, 473, 472, 473,
 &end
#
#   33 TRP  HE1          33 TRP  HD1         3.50    (#     58:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 58, nxpk= 60, iat= 520, 518, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   33 TRP  HN           33 TRP  HD1         5.50    (#     59:60  Unique         1.93, 2.58 A)
 &rst
  ixpk= 59, nxpk= 60, iat= 510, 518, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HB+          33 TRP  HD1         5.50    (#     62:60  Unique         2.56, 3.28 A)
 &rst
  ixpk= 62, nxpk= 60, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#   33 TRP  HB-          33 TRP  HD1         5.50    (#     63:60  Unique         2.56, 3.28 A)
 &rst
  ixpk= 63, nxpk= 60, iat=  -1, 518, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#   33 TRP  HE1          33 TRP  HZ2         4.50    (#     64:60  Unique         2.82, 2.82 A)
 &rst
  ixpk= 64, nxpk= 60, iat= 520, 523, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 TRP  HH2          33 TRP  HZ2         3.50    (#     65:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 65, nxpk= 60, iat= 525, 523, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   26 ARG  HG-          33 TRP  HZ2         5.50    (#     70:60  Unique         4.24, 5.69 A)
 &rst
  ixpk= 70, nxpk= 60, iat=  -1, 523, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   33 TRP  HZ2          33 TRP  HH2         4.50    (#     71:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 71, nxpk= 60, iat= 523, 525, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  125 ARG  HD-          33 TRP  HH2         5.50    (#     72:60  Unique         2.12, 5.17 A)
 &rst
  ixpk= 72, nxpk= 60, iat=  -1, 525, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2024,2025,
 &end
#
#   25 ALA  HA           33 TRP  HH2         5.50    (#     73:60  Unique         3.77, 4.35 A)
 &rst
  ixpk= 73, nxpk= 60, iat= 382, 525, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HE           55 PHE  HD          2.80    (#     74:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 74, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 849, 853,
 igr2= 847, 855,
 &end
#
#    0 AMB  60-2:75       0 AMB  60-1:75     4.50    (#     75:60  Double Ambig)
 &rst
  ixpk= 75, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 841,1910,
 igr2= 847, 855, 446, 454,
 &end
#
#   55 PHE  HB+          55 PHE  HD          4.50    (#     76:60  Unique         2.29, 3.04 A)
 &rst
  ixpk= 76, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 843, 844,
 igr2= 847, 855,
 &end
#
#    0 AMB  60-2:77       0 AMB  60-1:77     4.50    (#     77:60  Double Ambig)
 &rst
  ixpk= 77, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 843, 844,1975,1976,
 igr2= 847, 855, 446, 454,
 &end
#
#   56 GLU  HG+          55 PHE  HD          4.50    (#     78:60  Unique         1.98, 4.84 A)
 &rst
  ixpk= 78, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 866, 867,
 igr2= 847, 855,
 &end
#
#   56 GLU  HG-          55 PHE  HD          5.50    (#     79:60  Unique         1.98, 4.84 A)
 &rst
  ixpk= 79, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867,
 igr2= 847, 855,
 &end
#
#  115 THR  MG2          55 PHE  HD          5.50    (#     80:60  Unique         3.06, 6.49 A)
 &rst
  ixpk= 80, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2= 847, 855,
 &end
#
#   28 PHE  HD           28 PHE  HE          2.80    (#     81:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 81, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 446, 454,
 igr2= 448, 452,
 &end
#
#  119 PRO  HD-          28 PHE  HE          5.50    (#     83:60  Unique         1.96, 5.69 A)
 &rst
  ixpk= 83, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1923,1924,
 igr2= 448, 452,
 &end
#
#    0 AMB  60-2:84      28 PHE  HE          5.50    (#     84:60  Single Ambig)
 &rst
  ixpk= 84, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1859,1860,1862,1863,1862,1863,
 igr2= 448, 452,
 &end
#
#   55 PHE  HD           55 PHE  HE          2.80    (#     85:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 85, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 847, 855,
 igr2= 849, 853,
 &end
#
#  115 THR  HB           55 PHE  HE          5.50    (#     86:60  Unique         2.23, 8.73 A)
 &rst
  ixpk= 86, nxpk= 60, iat=1876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 849, 853,
 &end
#
#   56 GLU  HG-          55 PHE  HE          5.50    (#     87:60  Unique         2.11, 5.47 A)
 &rst
  ixpk= 87, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867,
 igr2= 849, 853,
 &end
#
#   51 TYR  HN           51 TYR  HD          4.50    (#     88:60  Unique         1.84, 3.30 A)
 &rst
  ixpk= 88, nxpk= 60, iat= 765,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 773, 782,
 &end
#
#   51 TYR  HE           51 TYR  HD          3.50    (#     89:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 89, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 775, 780,
 igr2= 773, 782,
 &end
#
#    0 AMB  60-2:90       0 AMB  60-1:90     4.50    (#     90:60  Double Ambig)
 &rst
  ixpk= 90, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 767,2291,
 igr2= 773, 782,1226,1235,
 &end
#
#   51 TYR  HB+          51 TYR  HD          4.50    (#     91:60  Unique         2.30, 3.05 A)
 &rst
  ixpk= 91, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 769, 770,
 igr2= 773, 782,
 &end
#
#    0 AMB  60-2:92      51 TYR  HD          4.50    (#     92:60  Single Ambig)
 &rst
  ixpk= 92, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 769, 770, 952, 953, 952, 953,
 igr2= 773, 782,
 &end
#
#   54 LEU  MDX          51 TYR  HD          5.50    (#     93:60  Unique         1.98, 5.94 A)
 &rst
  ixpk= 93, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 829, 830, 831, 833, 834, 835,
 igr2= 773, 782,
 &end
#
#    0 AMB  60-2:94       0 AMB  60-1:94     5.50    (#     94:60  Double Ambig)
 &rst
  ixpk= 94, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.63, r4=11.13,
 igr1= 759, 760, 761,2296,2297,2296,2297, 921, 922, 923,
       925, 926, 927,
 igr2= 773, 782,1226,1235,
 &end
#
#   62 ARG  HN           51 TYR  HE          5.50    (#     96:60  Unique         3.84, 5.33 A)
 &rst
  ixpk= 96, nxpk= 60, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 775, 780,
 &end
#
#   51 TYR  HN           51 TYR  HE          5.50    (#     97:60  Unique         3.91, 4.93 A)
 &rst
  ixpk= 97, nxpk= 60, iat= 765,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 775, 780,
 &end
#
#   51 TYR  HD           51 TYR  HE          2.80    (#     98:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 98, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 773, 782,
 igr2= 775, 780,
 &end
#
#    0 AMB  60-2:100     51 TYR  HE          4.50    (#    100:60  Single Ambig)
 &rst
  ixpk= 100, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 767,1042, 740,
 igr2= 775, 780,
 &end
#
#   62 ARG  HA           51 TYR  HE          4.50    (#    101:60  Unique         2.16, 3.97 A)
 &rst
  ixpk= 101, nxpk= 60, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 775, 780,
 &end
#
#   51 TYR  HB+          51 TYR  HE          5.50    (#    102:60  Unique         4.61, 5.05 A)
 &rst
  ixpk= 102, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 769, 770,
 igr2= 775, 780,
 &end
#
#    0 AMB  60-2:103     51 TYR  HE          5.50    (#    103:60  Single Ambig)
 &rst
  ixpk= 103, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 952, 953, 952, 953,
 igr2= 775, 780,
 &end
#
#   47 GLU  HG+          51 TYR  HE          4.50    (#    104:60  Unique         1.98, 4.67 A)
 &rst
  ixpk= 104, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 713, 714,
 igr2= 775, 780,
 &end
#
#   62 ARG  HB+          51 TYR  HE          5.50    (#    105:60  Unique         2.88, 3.98 A)
 &rst
  ixpk= 105, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 946, 947,
 igr2= 775, 780,
 &end
#
#   62 ARG  HG+          51 TYR  HE          5.50    (#    106:60  Unique         3.95, 5.73 A)
 &rst
  ixpk= 106, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 949, 950,
 igr2= 775, 780,
 &end
#
#   54 LEU  MDX          51 TYR  HE          3.50    (#    107:60  Unique         3.40, 7.19 A)
 &rst
  ixpk= 107, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 829, 830, 831, 833, 834, 835,
 igr2= 775, 780,
 &end
#
#   65 VAL  MGX          51 TYR  HE          3.50    (#    108:60  Unique         1.94, 5.73 A)
 &rst
  ixpk= 108, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1006,1007,1008,1010,1011,1012,
 igr2= 775, 780,
 &end
#
#   50 MET  ME           51 TYR  HE          4.50    (#    109:60  Unique         2.50, 4.48 A)
 &rst
  ixpk= 109, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 759, 760, 761,
 igr2= 775, 780,
 &end
#
#   61 SER  HA           55 PHE  HD          5.50    (#    110:60  Unique         2.14, 5.24 A)
 &rst
  ixpk= 110, nxpk= 60, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 847, 855,
 &end
#
#   74 TRP  HE1          74 TRP  HD1         2.80    (#    111:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 111, nxpk= 60, iat=1161,1159, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 TRP  HN           74 TRP  HD1         4.50    (#    112:60  Unique         1.97, 2.52 A)
 &rst
  ixpk= 112, nxpk= 60, iat=1151,1159, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 ASN  HA           74 TRP  HD1         5.50    (#    113:60  Unique         2.38, 3.86 A)
 &rst
  ixpk= 113, nxpk= 60, iat=1139,1159, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  60-2:114     74 TRP  HD1         5.50    (#    114:60  Single Ambig)
 &rst
  ixpk= 114, nxpk= 60, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1153,1103,
 &end
#
#   74 TRP  HB-          74 TRP  HD1         5.50    (#    115:60  Unique         2.61, 3.26 A)
 &rst
  ixpk= 115, nxpk= 60, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#    0 AMB  60-2:116     74 TRP  HD1         4.50    (#    116:60  Single Ambig)
 &rst
  ixpk= 116, nxpk= 60, iat=  -1,1159, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1141,1142,1155,1156,
 &end
#
#  130 TRP  HH2         130 TRP  HZ2         2.80    (#    118:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 118, nxpk= 60, iat=2125,2123, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  60-2:119    130 TRP  HZ2         5.50    (#    119:60  Single Ambig)
 &rst
  ixpk= 119, nxpk= 60, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2097,2106,2099,2104,
 &end
#
#  108 ASP  HA          126 TRP  HZ2         5.50    (#    120:60  Unique         1.99, 2.87 A)
 &rst
  ixpk= 120, nxpk= 60, iat=1770,2051, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  QD1         126 TRP  HZ2         5.50    (#    121:60  Unique         1.98, 3.19 A)
 &rst
  ixpk= 121, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  104 LEU  MDY         126 TRP  HZ2         3.50    (#    122:60  Unique         2.19, 4.91 A)
 &rst
  ixpk= 122, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  152 ALA  MB          130 TRP  HZ2         4.50    (#    123:60  Unique         1.98, 3.05 A)
 &rst
  ixpk= 123, nxpk= 60, iat=  -1,2123, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2526,2527,2528,
 &end
#
#    0 AMB  60-2:124      0 AMB  60-1:124    5.50    (#    124:60  Double Ambig)
 &rst
  ixpk= 124, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1722,2472,2473,
 igr2=2051,2123,
 &end
#
#   40 ILE  QD1          74 TRP  HH2         3.50    (#    126:60  Unique         2.00, 3.04 A)
 &rst
  ixpk= 126, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 629, 630, 631,
 &end
#
#   40 ILE  HG1-         74 TRP  HH2         5.50    (#    127:60  Unique         2.84, 3.97 A)
 &rst
  ixpk= 127, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  60-2:128     74 TRP  HH2         5.50    (#    128:60  Single Ambig)
 &rst
  ixpk= 128, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 755, 756, 752, 753,
 &end
#
#   96 LYS  HE-          74 TRP  HH2         4.50    (#    129:60  Unique         3.39, 4.77 A)
 &rst
  ixpk= 129, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1568,1569,
 &end
#
#    0 AMB  60-2:130     74 TRP  HH2         5.50    (#    130:60  Single Ambig)
 &rst
  ixpk= 130, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 160, 135, 136, 710, 711,
 &end
#
#   96 LYS  HE+          74 TRP  HH2         5.50    (#    131:60  Unique         3.39, 4.77 A)
 &rst
  ixpk= 131, nxpk= 60, iat=  -1,1166, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1568,1569,
 &end
#
#   74 TRP  HZ2          74 TRP  HH2         2.80    (#    133:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 133, nxpk= 60, iat=1164,1166, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   78 LYS  HN           77 TYR  HD          4.50    (#    134:60  Unique         3.09, 4.33 A)
 &rst
  ixpk= 134, nxpk= 60, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1226,1235,
 &end
#
#   77 TYR  HN           77 TYR  HD          4.50    (#    135:60  Unique         2.42, 3.79 A)
 &rst
  ixpk= 135, nxpk= 60, iat=1218,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1226,1235,
 &end
#
#  139 PHE  HE           77 TYR  HD          4.50    (#    137:60  Unique         1.96, 5.73 A)
 &rst
  ixpk= 137, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2279,2283,
 igr2=1226,1235,
 &end
#
#    0 AMB  60-2:138     77 TYR  HD          4.50    (#    138:60  Single Ambig)
 &rst
  ixpk= 138, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2277,2285,1589,1590,
 igr2=1226,1235,
 &end
#
#    0 AMB  60-2:139      0 AMB  60-1:139    2.80    (#    139:60  Double Ambig)
 &rst
  ixpk= 139, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1228,1233, 955,
 igr2=1226,1235, 773, 782,
 &end
#
#   77 TYR  HA           77 TYR  HD          4.50    (#    140:60  Unique         3.81, 4.17 A)
 &rst
  ixpk= 140, nxpk= 60, iat=1220,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1226,1235,
 &end
#
#   77 TYR  HB+          77 TYR  HD          3.50    (#    141:60  Unique         2.30, 3.05 A)
 &rst
  ixpk= 141, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1222,1223,
 igr2=1226,1235,
 &end
#
#   77 TYR  HB-          77 TYR  HD          3.50    (#    142:60  Unique         2.30, 3.05 A)
 &rst
  ixpk= 142, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1222,1223,
 igr2=1226,1235,
 &end
#
#    0 AMB  60-2:143      0 AMB  60-1:143    4.50    (#    143:60  Double Ambig)
 &rst
  ixpk= 143, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2351, 713, 714,
 igr2=1226,1235, 773, 782,
 &end
#
#    0 AMB  60-2:144      0 AMB  60-1:144    5.50    (#    144:60  Double Ambig)
 &rst
  ixpk= 144, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 824, 825,1542,1543,1004,
 igr2= 773, 782,1226,1235,
 &end
#
#    0 AMB  60-2:145      0 AMB  60-1:145    5.50    (#    145:60  Double Ambig)
 &rst
  ixpk= 145, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=1179,1180,1243,1244, 790, 791,1249,1250,
 igr2=1226,1235, 773, 782,
 &end
#
#    0 AMB  60-2:146      0 AMB  60-1:146    5.50    (#    146:60  Double Ambig)
 &rst
  ixpk= 146, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 946, 947,1201,1202,
 igr2= 773, 782,1226,1235,
 &end
#
#    0 AMB  60-2:147      0 AMB  60-1:147    5.50    (#    147:60  Double Ambig)
 &rst
  ixpk= 147, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 824, 825,1542,1543,
 igr2= 773, 782,1226,1235,
 &end
#
#    0 AMB  60-2:148     77 TYR  HD          3.50    (#    148:60  Single Ambig)
 &rst
  ixpk= 148, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1226,1235,
 &end
#
#    0 AMB  60-2:149      0 AMB  60-1:149    4.50    (#    149:60  Double Ambig)
 &rst
  ixpk= 149, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1270,1271,1272,1274,1275,1276,1006,1007,1008,1010,
      1011,1012,1006,1007,1008,1010,1011,1012,
 igr2=1226,1235, 773, 782,
 &end
#
#  139 PHE  HE           77 TYR  HE          4.50    (#    150:60  Unique         2.05, 5.52 A)
 &rst
  ixpk= 150, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2279,2283,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:151     77 TYR  HE          4.50    (#    151:60  Single Ambig)
 &rst
  ixpk= 151, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1589,1590,2277,2285,
 igr2=1228,1233,
 &end
#
#   77 TYR  HD           77 TYR  HE          2.80    (#    152:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 152, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1226,1235,
 igr2=1228,1233,
 &end
#
#   97 GLN  HE2-         77 TYR  HE          5.50    (#    153:60  Unique         1.91, 4.87 A)
 &rst
  ixpk= 153, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1589,1590,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:154     77 TYR  HE          5.50    (#    154:60  Single Ambig)
 &rst
  ixpk= 154, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2418,2419,2418,2419,2367,2368,
 igr2=1228,1233,
 &end
#
#   80 PRO  HD-          77 TYR  HE          5.50    (#    156:60  Unique         3.73, 7.31 A)
 &rst
  ixpk= 156, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:157     77 TYR  HE          5.50    (#    157:60  Single Ambig)
 &rst
  ixpk= 157, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2351,1545,1546,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:158     77 TYR  HE          5.50    (#    158:60  Single Ambig)
 &rst
  ixpk= 158, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1542,1543,1179,1180,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:159     77 TYR  HE          5.50    (#    159:60  Single Ambig)
 &rst
  ixpk= 159, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2299,2300,1542,1543,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:160     77 TYR  HE          5.50    (#    160:60  Single Ambig)
 &rst
  ixpk= 160, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2299,2300,1268,
 igr2=1228,1233,
 &end
#
#    0 AMB  60-2:161     77 TYR  HE          4.50    (#    161:60  Single Ambig)
 &rst
  ixpk= 161, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,1265,1266,
 igr2=1228,1233,
 &end
#
#   79 LEU  MDY          77 TYR  HE          4.50    (#    162:60  Unique         1.97, 5.75 A)
 &rst
  ixpk= 162, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1228,1233,
 &end
#
#   84 VAL  MGX          86 TRP  HD1         4.50    (#    163:60  Unique         2.46, 4.83 A)
 &rst
  ixpk= 163, nxpk= 60, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          86 TRP  HD1         5.50    (#    164:60  Unique         4.08, 6.49 A)
 &rst
  ixpk= 164, nxpk= 60, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  HB           86 TRP  HD1         5.50    (#    166:60  Unique         2.56, 3.22 A)
 &rst
  ixpk= 166, nxpk= 60, iat=1363,1407, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  60-2:167     86 TRP  HD1         3.50    (#    167:60  Single Ambig)
 &rst
  ixpk= 167, nxpk= 60, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1403,1404,1307,1308,1307,1308,
 &end
#
#   86 TRP  HB+          86 TRP  HD1         4.50    (#    168:60  Unique         2.57, 3.29 A)
 &rst
  ixpk= 168, nxpk= 60, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1403,1404,
 &end
#
#    0 AMB  60-2:169     86 TRP  HD1         5.50    (#    169:60  Single Ambig)
 &rst
  ixpk= 169, nxpk= 60, iat=  -1,1407, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1401,1318,
 &end
#
#   85 ARG  HA           86 TRP  HD1         5.50    (#    170:60  Unique         2.83, 3.33 A)
 &rst
  ixpk= 170, nxpk= 60, iat=1377,1407, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HN           86 TRP  HD1         3.50    (#    171:60  Unique         2.10, 3.16 A)
 &rst
  ixpk= 171, nxpk= 60, iat=1399,1407, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 ARG  HN           86 TRP  HD1         5.50    (#    172:60  Unique         3.45, 4.13 A)
 &rst
  ixpk= 172, nxpk= 60, iat=1375,1407, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HN           86 TRP  HD1         5.50    (#    173:60  Unique         4.98, 5.32 A)
 &rst
  ixpk= 173, nxpk= 60, iat=1423,1407, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HE1          86 TRP  HD1         2.80    (#    174:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 174, nxpk= 60, iat=1409,1407, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   86 TRP  HE3          86 TRP  HZ3         3.50    (#    197:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 197, nxpk= 60, iat=1418,1416, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  60-2:199     86 TRP  HZ3         5.50    (#    199:60  Single Ambig)
 &rst
  ixpk= 199, nxpk= 60, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1307,1308,1307,1308,
 &end
#
#   91 VAL  MGX          86 TRP  HZ3         5.50    (#    200:60  Unique         1.98, 4.15 A)
 &rst
  ixpk= 200, nxpk= 60, iat=  -1,1416, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  MGX          86 TRP  HE3         5.50    (#    202:60  Unique         1.99, 3.63 A)
 &rst
  ixpk= 202, nxpk= 60, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  MGY          86 TRP  HE3         5.50    (#    203:60  Unique         1.99, 3.63 A)
 &rst
  ixpk= 203, nxpk= 60, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HB-          86 TRP  HE3         5.50    (#    204:60  Unique         2.42, 3.28 A)
 &rst
  ixpk= 204, nxpk= 60, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1403,1404,
 &end
#
#   86 TRP  HB+          86 TRP  HE3         5.50    (#    205:60  Unique         2.42, 3.28 A)
 &rst
  ixpk= 205, nxpk= 60, iat=  -1,1418, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1403,1404,
 &end
#
#   86 TRP  HA           86 TRP  HE3         5.50    (#    206:60  Unique         2.59, 3.38 A)
 &rst
  ixpk= 206, nxpk= 60, iat=1401,1418, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HZ3          86 TRP  HE3         4.50    (#    207:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 207, nxpk= 60, iat=1416,1418, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HE1          99 TRP  HD1         4.50    (#    208:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 208, nxpk= 60, iat=1626,1624, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HN           99 TRP  HD1         5.50    (#    210:60  Unique         1.93, 2.17 A)
 &rst
  ixpk= 210, nxpk= 60, iat=1616,1624, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HA           99 TRP  HD1         5.50    (#    211:60  Unique         2.77, 3.42 A)
 &rst
  ixpk= 211, nxpk= 60, iat=1596,1624, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HB-          99 TRP  HD1         4.50    (#    213:60  Unique         2.58, 5.21 A)
 &rst
  ixpk= 213, nxpk= 60, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#   75 LEU  MDX          99 TRP  HD1         4.50    (#    214:60  Unique         1.99, 4.97 A)
 &rst
  ixpk= 214, nxpk= 60, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1184,1185,1186,1188,1189,1190,
 &end
#
#   71 THR  MG2          99 TRP  HD1         5.50    (#    215:60  Unique         2.08, 4.37 A)
 &rst
  ixpk= 215, nxpk= 60, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1105,1106,1107,
 &end
#
#  147 VAL  MGY          99 TRP  HD1         5.50    (#    216:60  Unique         3.06, 5.49 A)
 &rst
  ixpk= 216, nxpk= 60, iat=  -1,1624, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  100 PHE  HN           99 TRP  HE3         5.50    (#    217:60  Unique         4.41, 4.83 A)
 &rst
  ixpk= 217, nxpk= 60, iat=1640,1635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HD           99 TRP  HE3         5.50    (#    218:60  Unique         4.98, 6.29 A)
 &rst
  ixpk= 218, nxpk= 60, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#   99 TRP  HB+          99 TRP  HE3         5.50    (#    219:60  Unique         2.40, 3.21 A)
 &rst
  ixpk= 219, nxpk= 60, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#   99 TRP  HB-          99 TRP  HE3         5.50    (#    220:60  Unique         2.40, 3.21 A)
 &rst
  ixpk= 220, nxpk= 60, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#   14 VAL  MGX          99 TRP  HE3         4.50    (#    221:60  Unique         1.97, 3.60 A)
 &rst
  ixpk= 221, nxpk= 60, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#  147 VAL  MGX          99 TRP  HE3         5.50    (#    222:60  Unique         1.99, 3.52 A)
 &rst
  ixpk= 222, nxpk= 60, iat=  -1,1635, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  126 TRP  HE1         126 TRP  HD1         2.80    (#    223:60  Unique         2.57, 2.57 A)
 &rst
  ixpk= 223, nxpk= 60, iat=2048,2046, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  126 TRP  HN          126 TRP  HD1         4.50    (#    224:60  Unique         2.34, 3.58 A)
 &rst
  ixpk= 224, nxpk= 60, iat=2038,2046, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  60-2:228    126 TRP  HD1         3.50    (#    228:60  Single Ambig)
 &rst
  ixpk= 228, nxpk= 60, iat=  -1,2046, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2042,2043,2042,2043, 248, 249,
 &end
#
#  126 TRP  HE1         126 TRP  HZ2         4.50    (#    230:60  Unique         2.82, 2.82 A)
 &rst
  ixpk= 230, nxpk= 60, iat=2048,2051, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 ASP  HN          126 TRP  HZ2         5.50    (#    231:60  Unique         3.00, 3.44 A)
 &rst
  ixpk= 231, nxpk= 60, iat=1768,2051, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HD2+        126 TRP  HZ2         5.50    (#    232:60  Unique         3.06, 4.58 A)
 &rst
  ixpk= 232, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#  126 TRP  HD1         126 TRP  HZ2         5.50    (#    233:60  Unique         5.04, 5.04 A)
 &rst
  ixpk= 233, nxpk= 60, iat=2046,2051, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  60-2:234    126 TRP  HZ2         5.50    (#    234:60  Single Ambig)
 &rst
  ixpk= 234, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1772,1773,1772,1773,
 &end
#
#   15 ILE  QG2         126 TRP  HZ2         5.50    (#    235:60  Unique         4.74, 6.35 A)
 &rst
  ixpk= 235, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 220, 221, 222,
 &end
#
#  111 ILE  QD1         126 TRP  HZ2         5.50    (#    236:60  Unique         1.98, 3.19 A)
 &rst
  ixpk= 236, nxpk= 60, iat=  -1,2051, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  126 TRP  HE1         126 TRP  HH2         5.50    (#    237:60  Unique         4.96, 4.97 A)
 &rst
  ixpk= 237, nxpk= 60, iat=2048,2053, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  60-2:240    126 TRP  HH2         5.50    (#    240:60  Single Ambig)
 &rst
  ixpk= 240, nxpk= 60, iat=  -1,2053, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1772,1773,1772,1773,
 &end
#
#  111 ILE  QD1         126 TRP  HH2         5.50    (#    242:60  Unique         1.99, 2.88 A)
 &rst
  ixpk= 242, nxpk= 60, iat=  -1,2053, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QG2         126 TRP  HH2         5.50    (#    243:60  Unique         1.98, 4.25 A)
 &rst
  ixpk= 243, nxpk= 60, iat=  -1,2053, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#    0 AMB  60-2:244    129 TYR  HD          5.50    (#    244:60  Single Ambig)
 &rst
  ixpk= 244, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2089,2575,
 igr2=2097,2106,
 &end
#
#  130 TRP  HN          129 TYR  HD          5.50    (#    245:60  Unique         1.76, 4.62 A)
 &rst
  ixpk= 245, nxpk= 60, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2097,2106,
 &end
#
#  129 TYR  HA          129 TYR  HD          5.50    (#    246:60  Unique         1.85, 3.28 A)
 &rst
  ixpk= 246, nxpk= 60, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2097,2106,
 &end
#
#  129 TYR  HB+         129 TYR  HD          5.50    (#    247:60  Unique         2.30, 3.06 A)
 &rst
  ixpk= 247, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2093,2094,
 igr2=2097,2106,
 &end
#
#    0 AMB  60-2:248    129 TYR  HD          5.50    (#    248:60  Single Ambig)
 &rst
  ixpk= 248, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2093,2094,2455,2456,2582,2583,
 igr2=2097,2106,
 &end
#
#  152 ALA  MB          129 TYR  HD          5.50    (#    249:60  Unique         2.24, 5.82 A)
 &rst
  ixpk= 249, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2526,2527,2528,
 igr2=2097,2106,
 &end
#
#  148 MET  ME          129 TYR  HD          5.50    (#    250:60  Unique         2.04, 5.53 A)
 &rst
  ixpk= 250, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2459,2460,2461,
 igr2=2097,2106,
 &end
#
#  155 VAL  MGY         129 TYR  HD          5.50    (#    251:60  Unique         2.16, 5.95 A)
 &rst
  ixpk= 251, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2=2097,2106,
 &end
#
#   22 VAL  MGY         129 TYR  HD          4.50    (#    252:60  Unique         1.98, 6.04 A)
 &rst
  ixpk= 252, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2097,2106,
 &end
#
#  130 TRP  HN          130 TRP  HD1         4.50    (#    254:60  Unique         2.37, 3.60 A)
 &rst
  ixpk= 254, nxpk= 60, iat=2110,2118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 TYR  HD          130 TRP  HD1         5.50    (#    255:60  Unique         3.59, 5.84 A)
 &rst
  ixpk= 255, nxpk= 60, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2097,2106,
 &end
#
#  130 TRP  HB+         130 TRP  HD1         5.50    (#    256:60  Unique         2.55, 3.16 A)
 &rst
  ixpk= 256, nxpk= 60, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2114,2115,
 &end
#
#  130 TRP  HB-         130 TRP  HD1         3.50    (#    257:60  Unique         2.55, 3.16 A)
 &rst
  ixpk= 257, nxpk= 60, iat=  -1,2118, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2114,2115,
 &end
#
#    0 AMB  60-2:258      0 AMB  60-1:258    5.50    (#    258:60  Double Ambig)
 &rst
  ixpk= 258, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=2469,2470,1719,1720, 343, 344, 343, 344,1794,1795,
      
 igr2=2123,2051,
 &end
#
#  130 TRP  HE1         130 TRP  HH2         5.50    (#    259:60  Unique         4.96, 4.97 A)
 &rst
  ixpk= 259, nxpk= 60, iat=2120,2125, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HZ2         130 TRP  HH2         3.50    (#    260:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 260, nxpk= 60, iat=2123,2125, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  127 VAL  MGY         131 TYR  HD          4.50    (#    263:60  Unique         2.00, 5.07 A)
 &rst
  ixpk= 263, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2142,2151,
 &end
#
#  127 VAL  MGX         131 TYR  HD          3.50    (#    264:60  Unique         2.00, 5.07 A)
 &rst
  ixpk= 264, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2142,2151,
 &end
#
#    0 AMB  60-2:265    131 TYR  HD          5.50    (#    265:60  Single Ambig)
 &rst
  ixpk= 265, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2216,2217,2162,2163,
 igr2=2142,2151,
 &end
#
#  127 VAL  HB          131 TYR  HD          4.50    (#    266:60  Unique         2.11, 4.23 A)
 &rst
  ixpk= 266, nxpk= 60, iat=2066,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2142,2151,
 &end
#
#    0 AMB  60-2:268    131 TYR  HD          3.50    (#    268:60  Single Ambig)
 &rst
  ixpk= 268, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2138,2139,2138,2139,
 igr2=2142,2151,
 &end
#
#  132 PRO  HD-         131 TYR  HD          5.50    (#    269:60  Unique         1.93, 4.28 A)
 &rst
  ixpk= 269, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2142,2151,
 &end
#
#  132 PRO  HD+         131 TYR  HD          5.50    (#    270:60  Unique         1.93, 4.28 A)
 &rst
  ixpk= 270, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2142,2151,
 &end
#
#  131 TYR  HA          131 TYR  HD          4.50    (#    271:60  Unique         3.06, 3.66 A)
 &rst
  ixpk= 271, nxpk= 60, iat=2136,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2142,2151,
 &end
#
#  131 TYR  HE          131 TYR  HD          2.80    (#    272:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 272, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2144,2149,
 igr2=2142,2151,
 &end
#
#  131 TYR  HN          131 TYR  HD          4.50    (#    273:60  Unique         4.16, 4.66 A)
 &rst
  ixpk= 273, nxpk= 60, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2142,2151,
 &end
#
#  128 SER  HN          131 TYR  HD          5.50    (#    274:60  Unique         1.95, 4.63 A)
 &rst
  ixpk= 274, nxpk= 60, iat=2078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2142,2151,
 &end
#
#  131 TYR  HA          131 TYR  HE          5.50    (#    278:60  Unique         4.89, 5.49 A)
 &rst
  ixpk= 278, nxpk= 60, iat=2136,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2144,2149,
 &end
#
#  139 PHE  HE          139 PHE  HD          2.80    (#    279:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 279, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2279,2283,
 igr2=2277,2285,
 &end
#
#  139 PHE  HB+         139 PHE  HD          5.50    (#    281:60  Unique         2.28, 3.04 A)
 &rst
  ixpk= 281, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2273,2274,
 igr2=2277,2285,
 &end
#
#    0 AMB  60-2:282    139 PHE  HD          4.50    (#    282:60  Single Ambig)
 &rst
  ixpk= 282, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2273,2274,1222,1223,
 igr2=2277,2285,
 &end
#
#  137 VAL  MGY         139 PHE  HD          4.50    (#    283:60  Unique         1.98, 5.95 A)
 &rst
  ixpk= 283, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2277,2285,
 &end
#
#  137 VAL  MGX         139 PHE  HD          5.50    (#    284:60  Unique         1.98, 5.95 A)
 &rst
  ixpk= 284, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2277,2285,
 &end
#
#  139 PHE  HD          139 PHE  HE          2.80    (#    285:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 285, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2277,2285,
 igr2=2279,2283,
 &end
#
#  139 PHE  HB+         139 PHE  HE          5.50    (#    287:60  Unique         4.60, 5.04 A)
 &rst
  ixpk= 287, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2273,2274,
 igr2=2279,2283,
 &end
#
#   77 TYR  HB-         139 PHE  HE          5.50    (#    288:60  Unique         2.73, 6.38 A)
 &rst
  ixpk= 288, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1222,1223,
 igr2=2279,2283,
 &end
#
#    0 AMB  60-2:289    139 PHE  HE          4.50    (#    289:60  Single Ambig)
 &rst
  ixpk= 289, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,2248,2249,2250,2252,2253,2254,
 igr2=2279,2283,
 &end
#
#    0 AMB  60-2:290    139 PHE  HE          5.50    (#    290:60  Single Ambig)
 &rst
  ixpk= 290, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,
 igr2=2279,2283,
 &end
#
#  144 TYR  HN          144 TYR  HD          4.50    (#    291:60  Unique         3.45, 4.24 A)
 &rst
  ixpk= 291, nxpk= 60, iat=2363,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2371,2380,
 &end
#
#  144 TYR  HE          144 TYR  HD          3.50    (#    293:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 293, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2373,2378,
 igr2=2371,2380,
 &end
#
#  144 TYR  HA          144 TYR  HD          4.50    (#    295:60  Unique         2.24, 3.28 A)
 &rst
  ixpk= 295, nxpk= 60, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2371,2380,
 &end
#
#  144 TYR  HB+         144 TYR  HD          4.50    (#    296:60  Unique         2.30, 3.06 A)
 &rst
  ixpk= 296, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2367,2368,
 igr2=2371,2380,
 &end
#
#  144 TYR  HB-         144 TYR  HD          5.50    (#    297:60  Unique         2.30, 3.06 A)
 &rst
  ixpk= 297, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2367,2368,
 igr2=2371,2380,
 &end
#
#  148 MET  HG-         144 TYR  HD          5.50    (#    298:60  Unique         2.15, 5.63 A)
 &rst
  ixpk= 298, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2455,2456,
 igr2=2371,2380,
 &end
#
#  148 MET  ME          144 TYR  HD          5.50    (#    299:60  Unique         1.99, 5.01 A)
 &rst
  ixpk= 299, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2459,2460,2461,
 igr2=2371,2380,
 &end
#
#    0 AMB  60-2:300    144 TYR  HD          4.50    (#    300:60  Single Ambig)
 &rst
  ixpk= 300, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=2371,2380,
 &end
#
#  136 VAL  MGX         144 TYR  HD          5.50    (#    301:60  Unique         1.95, 4.75 A)
 &rst
  ixpk= 301, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2232,2233,2234,2236,2237,2238,
 igr2=2371,2380,
 &end
#
#    0 AMB  60-2:302    144 TYR  HD          4.50    (#    302:60  Single Ambig)
 &rst
  ixpk= 302, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2232,2233,2234,2236,2237,2238,2296,2297,
 igr2=2371,2380,
 &end
#
#   99 TRP  HZ2         144 TYR  HE          4.50    (#    304:60  Unique         4.44, 6.16 A)
 &rst
  ixpk= 304, nxpk= 60, iat=1629,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2373,2378,
 &end
#
#   99 TRP  HH2         144 TYR  HE          4.50    (#    305:60  Unique         2.71, 4.11 A)
 &rst
  ixpk= 305, nxpk= 60, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2373,2378,
 &end
#
#  144 TYR  HD          144 TYR  HE          3.50    (#    307:60  Unique         2.46, 3.69 A)
 &rst
  ixpk= 307, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2371,2380,
 igr2=2373,2378,
 &end
#
#  136 VAL  HA          144 TYR  HE          5.50    (#    309:60  Unique         4.99, 7.26 A)
 &rst
  ixpk= 309, nxpk= 60, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2373,2378,
 &end
#
#  144 TYR  HB+         144 TYR  HE          5.50    (#    310:60  Unique         4.61, 5.05 A)
 &rst
  ixpk= 310, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2367,2368,
 igr2=2373,2378,
 &end
#
#  144 TYR  HA          144 TYR  HE          5.50    (#    311:60  Unique         4.30, 4.96 A)
 &rst
  ixpk= 311, nxpk= 60, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2373,2378,
 &end
#
#   35 PHE  HB+         144 TYR  HE          5.50    (#    312:60  Unique         2.92, 6.16 A)
 &rst
  ixpk= 312, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 555, 556,
 igr2=2373,2378,
 &end
#
#  136 VAL  HB          144 TYR  HE          5.50    (#    313:60  Unique         3.18, 5.74 A)
 &rst
  ixpk= 313, nxpk= 60, iat=2230,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2373,2378,
 &end
#
#    0 AMB  60-2:314    144 TYR  HE          5.50    (#    314:60  Single Ambig)
 &rst
  ixpk= 314, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2299,2300,2216,2217,2318,2319,
 igr2=2373,2378,
 &end
#
#    0 AMB  60-2:315    144 TYR  HE          5.50    (#    315:60  Single Ambig)
 &rst
  ixpk= 315, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=2373,2378,
 &end
#
#  136 VAL  MGX         144 TYR  HE          5.50    (#    316:60  Unique         2.14, 5.48 A)
 &rst
  ixpk= 316, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2232,2233,2234,2236,2237,2238,
 igr2=2373,2378,
 &end
#
#  136 VAL  MGY         144 TYR  HE          4.50    (#    317:60  Unique         2.14, 5.48 A)
 &rst
  ixpk= 317, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2232,2233,2234,2236,2237,2238,
 igr2=2373,2378,
 &end
#
#   24 TRP  HE1          24 TRP  HZ2         5.50    (#    318:60  Unique         2.82, 2.82 A)
 &rst
  ixpk= 318, nxpk= 60, iat= 366, 369, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HH2          24 TRP  HZ2         4.50    (#    319:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 319, nxpk= 60, iat= 371, 369, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 GLN  HB+          24 TRP  HZ2         5.50    (#    320:60  Unique         1.99, 3.35 A)
 &rst
  ixpk= 320, nxpk= 60, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2213,2214,
 &end
#
#   33 TRP  HB-          24 TRP  HZ2         4.50    (#    321:60  Unique         2.40, 3.59 A)
 &rst
  ixpk= 321, nxpk= 60, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 514, 515,
 &end
#
#   99 TRP  HE1          99 TRP  HZ2         5.50    (#    328:60  Unique         2.82, 2.82 A)
 &rst
  ixpk= 328, nxpk= 60, iat=1626,1629, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HH2          99 TRP  HZ2         5.50    (#    329:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 329, nxpk= 60, iat=1631,1629, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HE           99 TRP  HZ2         5.50    (#    330:60  Unique         4.44, 6.16 A)
 &rst
  ixpk= 330, nxpk= 60, iat=  -1,1629, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2373,2378,
 &end
#
#    0 AMB  60-2:331     99 TRP  HZ2         5.50    (#    331:60  Single Ambig)
 &rst
  ixpk= 331, nxpk= 60, iat=  -1,1629, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2371,2380,1624,
 &end
#
#    0 AMB  60-2:333     99 TRP  HZ2         5.50    (#    333:60  Single Ambig)
 &rst
  ixpk= 333, nxpk= 60, iat=  -1,1629, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#   99 TRP  HZ2          99 TRP  HH2         4.50    (#    334:60  Unique         2.46, 2.46 A)
 &rst
  ixpk= 334, nxpk= 60, iat=1629,1631, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  60-2:336     99 TRP  HH2         5.50    (#    336:60  Single Ambig)
 &rst
  ixpk= 336, nxpk= 60, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1589,1590,1635,
 &end
#
#    0 AMB  60-2:337     99 TRP  HH2         5.50    (#    337:60  Single Ambig)
 &rst
  ixpk= 337, nxpk= 60, iat=  -1,1631, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2367,2368,2418,2419,
 &end
#
#  156 MET  HN          129 TYR  HE          5.50    (#    338:60  Unique         2.90, 6.01 A)
 &rst
  ixpk= 338, nxpk= 60, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2099,2104,
 &end
#
#  148 MET  HG+         129 TYR  HE          5.50    (#    339:60  Unique         2.60, 5.63 A)
 &rst
  ixpk= 339, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2455,2456,
 igr2=2099,2104,
 &end
#
#    0 AMB  60-2:341    129 TYR  HE          4.50    (#    341:60  Single Ambig)
 &rst
  ixpk= 341, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2563,2526,2527,2528,
 igr2=2099,2104,
 &end
#
#  148 MET  ME          129 TYR  HE          5.50    (#    342:60  Unique         2.18, 5.73 A)
 &rst
  ixpk= 342, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2459,2460,2461,
 igr2=2099,2104,
 &end
#
#  155 VAL  MGY         129 TYR  HE          4.50    (#    343:60  Unique         1.95, 4.98 A)
 &rst
  ixpk= 343, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2=2099,2104,
 &end
#
#   22 VAL  MGY         129 TYR  HE          5.50    (#    344:60  Unique         1.98, 5.96 A)
 &rst
  ixpk= 344, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2099,2104,
 &end
#
#    0 AMB  60-2:345    129 TYR  HE          5.50    (#    345:60  Single Ambig)
 &rst
  ixpk= 345, nxpk= 60, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2549,2550,2551,2553,2554,2555,2612,2613,2614,2616,
      2617,2618,
 igr2=2099,2104,
 &end
#
#  111 ILE  HB          126 TRP  HZ2         4.50    (#    346:60  Unique         3.42, 4.18 A)
 &rst
  ixpk= 346, nxpk= 60, iat=1809,2051, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  chirality for residue 1 atoms:  CA CG HB2 HB3
 &rst iat=5,10,8,9, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 150., rk3=150.,  &end
#
#  chirality for residue 1 atoms:  CB SD HG2 HG3
 &rst iat=7,13,11,12, &end
#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,18,6,7, &end
#
#  chirality for residue 2 atoms:  CA CG2 CG1 HB
 &rst iat=22,26,30,25, &end
#
#  chirality for residue 2 atoms:  CB CD1 HG12 HG13
 &rst iat=24,33,31,32, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=20,37,23,24, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=41,46,44,45, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=39,49,42,43, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=53,58,56,57, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=51,61,54,55, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=65,70,68,69, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=63,73,66,67, &end
#
#  chirality for residue 6 atoms:  N C HA2 HA3
 &rst iat=75,80,78,79, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=84,89,87,88, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=82,101,85,86, &end
#
#  chirality for residue 8 atoms:  CA CG HB2 HB3
 &rst iat=105,110,108,109, &end
#
#  chirality for residue 8 atoms:  CB CD HG2 HG3
 &rst iat=107,113,111,112, &end
#
#  chirality for residue 8 atoms:  CG NE HD2 HD3
 &rst iat=110,116,114,115, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=103,125,106,107, &end
#
#  chirality for residue 9 atoms:  CA CG HB2 HB3
 &rst iat=137,131,135,136, &end
#
#  chirality for residue 9 atoms:  CB CD HG2 HG3
 &rst iat=134,128,132,133, &end
#
#  chirality for residue 9 atoms:  CG N HD2 HD3
 &rst iat=131,127,129,130, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=127,139,138,134, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=143,148,146,147, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=141,153,144,145, &end
#
#  chirality for residue 11 atoms:  CA CG1 CG2 HB
 &rst iat=157,161,165,160, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=155,169,158,159, &end
#
#  chirality for residue 12 atoms:  N C HA2 HA3
 &rst iat=171,176,174,175, &end
#
#  chirality for residue 13 atoms:  CA CG2 CG1 HB
 &rst iat=180,184,188,183, &end
#
#  chirality for residue 13 atoms:  CB CD1 HG12 HG13
 &rst iat=182,191,189,190, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=178,195,181,182, &end
#
#  chirality for residue 14 atoms:  CA CG1 CG2 HB
 &rst iat=199,203,207,202, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=197,211,200,201, &end
#
#  chirality for residue 15 atoms:  CA CG2 CG1 HB
 &rst iat=215,219,223,218, &end
#
#  chirality for residue 15 atoms:  CB CD1 HG12 HG13
 &rst iat=217,226,224,225, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=213,230,216,217, &end
#
#  chirality for residue 16 atoms:  CA SG HB2 HB3
 &rst iat=234,239,237,238, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=232,241,235,236, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=245,250,248,249, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=243,255,246,247, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=259,264,262,263, &end
#
#  chirality for residue 18 atoms:  CB CD HG2 HG3
 &rst iat=261,267,265,266, &end
#
#  chirality for residue 18 atoms:  CG NE HD2 HD3
 &rst iat=264,270,268,269, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=257,279,260,261, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=283,288,286,287, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=285,291,289,290, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=281,296,284,285, &end
#
#  chirality for residue 20 atoms:  N C HA2 HA3
 &rst iat=298,303,301,302, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=307,312,310,311, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=309,315,313,314, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=305,320,308,309, &end
#
#  chirality for residue 22 atoms:  CA CG1 CG2 HB
 &rst iat=324,328,332,327, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=322,336,325,326, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=340,345,343,344, &end
#
#  chirality for residue 23 atoms:  CB SD HG2 HG3
 &rst iat=342,348,346,347, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=338,353,341,342, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=357,362,360,361, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=355,377,358,359, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=379,387,382,383, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=391,396,394,395, &end
#
#  chirality for residue 26 atoms:  CB CD HG2 HG3
 &rst iat=393,399,397,398, &end
#
#  chirality for residue 26 atoms:  CG NE HD2 HD3
 &rst iat=396,402,400,401, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=389,411,392,393, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=415,420,418,419, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=417,423,421,422, &end
#
#  chirality for residue 27 atoms:  CG NE HD2 HD3
 &rst iat=420,426,424,425, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=413,435,416,417, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=439,444,442,443, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=437,455,440,441, &end
#
#  chirality for residue 29 atoms:  N C HA2 HA3
 &rst iat=457,462,460,461, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=466,471,469,470, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=468,474,472,473, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=464,479,467,468, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=483,488,486,487, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=481,496,484,485, &end
#
#  chirality for residue 32 atoms:  CA OG HB2 HB3
 &rst iat=500,505,503,504, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=498,507,501,502, &end
#
#  chirality for residue 33 atoms:  CA CG HB2 HB3
 &rst iat=511,516,514,515, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=509,531,512,513, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=535,540,538,539, &end
#
#  chirality for residue 34 atoms:  CB CD HG2 HG3
 &rst iat=537,543,541,542, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=533,548,536,537, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=552,557,555,556, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=550,568,553,554, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=580,574,578,579, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=577,571,575,576, &end
#
#  chirality for residue 36 atoms:  CG N HD2 HD3
 &rst iat=574,570,572,573, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=570,582,581,577, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=586,591,589,590, &end
#
#  chirality for residue 37 atoms:  CB CD HG2 HG3
 &rst iat=588,594,592,593, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=584,599,587,588, &end
#
#  chirality for residue 38 atoms:  N C HA2 HA3
 &rst iat=601,606,604,605, &end
#
#  chirality for residue 39 atoms:  N C HA2 HA3
 &rst iat=608,613,611,612, &end
#
#  chirality for residue 40 atoms:  CA CG2 CG1 HB
 &rst iat=617,621,625,620, &end
#
#  chirality for residue 40 atoms:  CB CD1 HG12 HG13
 &rst iat=619,628,626,627, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=615,632,618,619, &end
#
#  chirality for residue 41 atoms:  CA CG HB2 HB3
 &rst iat=636,641,639,640, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=634,646,637,638, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=658,652,656,657, &end
#
#  chirality for residue 42 atoms:  CB CD HG2 HG3
 &rst iat=655,649,653,654, &end
#
#  chirality for residue 42 atoms:  CG N HD2 HD3
 &rst iat=652,648,650,651, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=648,660,659,655, &end
#
#  chirality for residue 43 atoms:  N C HA2 HA3
 &rst iat=662,667,665,666, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=671,676,674,675, &end
#
#  chirality for residue 44 atoms:  CB CD HG2 HG3
 &rst iat=673,679,677,678, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=669,682,672,673, &end
#
#  chirality for residue 45 atoms:  CA OG HB2 HB3
 &rst iat=686,691,689,690, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=684,693,687,688, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=695,703,698,699, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=707,712,710,711, &end
#
#  chirality for residue 47 atoms:  CB CD HG2 HG3
 &rst iat=709,715,713,714, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=705,718,708,709, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=722,727,725,726, &end
#
#  chirality for residue 48 atoms:  CB CD HG2 HG3
 &rst iat=724,730,728,729, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=720,735,723,724, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=737,745,740,741, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=749,754,752,753, &end
#
#  chirality for residue 50 atoms:  CB SD HG2 HG3
 &rst iat=751,757,755,756, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=747,762,750,751, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=766,771,769,770, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=764,783,767,768, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=787,792,790,791, &end
#
#  chirality for residue 52 atoms:  CB CD HG2 HG3
 &rst iat=789,795,793,794, &end
#
#  chirality for residue 52 atoms:  CG NE HD2 HD3
 &rst iat=792,798,796,797, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=785,807,788,789, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=809,817,812,813, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=821,826,824,825, &end
#
#  chirality for residue 54 atoms:  CB CD1 CD2 HG
 &rst iat=823,828,832,827, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=819,836,822,823, &end
#
#  chirality for residue 55 atoms:  CA CG HB2 HB3
 &rst iat=840,845,843,844, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=838,856,841,842, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=860,865,863,864, &end
#
#  chirality for residue 56 atoms:  CB CD HG2 HG3
 &rst iat=862,868,866,867, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=858,871,861,862, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=875,880,878,879, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=877,883,881,882, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=873,886,876,877, &end
#
#  chirality for residue 58 atoms:  CA CG1 CG2 HB
 &rst iat=890,894,898,893, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=888,902,891,892, &end
#
#  chirality for residue 59 atoms:  N C HA2 HA3
 &rst iat=904,909,907,908, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=913,918,916,917, &end
#
#  chirality for residue 60 atoms:  CB CD1 CD2 HG
 &rst iat=915,920,924,919, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=911,928,914,915, &end
#
#  chirality for residue 61 atoms:  CA OG HB2 HB3
 &rst iat=932,937,935,936, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=930,939,933,934, &end
#
#  chirality for residue 62 atoms:  CA CG HB2 HB3
 &rst iat=943,948,946,947, &end
#
#  chirality for residue 62 atoms:  CB CD HG2 HG3
 &rst iat=945,951,949,950, &end
#
#  chirality for residue 62 atoms:  CG NE HD2 HD3
 &rst iat=948,954,952,953, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=941,963,944,945, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=967,972,970,971, &end
#
#  chirality for residue 63 atoms:  CB CD HG2 HG3
 &rst iat=969,975,973,974, &end
#
#  chirality for residue 63 atoms:  CD NZ HE2 HE3
 &rst iat=975,981,979,980, &end
#
#  chirality for residue 63 atoms:  CG CE HD2 HD3
 &rst iat=972,978,976,977, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=965,985,968,969, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=989,994,992,993, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=987,997,990,991, &end
#
#  chirality for residue 65 atoms:  CA CG1 CG2 HB
 &rst iat=1001,1005,1009,1004, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=999,1013,1002,1003, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1017,1022,1020,1021, &end
#
#  chirality for residue 66 atoms:  CB CD HG2 HG3
 &rst iat=1019,1025,1023,1024, &end
#
#  chirality for residue 66 atoms:  CG NE HD2 HD3
 &rst iat=1022,1028,1026,1027, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1015,1037,1018,1019, &end
#
#  chirality for residue 67 atoms:  CA CG2 CG1 HB
 &rst iat=1041,1045,1049,1044, &end
#
#  chirality for residue 67 atoms:  CB CD1 HG12 HG13
 &rst iat=1043,1052,1050,1051, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1039,1056,1042,1043, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1060,1065,1063,1064, &end
#
#  chirality for residue 68 atoms:  CB CD1 CD2 HG
 &rst iat=1062,1067,1071,1066, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1058,1075,1061,1062, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1077,1085,1080,1081, &end
#
#  chirality for residue 70 atoms:  CA OG HB2 HB3
 &rst iat=1089,1094,1092,1093, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1087,1096,1090,1091, &end
#
#  chirality for residue 71 atoms:  CA CG2 OG1 HB
 &rst iat=1100,1104,1108,1103, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1098,1110,1101,1102, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1114,1119,1117,1118, &end
#
#  chirality for residue 72 atoms:  CB CD HG2 HG3
 &rst iat=1116,1122,1120,1121, &end
#
#  chirality for residue 72 atoms:  CG NE HD2 HD3
 &rst iat=1119,1125,1123,1124, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1112,1134,1115,1116, &end
#
#  chirality for residue 73 atoms:  CA CG HB2 HB3
 &rst iat=1138,1143,1141,1142, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1136,1148,1139,1140, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1152,1157,1155,1156, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1150,1172,1153,1154, &end
#
#  chirality for residue 75 atoms:  CA CG HB2 HB3
 &rst iat=1176,1181,1179,1180, &end
#
#  chirality for residue 75 atoms:  CB CD1 CD2 HG
 &rst iat=1178,1183,1187,1182, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1174,1191,1177,1178, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1195,1200,1198,1199, &end
#
#  chirality for residue 76 atoms:  CB CD HG2 HG3
 &rst iat=1197,1203,1201,1202, &end
#
#  chirality for residue 76 atoms:  CG NE HD2 HD3
 &rst iat=1200,1206,1204,1205, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1193,1215,1196,1197, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1219,1224,1222,1223, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1217,1236,1220,1221, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1240,1245,1243,1244, &end
#
#  chirality for residue 78 atoms:  CB CD HG2 HG3
 &rst iat=1242,1248,1246,1247, &end
#
#  chirality for residue 78 atoms:  CD NZ HE2 HE3
 &rst iat=1248,1254,1252,1253, &end
#
#  chirality for residue 78 atoms:  CG CE HD2 HD3
 &rst iat=1245,1251,1249,1250, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1238,1258,1241,1242, &end
#
#  chirality for residue 79 atoms:  CA CG HB2 HB3
 &rst iat=1262,1267,1265,1266, &end
#
#  chirality for residue 79 atoms:  CB CD1 CD2 HG
 &rst iat=1264,1269,1273,1268, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1260,1277,1263,1264, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1289,1283,1287,1288, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1286,1280,1284,1285, &end
#
#  chirality for residue 80 atoms:  CG N HD2 HD3
 &rst iat=1283,1279,1281,1282, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1279,1291,1290,1286, &end
#
#  chirality for residue 81 atoms:  CA CG HB2 HB3
 &rst iat=1295,1300,1298,1299, &end
#
#  chirality for residue 81 atoms:  CB CD HG2 HG3
 &rst iat=1297,1303,1301,1302, &end
#
#  chirality for residue 81 atoms:  CD NZ HE2 HE3
 &rst iat=1303,1309,1307,1308, &end
#
#  chirality for residue 81 atoms:  CG CE HD2 HD3
 &rst iat=1300,1306,1304,1305, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1293,1313,1296,1297, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1317,1322,1320,1321, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1319,1325,1323,1324, &end
#
#  chirality for residue 82 atoms:  CG NE HD2 HD3
 &rst iat=1322,1328,1326,1327, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1315,1337,1318,1319, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1341,1346,1344,1345, &end
#
#  chirality for residue 83 atoms:  CB CD1 CD2 HG
 &rst iat=1343,1348,1352,1347, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1339,1356,1342,1343, &end
#
#  chirality for residue 84 atoms:  CA CG1 CG2 HB
 &rst iat=1360,1364,1368,1363, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1358,1372,1361,1362, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1376,1381,1379,1380, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1378,1384,1382,1383, &end
#
#  chirality for residue 85 atoms:  CG NE HD2 HD3
 &rst iat=1381,1387,1385,1386, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1374,1396,1377,1378, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1400,1405,1403,1404, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1398,1420,1401,1402, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1424,1429,1427,1428, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1422,1432,1425,1426, &end
#
#  chirality for residue 88 atoms:  CA CG2 OG1 HB
 &rst iat=1436,1440,1444,1439, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1434,1446,1437,1438, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1450,1455,1453,1454, &end
#
#  chirality for residue 89 atoms:  CB CD HG2 HG3
 &rst iat=1452,1458,1456,1457, &end
#
#  chirality for residue 89 atoms:  CD NZ HE2 HE3
 &rst iat=1458,1464,1462,1463, &end
#
#  chirality for residue 89 atoms:  CG CE HD2 HD3
 &rst iat=1455,1461,1459,1460, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1448,1468,1451,1452, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1480,1474,1478,1479, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1477,1471,1475,1476, &end
#
#  chirality for residue 90 atoms:  CG N HD2 HD3
 &rst iat=1474,1470,1472,1473, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1470,1482,1481,1477, &end
#
#  chirality for residue 91 atoms:  CA CG1 CG2 HB
 &rst iat=1486,1490,1494,1489, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1484,1498,1487,1488, &end
#
#  chirality for residue 92 atoms:  CA SG HB2 HB3
 &rst iat=1502,1507,1505,1506, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1500,1509,1503,1504, &end
#
#  chirality for residue 93 atoms:  CA CG2 CG1 HB
 &rst iat=1513,1517,1521,1516, &end
#
#  chirality for residue 93 atoms:  CB CD1 HG12 HG13
 &rst iat=1515,1524,1522,1523, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1511,1528,1514,1515, &end
#
#  chirality for residue 94 atoms:  N C HA2 HA3
 &rst iat=1530,1535,1533,1534, &end
#
#  chirality for residue 95 atoms:  CA CG HB2 HB3
 &rst iat=1539,1544,1542,1543, &end
#
#  chirality for residue 95 atoms:  CB CD HG2 HG3
 &rst iat=1541,1547,1545,1546, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1537,1552,1540,1541, &end
#
#  chirality for residue 96 atoms:  CA CG HB2 HB3
 &rst iat=1556,1561,1559,1560, &end
#
#  chirality for residue 96 atoms:  CB CD HG2 HG3
 &rst iat=1558,1564,1562,1563, &end
#
#  chirality for residue 96 atoms:  CD NZ HE2 HE3
 &rst iat=1564,1570,1568,1569, &end
#
#  chirality for residue 96 atoms:  CG CE HD2 HD3
 &rst iat=1561,1567,1565,1566, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1554,1574,1557,1558, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1578,1583,1581,1582, &end
#
#  chirality for residue 97 atoms:  CB CD HG2 HG3
 &rst iat=1580,1586,1584,1585, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1576,1591,1579,1580, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1595,1600,1598,1599, &end
#
#  chirality for residue 98 atoms:  CB CD HG2 HG3
 &rst iat=1597,1603,1601,1602, &end
#
#  chirality for residue 98 atoms:  CD NZ HE2 HE3
 &rst iat=1603,1609,1607,1608, &end
#
#  chirality for residue 98 atoms:  CG CE HD2 HD3
 &rst iat=1600,1606,1604,1605, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1593,1613,1596,1597, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1617,1622,1620,1621, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1615,1637,1618,1619, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1641,1646,1644,1645, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1639,1657,1642,1643, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1661,1666,1664,1665, &end
#
#  chirality for residue 101 atoms:  CB CD1 CD2 HG
 &rst iat=1663,1668,1672,1667, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1659,1676,1662,1663, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1680,1685,1683,1684, &end
#
#  chirality for residue 102 atoms:  CB CD1 CD2 HG
 &rst iat=1682,1687,1691,1686, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1678,1695,1681,1682, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1699,1704,1702,1703, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1701,1707,1705,1706, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1697,1712,1700,1701, &end
#
#  chirality for residue 104 atoms:  CA CG HB2 HB3
 &rst iat=1716,1721,1719,1720, &end
#
#  chirality for residue 104 atoms:  CB CD1 CD2 HG
 &rst iat=1718,1723,1727,1722, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1714,1731,1717,1718, &end
#
#  chirality for residue 105 atoms:  CA CG1 CG2 HB
 &rst iat=1735,1739,1743,1738, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1733,1747,1736,1737, &end
#
#  chirality for residue 106 atoms:  CA OG HB2 HB3
 &rst iat=1751,1756,1754,1755, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1749,1758,1752,1753, &end
#
#  chirality for residue 107 atoms:  N C HA2 HA3
 &rst iat=1760,1765,1763,1764, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1769,1774,1772,1773, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1767,1777,1770,1771, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1779,1787,1782,1783, &end
#
#  chirality for residue 110 atoms:  CA CG HB2 HB3
 &rst iat=1791,1796,1794,1795, &end
#
#  chirality for residue 110 atoms:  CB CD HG2 HG3
 &rst iat=1793,1799,1797,1798, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1789,1802,1792,1793, &end
#
#  chirality for residue 111 atoms:  CA CG2 CG1 HB
 &rst iat=1806,1810,1814,1809, &end
#
#  chirality for residue 111 atoms:  CB CD1 HG12 HG13
 &rst iat=1808,1817,1815,1816, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1804,1821,1807,1808, &end
#
#  chirality for residue 112 atoms:  CA CG HB2 HB3
 &rst iat=1825,1830,1828,1829, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1823,1835,1826,1827, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1839,1844,1842,1843, &end
#
#  chirality for residue 113 atoms:  CB SD HG2 HG3
 &rst iat=1841,1847,1845,1846, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1837,1852,1840,1841, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1856,1861,1859,1860, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=1858,1864,1862,1863, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1854,1869,1857,1858, &end
#
#  chirality for residue 115 atoms:  CA CG2 OG1 HB
 &rst iat=1873,1877,1881,1876, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1871,1883,1874,1875, &end
#
#  chirality for residue 116 atoms:  CA OG HB2 HB3
 &rst iat=1887,1892,1890,1891, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1885,1894,1888,1889, &end
#
#  chirality for residue 117 atoms:  CA OG HB2 HB3
 &rst iat=1898,1903,1901,1902, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1896,1905,1899,1900, &end
#
#  chirality for residue 118 atoms:  CA CG2 OG1 HB
 &rst iat=1909,1913,1917,1912, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1907,1919,1910,1911, &end
#
#  chirality for residue 119 atoms:  CA CG HB2 HB3
 &rst iat=1931,1925,1929,1930, &end
#
#  chirality for residue 119 atoms:  CB CD HG2 HG3
 &rst iat=1928,1922,1926,1927, &end
#
#  chirality for residue 119 atoms:  CG N HD2 HD3
 &rst iat=1925,1921,1923,1924, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1921,1933,1932,1928, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=1937,1942,1940,1941, &end
#
#  chirality for residue 120 atoms:  CB CD HG2 HG3
 &rst iat=1939,1945,1943,1944, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1935,1948,1938,1939, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1952,1957,1955,1956, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1950,1968,1953,1954, &end
#
#  chirality for residue 122 atoms:  CA CG HB2 HB3
 &rst iat=1972,1977,1975,1976, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1970,1980,1973,1974, &end
#
#  chirality for residue 123 atoms:  N C HA2 HA3
 &rst iat=1982,1987,1985,1986, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1991,1996,1994,1995, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1989,2011,1992,1993, &end
#
#  chirality for residue 125 atoms:  CA CG HB2 HB3
 &rst iat=2015,2020,2018,2019, &end
#
#  chirality for residue 125 atoms:  CB CD HG2 HG3
 &rst iat=2017,2023,2021,2022, &end
#
#  chirality for residue 125 atoms:  CG NE HD2 HD3
 &rst iat=2020,2026,2024,2025, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=2013,2035,2016,2017, &end
#
#  chirality for residue 126 atoms:  CA CG HB2 HB3
 &rst iat=2039,2044,2042,2043, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=2037,2059,2040,2041, &end
#
#  chirality for residue 127 atoms:  CA CG1 CG2 HB
 &rst iat=2063,2067,2071,2066, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=2061,2075,2064,2065, &end
#
#  chirality for residue 128 atoms:  CA OG HB2 HB3
 &rst iat=2079,2084,2082,2083, &end
#
#  chirality for residue 128 atoms:  N C HA CB
 &rst iat=2077,2086,2080,2081, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=2090,2095,2093,2094, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=2088,2107,2091,2092, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=2111,2116,2114,2115, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=2109,2131,2112,2113, &end
#
#  chirality for residue 131 atoms:  CA CG HB2 HB3
 &rst iat=2135,2140,2138,2139, &end
#
#  chirality for residue 131 atoms:  N C HA CB
 &rst iat=2133,2152,2136,2137, &end
#
#  chirality for residue 132 atoms:  CA CG HB2 HB3
 &rst iat=2164,2158,2162,2163, &end
#
#  chirality for residue 132 atoms:  CB CD HG2 HG3
 &rst iat=2161,2155,2159,2160, &end
#
#  chirality for residue 132 atoms:  CG N HD2 HD3
 &rst iat=2158,2154,2156,2157, &end
#
#  chirality for residue 132 atoms:  N C HA CB
 &rst iat=2154,2166,2165,2161, &end
#
#  chirality for residue 133 atoms:  CA CG1 CG2 HB
 &rst iat=2170,2174,2178,2173, &end
#
#  chirality for residue 133 atoms:  N C HA CB
 &rst iat=2168,2182,2171,2172, &end
#
#  chirality for residue 134 atoms:  CA CG HB2 HB3
 &rst iat=2186,2191,2189,2190, &end
#
#  chirality for residue 134 atoms:  CB CD HG2 HG3
 &rst iat=2188,2194,2192,2193, &end
#
#  chirality for residue 134 atoms:  CG NE HD2 HD3
 &rst iat=2191,2197,2195,2196, &end
#
#  chirality for residue 134 atoms:  N C HA CB
 &rst iat=2184,2206,2187,2188, &end
#
#  chirality for residue 135 atoms:  CA CG HB2 HB3
 &rst iat=2210,2215,2213,2214, &end
#
#  chirality for residue 135 atoms:  CB CD HG2 HG3
 &rst iat=2212,2218,2216,2217, &end
#
#  chirality for residue 135 atoms:  N C HA CB
 &rst iat=2208,2223,2211,2212, &end
#
#  chirality for residue 136 atoms:  CA CG1 CG2 HB
 &rst iat=2227,2231,2235,2230, &end
#
#  chirality for residue 136 atoms:  N C HA CB
 &rst iat=2225,2239,2228,2229, &end
#
#  chirality for residue 137 atoms:  CA CG1 CG2 HB
 &rst iat=2243,2247,2251,2246, &end
#
#  chirality for residue 137 atoms:  N C HA CB
 &rst iat=2241,2255,2244,2245, &end
#
#  chirality for residue 138 atoms:  CA OG HB2 HB3
 &rst iat=2259,2264,2262,2263, &end
#
#  chirality for residue 138 atoms:  N C HA CB
 &rst iat=2257,2266,2260,2261, &end
#
#  chirality for residue 139 atoms:  CA CG HB2 HB3
 &rst iat=2270,2275,2273,2274, &end
#
#  chirality for residue 139 atoms:  N C HA CB
 &rst iat=2268,2286,2271,2272, &end
#
#  chirality for residue 140 atoms:  CA CG HB2 HB3
 &rst iat=2290,2295,2293,2294, &end
#
#  chirality for residue 140 atoms:  CB CD HG2 HG3
 &rst iat=2292,2298,2296,2297, &end
#
#  chirality for residue 140 atoms:  CD NZ HE2 HE3
 &rst iat=2298,2304,2302,2303, &end
#
#  chirality for residue 140 atoms:  CG CE HD2 HD3
 &rst iat=2295,2301,2299,2300, &end
#
#  chirality for residue 140 atoms:  N C HA CB
 &rst iat=2288,2308,2291,2292, &end
#
#  chirality for residue 141 atoms:  CA CG HB2 HB3
 &rst iat=2312,2317,2315,2316, &end
#
#  chirality for residue 141 atoms:  CB CD HG2 HG3
 &rst iat=2314,2320,2318,2319, &end
#
#  chirality for residue 141 atoms:  CG NE HD2 HD3
 &rst iat=2317,2323,2321,2322, &end
#
#  chirality for residue 141 atoms:  N C HA CB
 &rst iat=2310,2332,2313,2314, &end
#
#  chirality for residue 142 atoms:  CA CG HB2 HB3
 &rst iat=2336,2341,2339,2340, &end
#
#  chirality for residue 142 atoms:  N C HA CB
 &rst iat=2334,2344,2337,2338, &end
#
#  chirality for residue 143 atoms:  CA CG1 CG2 HB
 &rst iat=2348,2352,2356,2351, &end
#
#  chirality for residue 143 atoms:  N C HA CB
 &rst iat=2346,2360,2349,2350, &end
#
#  chirality for residue 144 atoms:  CA CG HB2 HB3
 &rst iat=2364,2369,2367,2368, &end
#
#  chirality for residue 144 atoms:  N C HA CB
 &rst iat=2362,2381,2365,2366, &end
#
#  chirality for residue 145 atoms:  CA CG HB2 HB3
 &rst iat=2385,2390,2388,2389, &end
#
#  chirality for residue 145 atoms:  CB CD HG2 HG3
 &rst iat=2387,2393,2391,2392, &end
#
#  chirality for residue 145 atoms:  CG NE HD2 HD3
 &rst iat=2390,2396,2394,2395, &end
#
#  chirality for residue 145 atoms:  N C HA CB
 &rst iat=2383,2405,2386,2387, &end
#
#  chirality for residue 146 atoms:  CA CG HB2 HB3
 &rst iat=2409,2414,2412,2413, &end
#
#  chirality for residue 146 atoms:  CB CD HG2 HG3
 &rst iat=2411,2417,2415,2416, &end
#
#  chirality for residue 146 atoms:  CG NE HD2 HD3
 &rst iat=2414,2420,2418,2419, &end
#
#  chirality for residue 146 atoms:  N C HA CB
 &rst iat=2407,2429,2410,2411, &end
#
#  chirality for residue 147 atoms:  CA CG1 CG2 HB
 &rst iat=2433,2437,2441,2436, &end
#
#  chirality for residue 147 atoms:  N C HA CB
 &rst iat=2431,2445,2434,2435, &end
#
#  chirality for residue 148 atoms:  CA CG HB2 HB3
 &rst iat=2449,2454,2452,2453, &end
#
#  chirality for residue 148 atoms:  CB SD HG2 HG3
 &rst iat=2451,2457,2455,2456, &end
#
#  chirality for residue 148 atoms:  N C HA CB
 &rst iat=2447,2462,2450,2451, &end
#
#  chirality for residue 149 atoms:  CA CG HB2 HB3
 &rst iat=2466,2471,2469,2470, &end
#
#  chirality for residue 149 atoms:  CB CD HG2 HG3
 &rst iat=2468,2474,2472,2473, &end
#
#  chirality for residue 149 atoms:  CD NZ HE2 HE3
 &rst iat=2474,2480,2478,2479, &end
#
#  chirality for residue 149 atoms:  CG CE HD2 HD3
 &rst iat=2471,2477,2475,2476, &end
#
#  chirality for residue 149 atoms:  N C HA CB
 &rst iat=2464,2484,2467,2468, &end
#
#  chirality for residue 150 atoms:  CA CG HB2 HB3
 &rst iat=2488,2493,2491,2492, &end
#
#  chirality for residue 150 atoms:  CB CD HG2 HG3
 &rst iat=2490,2496,2494,2495, &end
#
#  chirality for residue 150 atoms:  N C HA CB
 &rst iat=2486,2499,2489,2490, &end
#
#  chirality for residue 151 atoms:  CA CG HB2 HB3
 &rst iat=2503,2508,2506,2507, &end
#
#  chirality for residue 151 atoms:  N C HA CB
 &rst iat=2501,2519,2504,2505, &end
#
#  chirality for residue 152 atoms:  N C HA CB
 &rst iat=2521,2529,2524,2525, &end
#
#  chirality for residue 153 atoms:  CA OG HB2 HB3
 &rst iat=2533,2538,2536,2537, &end
#
#  chirality for residue 153 atoms:  N C HA CB
 &rst iat=2531,2540,2534,2535, &end
#
#  chirality for residue 154 atoms:  CA CG1 CG2 HB
 &rst iat=2544,2548,2552,2547, &end
#
#  chirality for residue 154 atoms:  N C HA CB
 &rst iat=2542,2556,2545,2546, &end
#
#  chirality for residue 155 atoms:  CA CG1 CG2 HB
 &rst iat=2560,2564,2568,2563, &end
#
#  chirality for residue 155 atoms:  N C HA CB
 &rst iat=2558,2572,2561,2562, &end
#
#  chirality for residue 156 atoms:  CA CG HB2 HB3
 &rst iat=2576,2581,2579,2580, &end
#
#  chirality for residue 156 atoms:  CB SD HG2 HG3
 &rst iat=2578,2584,2582,2583, &end
#
#  chirality for residue 156 atoms:  N C HA CB
 &rst iat=2574,2589,2577,2578, &end
#
#  chirality for residue 157 atoms:  CA OG HB2 HB3
 &rst iat=2593,2598,2596,2597, &end
#
#  chirality for residue 157 atoms:  N C HA CB
 &rst iat=2591,2600,2594,2595, &end
#
#  chirality for residue 158 atoms:  CA CG HB2 HB3
 &rst iat=2604,2609,2607,2608, &end
#
#  chirality for residue 158 atoms:  CB CD1 CD2 HG
 &rst iat=2606,2611,2615,2610, &end
#
#  chirality for residue 158 atoms:  N C HA CB
 &rst iat=2602,2619,2605,2606, &end
#
#  chirality for residue 159 atoms:  CA CG HB2 HB3
 &rst iat=2623,2628,2626,2627, &end
#
#  chirality for residue 159 atoms:  CB CD HG2 HG3
 &rst iat=2625,2631,2629,2630, &end
#
#  chirality for residue 159 atoms:  N C HA CB
 &rst iat=2621,2636,2624,2625, &end
#
#  chirality for residue 160 atoms:  CA CG HB2 HB3
 &rst iat=2640,2645,2643,2644, &end
#
#  chirality for residue 160 atoms:  CB CD HG2 HG3
 &rst iat=2642,2648,2646,2647, &end
#
#  chirality for residue 160 atoms:  N C HA CB
 &rst iat=2638,2651,2641,2642, &end
#
#  chirality for residue 161 atoms:  CA CG HB2 HB3
 &rst iat=2655,2660,2658,2659, &end
#
#  chirality for residue 161 atoms:  N C HA CB
 &rst iat=2653,2665,2656,2657, &end
#
#  chirality for residue 162 atoms:  CA CG2 OG1 HB
 &rst iat=2669,2673,2677,2672, &end
#
#  chirality for residue 162 atoms:  N C HA CB
 &rst iat=2667,2679,2670,2671, &end
#
#  chirality for residue 163 atoms:  CA CG HB2 HB3
 &rst iat=2691,2685,2689,2690, &end
#
#  chirality for residue 163 atoms:  CB CD HG2 HG3
 &rst iat=2688,2682,2686,2687, &end
#
#  chirality for residue 163 atoms:  CG N HD2 HD3
 &rst iat=2685,2681,2683,2684, &end
#
#  chirality for residue 163 atoms:  N C HA CB
 &rst iat=2681,2693,2692,2688, &end
#
#  chirality for residue 164 atoms:  CA CG HB2 HB3
 &rst iat=2697,2702,2700,2701, &end
#
#  chirality for residue 164 atoms:  CB CD HG2 HG3
 &rst iat=2699,2705,2703,2704, &end
#
#  chirality for residue 164 atoms:  CD NZ HE2 HE3
 &rst iat=2705,2711,2709,2710, &end
#
#  chirality for residue 164 atoms:  CG CE HD2 HD3
 &rst iat=2702,2708,2706,2707, &end
#
#  chirality for residue 164 atoms:  N C HA CB
 &rst iat=2695,2715,2698,2699, &end
#
#  trans-omega constraint for residue 2
 &rst iat=22,20,18,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 150., rk3=150.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=41,39,37,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=53,51,49,41, &end
#
#  trans-omega constraint for residue 5
 &rst iat=65,63,61,53, &end
#
#  trans-omega constraint for residue 6
 &rst iat=77,75,73,65, &end
#
#  trans-omega constraint for residue 7
 &rst iat=84,82,80,77, &end
#
#  trans-omega constraint for residue 8
 &rst iat=105,103,101,84, &end
#
#  trans-omega constraint for residue 9
 &rst iat=137,127,125,105, &end
#
#  trans-omega constraint for residue 10
 &rst iat=143,141,139,137, &end
#
#  trans-omega constraint for residue 11
 &rst iat=157,155,153,143, &end
#
#  trans-omega constraint for residue 12
 &rst iat=173,171,169,157, &end
#
#  trans-omega constraint for residue 13
 &rst iat=180,178,176,173, &end
#
#  trans-omega constraint for residue 14
 &rst iat=199,197,195,180, &end
#
#  trans-omega constraint for residue 15
 &rst iat=215,213,211,199, &end
#
#  trans-omega constraint for residue 16
 &rst iat=234,232,230,215, &end
#
#  trans-omega constraint for residue 17
 &rst iat=245,243,241,234, &end
#
#  trans-omega constraint for residue 18
 &rst iat=259,257,255,245, &end
#
#  trans-omega constraint for residue 19
 &rst iat=283,281,279,259, &end
#
#  trans-omega constraint for residue 20
 &rst iat=300,298,296,283, &end
#
#  trans-omega constraint for residue 21
 &rst iat=307,305,303,300, &end
#
#  trans-omega constraint for residue 22
 &rst iat=324,322,320,307, &end
#
#  trans-omega constraint for residue 23
 &rst iat=340,338,336,324, &end
#
#  trans-omega constraint for residue 24
 &rst iat=357,355,353,340, &end
#
#  trans-omega constraint for residue 25
 &rst iat=381,379,377,357, &end
#
#  trans-omega constraint for residue 26
 &rst iat=391,389,387,381, &end
#
#  trans-omega constraint for residue 27
 &rst iat=415,413,411,391, &end
#
#  trans-omega constraint for residue 28
 &rst iat=439,437,435,415, &end
#
#  trans-omega constraint for residue 29
 &rst iat=459,457,455,439, &end
#
#  trans-omega constraint for residue 30
 &rst iat=466,464,462,459, &end
#
#  trans-omega constraint for residue 31
 &rst iat=483,481,479,466, &end
#
#  trans-omega constraint for residue 32
 &rst iat=500,498,496,483, &end
#
#  trans-omega constraint for residue 33
 &rst iat=511,509,507,500, &end
#
#  trans-omega constraint for residue 34
 &rst iat=535,533,531,511, &end
#
#  trans-omega constraint for residue 35
 &rst iat=552,550,548,535, &end
#
#  trans-omega constraint for residue 36
 &rst iat=580,570,568,552, &end
#
#  trans-omega constraint for residue 37
 &rst iat=586,584,582,580, &end
#
#  trans-omega constraint for residue 38
 &rst iat=603,601,599,586, &end
#
#  trans-omega constraint for residue 39
 &rst iat=610,608,606,603, &end
#
#  trans-omega constraint for residue 40
 &rst iat=617,615,613,610, &end
#
#  trans-omega constraint for residue 41
 &rst iat=636,634,632,617, &end
#
#  trans-omega constraint for residue 42
 &rst iat=658,648,646,636, &end
#
#  trans-omega constraint for residue 43
 &rst iat=664,662,660,658, &end
#
#  trans-omega constraint for residue 44
 &rst iat=671,669,667,664, &end
#
#  trans-omega constraint for residue 45
 &rst iat=686,684,682,671, &end
#
#  trans-omega constraint for residue 46
 &rst iat=697,695,693,686, &end
#
#  trans-omega constraint for residue 47
 &rst iat=707,705,703,697, &end
#
#  trans-omega constraint for residue 48
 &rst iat=722,720,718,707, &end
#
#  trans-omega constraint for residue 49
 &rst iat=739,737,735,722, &end
#
#  trans-omega constraint for residue 50
 &rst iat=749,747,745,739, &end
#
#  trans-omega constraint for residue 51
 &rst iat=766,764,762,749, &end
#
#  trans-omega constraint for residue 52
 &rst iat=787,785,783,766, &end
#
#  trans-omega constraint for residue 53
 &rst iat=811,809,807,787, &end
#
#  trans-omega constraint for residue 54
 &rst iat=821,819,817,811, &end
#
#  trans-omega constraint for residue 55
 &rst iat=840,838,836,821, &end
#
#  trans-omega constraint for residue 56
 &rst iat=860,858,856,840, &end
#
#  trans-omega constraint for residue 57
 &rst iat=875,873,871,860, &end
#
#  trans-omega constraint for residue 58
 &rst iat=890,888,886,875, &end
#
#  trans-omega constraint for residue 59
 &rst iat=906,904,902,890, &end
#
#  trans-omega constraint for residue 60
 &rst iat=913,911,909,906, &end
#
#  trans-omega constraint for residue 61
 &rst iat=932,930,928,913, &end
#
#  trans-omega constraint for residue 62
 &rst iat=943,941,939,932, &end
#
#  trans-omega constraint for residue 63
 &rst iat=967,965,963,943, &end
#
#  trans-omega constraint for residue 64
 &rst iat=989,987,985,967, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1001,999,997,989, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1017,1015,1013,1001, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1041,1039,1037,1017, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1060,1058,1056,1041, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1079,1077,1075,1060, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1089,1087,1085,1079, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1100,1098,1096,1089, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1114,1112,1110,1100, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1138,1136,1134,1114, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1152,1150,1148,1138, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1176,1174,1172,1152, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1195,1193,1191,1176, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1219,1217,1215,1195, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1240,1238,1236,1219, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1262,1260,1258,1240, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1289,1279,1277,1262, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1295,1293,1291,1289, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1317,1315,1313,1295, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1341,1339,1337,1317, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1360,1358,1356,1341, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1376,1374,1372,1360, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1400,1398,1396,1376, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1424,1422,1420,1400, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1436,1434,1432,1424, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1450,1448,1446,1436, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1486,1484,1482,1480, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1502,1500,1498,1486, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1513,1511,1509,1502, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1532,1530,1528,1513, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1539,1537,1535,1532, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1556,1554,1552,1539, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1578,1576,1574,1556, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1595,1593,1591,1578, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1617,1615,1613,1595, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1641,1639,1637,1617, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1661,1659,1657,1641, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1680,1678,1676,1661, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1699,1697,1695,1680, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1716,1714,1712,1699, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1735,1733,1731,1716, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1751,1749,1747,1735, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1762,1760,1758,1751, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1769,1767,1765,1762, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1781,1779,1777,1769, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1791,1789,1787,1781, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1806,1804,1802,1791, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1825,1823,1821,1806, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1839,1837,1835,1825, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1856,1854,1852,1839, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1873,1871,1869,1856, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1887,1885,1883,1873, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1898,1896,1894,1887, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1909,1907,1905,1898, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1931,1921,1919,1909, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1937,1935,1933,1931, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1952,1950,1948,1937, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1972,1970,1968,1952, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1984,1982,1980,1972, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1991,1989,1987,1984, &end
#
#  trans-omega constraint for residue 125
 &rst iat=2015,2013,2011,1991, &end
#
#  trans-omega constraint for residue 126
 &rst iat=2039,2037,2035,2015, &end
#
#  trans-omega constraint for residue 127
 &rst iat=2063,2061,2059,2039, &end
#
#  trans-omega constraint for residue 128
 &rst iat=2079,2077,2075,2063, &end
#
#  trans-omega constraint for residue 129
 &rst iat=2090,2088,2086,2079, &end
#
#  trans-omega constraint for residue 130
 &rst iat=2111,2109,2107,2090, &end
#
#  trans-omega constraint for residue 131
 &rst iat=2135,2133,2131,2111, &end
#
#  trans-omega constraint for residue 132
 &rst iat=2164,2154,2152,2135, &end
#
#  trans-omega constraint for residue 133
 &rst iat=2170,2168,2166,2164, &end
#
#  trans-omega constraint for residue 134
 &rst iat=2186,2184,2182,2170, &end
#
#  trans-omega constraint for residue 135
 &rst iat=2210,2208,2206,2186, &end
#
#  trans-omega constraint for residue 136
 &rst iat=2227,2225,2223,2210, &end
#
#  trans-omega constraint for residue 137
 &rst iat=2243,2241,2239,2227, &end
#
#  trans-omega constraint for residue 138
 &rst iat=2259,2257,2255,2243, &end
#
#  trans-omega constraint for residue 139
 &rst iat=2270,2268,2266,2259, &end
#
#  trans-omega constraint for residue 140
 &rst iat=2290,2288,2286,2270, &end
#
#  trans-omega constraint for residue 141
 &rst iat=2312,2310,2308,2290, &end
#
#  trans-omega constraint for residue 142
 &rst iat=2336,2334,2332,2312, &end
#
#  trans-omega constraint for residue 143
 &rst iat=2348,2346,2344,2336, &end
#
#  trans-omega constraint for residue 144
 &rst iat=2364,2362,2360,2348, &end
#
#  trans-omega constraint for residue 145
 &rst iat=2385,2383,2381,2364, &end
#
#  trans-omega constraint for residue 146
 &rst iat=2409,2407,2405,2385, &end
#
#  trans-omega constraint for residue 147
 &rst iat=2433,2431,2429,2409, &end
#
#  trans-omega constraint for residue 148
 &rst iat=2449,2447,2445,2433, &end
#
#  trans-omega constraint for residue 149
 &rst iat=2466,2464,2462,2449, &end
#
#  trans-omega constraint for residue 150
 &rst iat=2488,2486,2484,2466, &end
#
#  trans-omega constraint for residue 151
 &rst iat=2503,2501,2499,2488, &end
#
#  trans-omega constraint for residue 152
 &rst iat=2523,2521,2519,2503, &end
#
#  trans-omega constraint for residue 153
 &rst iat=2533,2531,2529,2523, &end
#
#  trans-omega constraint for residue 154
 &rst iat=2544,2542,2540,2533, &end
#
#  trans-omega constraint for residue 155
 &rst iat=2560,2558,2556,2544, &end
#
#  trans-omega constraint for residue 156
 &rst iat=2576,2574,2572,2560, &end
#
#  trans-omega constraint for residue 157
 &rst iat=2593,2591,2589,2576, &end
#
#  trans-omega constraint for residue 158
 &rst iat=2604,2602,2600,2593, &end
#
#  trans-omega constraint for residue 159
 &rst iat=2623,2621,2619,2604, &end
#
#  trans-omega constraint for residue 160
 &rst iat=2640,2638,2636,2623, &end
#
#  trans-omega constraint for residue 161
 &rst iat=2655,2653,2651,2640, &end
#
#  trans-omega constraint for residue 162
 &rst iat=2669,2667,2665,2655, &end
#
#  trans-omega constraint for residue 163
 &rst iat=2691,2681,2679,2669, &end
#
#  trans-omega constraint for residue 164
 &rst iat=2697,2695,2693,2691, &end

#  cis-omega constraint for residue 90
 &rst iat=1480,1470,1468,1450,
 r1=-30., r2=-10., r3=10., r4=30., rk2 = 150., rk3=150.,  &end
 
#
#    2 ILE  HB            1 MET  HA          5.50    (#      1:20  Unique         4.23, 4.69 A)
 &rst
  ixpk= 1, nxpk= 20, iat=  25,   6, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 &end
#
#    0 AMB  20-2:2        0 AMB  20-1:2      3.50    (#      2:20  Double Ambig)
 &rst
  ixpk= 2, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 863, 864,2213,2214,
 igr2= 812,2211,
 &end
#
#    0 AMB  20-2:3        1 MET  HA          5.50    (#      3:20  Single Ambig)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=  15,  16,  17, 653, 654,
 &end
#
#    2 ILE  HG1-          1 MET  HA          5.50    (#      4:20  Unique         3.14, 4.49 A)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    1 MET  HG-           1 MET  HA          5.50    (#      5:20  Unique         2.38, 3.33 A)
 &rst
  ixpk= 5, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
#    1 MET  HG+           1 MET  HA          5.50    (#      6:20  Unique         2.38, 3.33 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
#    2 ILE  HN            1 MET  HA          5.50    (#      8:20  Unique         2.16, 2.66 A)
 &rst
  ixpk= 8, nxpk= 20, iat=  21,   6, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:10       0 AMB  20-1:10     2.80    (#     10:20  Double Ambig)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=  11,  12, 555, 556,
 igr2=   8,   9,   8,   9, 589, 590,
 &end
#
#    0 AMB  20-2:11       0 AMB  20-1:11     4.50    (#     11:20  Double Ambig)
 &rst
  ixpk= 11, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=  11,  12,  11,  12, 555, 556,
 igr2=   8,   9,   8,   9, 589, 590,
 &end
#
#    0 AMB  20-2:12       0 AMB  20-1:12     5.50    (#     12:20  Double Ambig)
 &rst
  ixpk= 12, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 650, 651, 650, 651,
 igr2=   8,   9,   8,   9,
 &end
#
#    1 MET  HA            0 AMB  20-1:13     3.50    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=   8,   9,   8,   9,
 &end
#
#    2 ILE  HN            0 AMB  20-1:15     5.50    (#     15:20  Single Ambig)
 &rst
  ixpk= 15, nxpk= 20, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=   8,   9,   8,   9,
 &end
#
#    8 ARG  HA            1 MET  HG-         5.50    (#     16:20  Unique         4.18, 6.19 A)
 &rst
  ixpk= 16, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  11,  12,
 &end
#
#    1 MET  HA            1 MET  HG+         5.50    (#     19:20  Unique         2.38, 3.33 A)
 &rst
  ixpk= 19, nxpk= 20, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  11,  12,
 &end
#
#    1 MET  HA            1 MET  HG-         5.50    (#     20:20  Unique         2.38, 3.33 A)
 &rst
  ixpk= 20, nxpk= 20, iat=   6,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:21       1 MET  HG-         5.50    (#     21:20  Single Ambig)
 &rst
  ixpk= 21, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 129, 130, 129, 130,
 igr2=  11,  12,
 &end
#
#    0 AMB  20-2:22       0 AMB  20-1:22     5.50    (#     22:20  Double Ambig)
 &rst
  ixpk= 22, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 129, 130, 129, 130,
 igr2=  11,  12,  11,  12,
 &end
#
#    0 AMB  20-2:23       0 AMB  20-1:23     4.50    (#     23:20  Double Ambig)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=   8,   9,   8,   9,
 igr2=  11,  12,  11,  12,
 &end
#
#    0 AMB  20-2:24       1 MET  HG-         2.80    (#     24:20  Single Ambig)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=   8,   9,   8,   9,
 igr2=  11,  12,
 &end
#
#    1 MET  ME            1 MET  HG+         5.50    (#     25:20  Unique         2.04, 3.38 A)
 &rst
  ixpk= 25, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  15,  16,  17,
 igr2=  11,  12,
 &end
#
#    1 MET  ME            1 MET  HG-         5.50    (#     26:20  Unique         2.04, 3.38 A)
 &rst
  ixpk= 26, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  15,  16,  17,
 igr2=  11,  12,
 &end
#
#   40 ILE  QG2           1 MET  ME          5.50    (#     27:20  Unique         4.06, 6.61 A)
 &rst
  ixpk= 27, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 622, 623, 624,
 igr2=  15,  16,  17,
 &end
#
#    1 MET  HG+           1 MET  ME          5.50    (#     28:20  Unique         2.04, 3.38 A)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  11,  12,
 igr2=  15,  16,  17,
 &end
#
#    1 MET  HG-           1 MET  ME          5.50    (#     29:20  Unique         2.04, 3.38 A)
 &rst
  ixpk= 29, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  11,  12,
 igr2=  15,  16,  17,
 &end
#
#    0 AMB  20-2:31       1 MET  ME          5.50    (#     31:20  Single Ambig)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  23,   6, 665, 666,
 igr2=  15,  16,  17,
 &end
#
#    3 ASP  HA            1 MET  ME          5.50    (#     32:20  Unique         2.34, 5.22 A)
 &rst
  ixpk= 32, nxpk= 20, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  15,  16,  17,
 &end
#
#    2 ILE  HN            2 ILE  HA          5.50    (#     33:20  Unique         2.27, 2.68 A)
 &rst
  ixpk= 33, nxpk= 20, iat=  21,  23, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    3 ASP  HN            2 ILE  HA          3.50    (#     34:20  Unique         2.17, 2.31 A)
 &rst
  ixpk= 34, nxpk= 20, iat=  40,  23, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:35       2 ILE  HA          5.50    (#     35:20  Single Ambig)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 104,  76,
 &end
#
#   40 ILE  HN           40 ILE  HA          5.50    (#     36:20  Unique         2.76, 2.83 A)
 &rst
  ixpk= 36, nxpk= 20, iat= 616, 618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ARG  HA            2 ILE  HA          5.50    (#     37:20  Unique         2.21, 3.05 A)
 &rst
  ixpk= 37, nxpk= 20, iat= 106,  23, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    3 ASP  HA            2 ILE  HA          5.50    (#     38:20  Unique         4.32, 4.41 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  42,  23, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:39       2 ILE  HA          5.50    (#     39:20  Single Ambig)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130, 129, 130,
 &end
#
#    3 ASP  HB+           2 ILE  HA          5.50    (#     40:20  Unique         3.93, 4.60 A)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  44,  45,
 &end
#
#    3 ASP  HB-           2 ILE  HA          5.50    (#     41:20  Unique         3.93, 4.60 A)
 &rst
  ixpk= 41, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  44,  45,
 &end
#
#    0 AMB  20-2:42       0 AMB  20-1:42     5.50    (#     42:20  Double Ambig)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  11,  12, 639, 640,
 igr2=  23, 618,
 &end
#
#    0 AMB  20-2:43       0 AMB  20-1:43     5.50    (#     43:20  Double Ambig)
 &rst
  ixpk= 43, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 674, 675, 674, 675, 677, 678,   8,   9,   8,   9,
      
 igr2= 618,  23,
 &end
#
#    0 AMB  20-2:44       2 ILE  HA          5.50    (#     44:20  Single Ambig)
 &rst
  ixpk= 44, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 132, 133, 108, 109, 108, 109, 111, 112,
 &end
#
#    0 AMB  20-2:45       0 AMB  20-1:45     5.50    (#     45:20  Double Ambig)
 &rst
  ixpk= 45, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  15,  16,  17, 135, 136, 135, 136,  87,  88,
 igr2=  23, 618,
 &end
#
#    2 ILE  HB            2 ILE  HA          5.50    (#     46:20  Unique         2.96, 3.01 A)
 &rst
  ixpk= 46, nxpk= 20, iat=  25,  23, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    2 ILE  HG1-          2 ILE  HA          5.50    (#     47:20  Unique         2.28, 3.41 A)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    2 ILE  HG1+          2 ILE  HA          5.50    (#     48:20  Unique         2.28, 3.41 A)
 &rst
  ixpk= 48, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    0 AMB  20-2:49       0 AMB  20-1:49     4.50    (#     49:20  Double Ambig)
 &rst
  ixpk= 49, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  34,  35,  36, 626, 627,
 igr2=  23, 618,
 &end
#
#    2 ILE  QG2           2 ILE  HA          3.50    (#     50:20  Unique         2.03, 3.01 A)
 &rst
  ixpk= 50, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  27,  28,  29,
 &end
#
#    2 ILE  HN            2 ILE  HB          5.50    (#     51:20  Unique         2.61, 3.16 A)
 &rst
  ixpk= 51, nxpk= 20, iat=  21,  25, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    3 ASP  HN            2 ILE  HB          5.50    (#     52:20  Unique         2.77, 3.65 A)
 &rst
  ixpk= 52, nxpk= 20, iat=  40,  25, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:53       2 ILE  HB          5.50    (#     53:20  Single Ambig)
 &rst
  ixpk= 53, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  23,   6,
 &end
#
#    0 AMB  20-2:55       2 ILE  HB          5.50    (#     55:20  Single Ambig)
 &rst
  ixpk= 55, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1472,1473,1472,1473,
 &end
#
#   90 PRO  HB+           2 ILE  HB          5.50    (#     56:20  Unique         4.07, 5.23 A)
 &rst
  ixpk= 56, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1478,1479,
 &end
#
#    0 AMB  20-2:57       2 ILE  HB          5.50    (#     57:20  Single Ambig)
 &rst
  ixpk= 57, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=   8,   9,   8,   9,
 &end
#
#   90 PRO  HG+           2 ILE  HB          5.50    (#     58:20  Unique         1.95, 3.33 A)
 &rst
  ixpk= 58, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1475,1476,
 &end
#
#    2 ILE  HG1-          2 ILE  HB          4.50    (#     59:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 59, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  31,  32,
 &end
#
#    2 ILE  HG1+          2 ILE  HB          5.50    (#     60:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 60, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    2 ILE  QD1           2 ILE  HB          4.50    (#     61:20  Unique         2.08, 3.72 A)
 &rst
  ixpk= 61, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  34,  35,  36,
 &end
#
#    2 ILE  QG2           2 ILE  HB          3.50    (#     62:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 62, nxpk= 20, iat=  -1,  25, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=  27,  28,  29,
 &end
#
#    2 ILE  HN            2 ILE  HG1+        5.50    (#     63:20  Unique         1.94, 3.49 A)
 &rst
  ixpk= 63, nxpk= 20, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    2 ILE  HN            2 ILE  HG1-        5.50    (#     64:20  Unique         1.94, 3.49 A)
 &rst
  ixpk= 64, nxpk= 20, iat=  21,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    3 ASP  HN            2 ILE  HG1-        5.50    (#     65:20  Unique         4.03, 4.97 A)
 &rst
  ixpk= 65, nxpk= 20, iat=  40,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:66       0 AMB  20-1:66     5.50    (#     66:20  Double Ambig)
 &rst
  ixpk= 66, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  40,  52,
 igr2=  31,  32,  31,  32,
 &end
#
#    0 AMB  20-2:67       0 AMB  20-1:67     5.50    (#     67:20  Double Ambig)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  23, 618,
 igr2=  31,  32, 626, 627,
 &end
#
#    0 AMB  20-2:68       0 AMB  20-1:68     5.50    (#     68:20  Double Ambig)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  23,   6,
 igr2=  31,  32,  31,  32,
 &end
#
#   83 LEU  HA           83 LEU  HG          5.50    (#     69:20  Unique         2.79, 3.46 A)
 &rst
  ixpk= 69, nxpk= 20, iat=1342,1347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 CYS  HB+           2 ILE  HG1-        5.50    (#     70:20  Unique         2.01, 5.74 A)
 &rst
  ixpk= 70, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1505,1506,
 igr2=  31,  32,
 &end
#
#   92 CYS  HB+           2 ILE  HG1+        5.50    (#     71:20  Unique         2.01, 5.74 A)
 &rst
  ixpk= 71, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1505,1506,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:72       0 AMB  20-1:72     5.50    (#     72:20  Double Ambig)
 &rst
  ixpk= 72, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1478,1479,1287,1288,
 igr2=  31,  32,1347,
 &end
#
#    0 AMB  20-2:73       0 AMB  20-1:73     2.80    (#     73:20  Double Ambig)
 &rst
  ixpk= 73, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1344,1345,  25,
 igr2=1347,  31,  32,
 &end
#
#    2 ILE  HB            2 ILE  HG1+        5.50    (#     74:20  Unique         2.41, 2.53 A)
 &rst
  ixpk= 74, nxpk= 20, iat=  25,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:75       0 AMB  20-1:75     5.50    (#     75:20  Double Ambig)
 &rst
  ixpk= 75, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 108, 109, 108, 109,
 igr2=  31,  32,  31,  32,
 &end
#
#    0 AMB  20-2:76       2 ILE  HG1-        4.50    (#     76:20  Single Ambig)
 &rst
  ixpk= 76, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 108, 109, 108, 109,
 igr2=  31,  32,
 &end
#
#    2 ILE  QD1           2 ILE  HG1+        4.50    (#     77:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  34,  35,  36,
 igr2=  31,  32,
 &end
#
#    2 ILE  QG2           2 ILE  HG1+        3.50    (#     78:20  Unique         2.08, 3.42 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  27,  28,  29,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:80       0 AMB  20-1:80     2.80    (#     80:20  Double Ambig)
 &rst
  ixpk= 80, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1=1270,1271,1272,1274,1275,1276,1006,1007,1008,1010,
      1011,1012,1006,1007,1008,1010,1011,1012,  27,  28,
        29,1349,1350,1351,1353,1354,1355,1349,1350,1351,
      1353,1354,1355,
 igr2=1347,1686,  31,  32,
 &end
#
#    8 ARG  HA            2 ILE  HG1+        5.50    (#     81:20  Unique         2.08, 4.90 A)
 &rst
  ixpk= 81, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    8 ARG  HA            2 ILE  HG1-        5.50    (#     82:20  Unique         2.08, 4.90 A)
 &rst
  ixpk= 82, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  31,  32,
 &end
#
#    0 AMB  20-2:83       2 ILE  QD1         5.50    (#     83:20  Single Ambig)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1501,  52,1485,
 igr2=  34,  35,  36,
 &end
#
#    8 ARG  HA            2 ILE  QD1         5.50    (#     85:20  Unique         2.00, 3.79 A)
 &rst
  ixpk= 85, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  34,  35,  36,
 &end
#
#   92 CYS  HA            2 ILE  QD1         5.50    (#     86:20  Unique         2.06, 4.72 A)
 &rst
  ixpk= 86, nxpk= 20, iat=1503,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:87       2 ILE  QD1         5.50    (#     87:20  Single Ambig)
 &rst
  ixpk= 87, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  23,   6,
 igr2=  34,  35,  36,
 &end
#
#    6 GLY  HA-           2 ILE  QD1         5.50    (#     88:20  Unique         2.53, 5.87 A)
 &rst
  ixpk= 88, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  78,  79,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:89       2 ILE  QD1         5.50    (#     89:20  Single Ambig)
 &rst
  ixpk= 89, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1472,1473,1472,1473,
 igr2=  34,  35,  36,
 &end
#
#   92 CYS  HB+           2 ILE  QD1         5.50    (#     90:20  Unique         2.12, 5.04 A)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1505,1506,
 igr2=  34,  35,  36,
 &end
#
#   92 CYS  HB-           2 ILE  QD1         5.50    (#     91:20  Unique         2.12, 5.04 A)
 &rst
  ixpk= 91, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1505,1506,
 igr2=  34,  35,  36,
 &end
#
#    0 AMB  20-2:92       2 ILE  QD1         4.50    (#     92:20  Single Ambig)
 &rst
  ixpk= 92, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 111, 112, 108, 109, 108, 109,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HB            2 ILE  QD1         3.50    (#     93:20  Unique         2.08, 3.72 A)
 &rst
  ixpk= 93, nxpk= 20, iat=  25,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HG1-          2 ILE  QD1         3.50    (#     94:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 94, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  31,  32,
 igr2=  34,  35,  36,
 &end
#
#    2 ILE  HG1+          2 ILE  QD1         3.50    (#     95:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=  31,  32,
 igr2=  34,  35,  36,
 &end
#
#   93 ILE  HN            2 ILE  QG2         5.50    (#     96:20  Unique         4.25, 5.39 A)
 &rst
  ixpk= 96, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  27,  28,  29,
 &end
#
#    3 ASP  HN            2 ILE  QG2         3.50    (#     97:20  Unique         1.96, 2.95 A)
 &rst
  ixpk= 97, nxpk= 20, iat=  40,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:98       2 ILE  QG2         4.50    (#     98:20  Single Ambig)
 &rst
  ixpk= 98, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  76, 104,
 igr2=  27,  28,  29,
 &end
#
#    5 ASP  HN            2 ILE  QG2         5.50    (#     99:20  Unique         3.42, 5.55 A)
 &rst
  ixpk= 99, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:100      2 ILE  QG2         5.50    (#    100:20  Single Ambig)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  42,1481,
 igr2=  27,  28,  29,
 &end
#
#    2 ILE  HA            2 ILE  QG2         3.50    (#    102:20  Unique         2.03, 3.01 A)
 &rst
  ixpk= 102, nxpk= 20, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=  27,  28,  29,
 &end
#
#    6 GLY  HA-           2 ILE  QG2         4.50    (#    103:20  Unique         1.95, 3.39 A)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  78,  79,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:104      2 ILE  QG2         5.50    (#    104:20  Single Ambig)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1472,1473,1472,1473,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:105      2 ILE  QG2         5.50    (#    105:20  Single Ambig)
 &rst
  ixpk= 105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  87,  88,  68,  69,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:106      2 ILE  QG2         5.50    (#    106:20  Single Ambig)
 &rst
  ixpk= 106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1505,1506,  56,  57,
 igr2=  27,  28,  29,
 &end
#
#   90 PRO  HB+           2 ILE  QG2         5.50    (#    107:20  Unique         3.15, 5.06 A)
 &rst
  ixpk= 107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1478,1479,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:108      2 ILE  QG2         5.50    (#    108:20  Single Ambig)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1545,1546,   8,   9,   8,   9,
 igr2=  27,  28,  29,
 &end
#
#    2 ILE  HB            2 ILE  QG2         2.80    (#    109:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 109, nxpk= 20, iat=  25,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  27,  28,  29,
 &end
#
#    2 ILE  HG1-          2 ILE  QG2         4.50    (#    110:20  Unique         2.08, 3.42 A)
 &rst
  ixpk= 110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  31,  32,
 igr2=  27,  28,  29,
 &end
#
#   96 LYS  HB-           2 ILE  QG2         5.50    (#    111:20  Unique         5.93, 7.53 A)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1559,1560,
 igr2=  27,  28,  29,
 &end
#
#    2 ILE  HG1+          2 ILE  QG2         4.50    (#    112:20  Unique         2.08, 3.42 A)
 &rst
  ixpk= 112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  31,  32,
 igr2=  27,  28,  29,
 &end
#
#    0 AMB  20-2:113      3 ASP  HA          3.50    (#    113:20  Single Ambig)
 &rst
  ixpk= 113, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  40,  52,
 &end
#
#    4 ASP  HA            3 ASP  HA          5.50    (#    114:20  Unique         4.30, 4.52 A)
 &rst
  ixpk= 114, nxpk= 20, iat=  54,  42, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:115      0 AMB  20-1:115    5.50    (#    115:20  Double Ambig)
 &rst
  ixpk= 115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  23,   6,1763,1764,
 igr2=  42, 914,
 &end
#
#    0 AMB  20-2:116      0 AMB  20-1:116    4.50    (#    116:20  Double Ambig)
 &rst
  ixpk= 116, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 992, 993, 992, 993,  44,  45,
 igr2= 914,  42,
 &end
#
#    3 ASP  HB-           3 ASP  HA          4.50    (#    117:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 117, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  44,  45,
 &end
#
#    1 MET  ME            3 ASP  HA          5.50    (#    118:20  Unique         2.34, 5.22 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1,  42, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  15,  16,  17,
 &end
#
#    0 AMB  20-2:119     60 LEU  HA          5.50    (#    119:20  Single Ambig)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 916, 917, 919,
 &end
#
#   63 LYS  HG+          60 LEU  HA          5.50    (#    120:20  Unique         3.66, 5.41 A)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 973, 974,
 &end
#
#    0 AMB  20-2:121      0 AMB  20-1:121    5.50    (#    121:20  Double Ambig)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  27,  28,  29,1006,1007,1008,1010,1011,1012,
 igr2=  42, 914,
 &end
#
#    0 AMB  20-2:122      0 AMB  20-1:122    2.80    (#    122:20  Double Ambig)
 &rst
  ixpk= 122, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  52,2335,
 igr2=  44,  45,2339,2340,2339,2340,
 &end
#
#    5 ASP  HN            0 AMB  20-1:123    5.50    (#    123:20  Single Ambig)
 &rst
  ixpk= 123, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=  68,  69,  44,  45,
 &end
#
#  143 VAL  HN            0 AMB  20-1:125    4.50    (#    125:20  Single Ambig)
 &rst
  ixpk= 125, nxpk= 20, iat=2347,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2339,2340,2339,2340,
 &end
#
#    0 AMB  20-2:126      0 AMB  20-1:126    5.50    (#    126:20  Double Ambig)
 &rst
  ixpk= 126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2311,2279,2283,
 igr2=2339,2340,2339,2340,2339,2340,
 &end
#
#    7 TYR  HD            0 AMB  20-1:127    5.50    (#    127:20  Single Ambig)
 &rst
  ixpk= 127, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  91, 100,
 igr2=  68,  69,  44,  45,
 &end
#
#    7 TYR  HE            5 ASP  HB-         5.50    (#    128:20  Unique         3.16, 5.47 A)
 &rst
  ixpk= 128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:129      0 AMB  20-1:129    3.50    (#    129:20  Double Ambig)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  42,  66,
 igr2=  44,  45,  68,  69,
 &end
#
#    3 ASP  HA            3 ASP  HB+         4.50    (#    130:20  Unique         2.34, 2.79 A)
 &rst
  ixpk= 130, nxpk= 20, iat=  42,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  44,  45,
 &end
#
#    0 AMB  20-2:131      0 AMB  20-1:131    5.50    (#    131:20  Double Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2418,2419,2418,2419,2418,2419,
 igr2=2339,2340,2339,2340,2339,2340,
 &end
#
#    0 AMB  20-2:132      0 AMB  20-1:132    5.50    (#    132:20  Double Ambig)
 &rst
  ixpk= 132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=  87,  88,  15,  16,  17,
 igr2=  44,  45,  44,  45,
 &end
#
#    0 AMB  20-2:133      0 AMB  20-1:133    5.50    (#    133:20  Double Ambig)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 132, 133,1607,1608,
 igr2=  44,  45,1141,1142,
 &end
#
#    0 AMB  20-2:134      0 AMB  20-1:134    5.50    (#    134:20  Double Ambig)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.42, r4=11.92,
 igr1=2318,2319,2318,2319,2315,2316,2391,2392,2391,2392,
      
 igr2=2339,2340,2339,2340,2339,2340,2339,2340,
 &end
#
#    0 AMB  20-2:135      0 AMB  20-1:135    5.50    (#    135:20  Double Ambig)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.53, r4=13.03,
 igr1=1475,1476,1478,1479,1475,1476,2415,2416,2415,2416,
      2412,2413,2412,2413,
 igr2=  68,  69,  44,  45,2339,2340,2339,2340,2339,2340,
      
 &end
#
#    0 AMB  20-2:136      3 ASP  HB-         5.50    (#    136:20  Single Ambig)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=  87,  88,  15,  16,  17,
 igr2=  44,  45,
 &end
#
#    0 AMB  20-2:137      0 AMB  20-1:137    5.50    (#    137:20  Double Ambig)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=2339,2340,2339,2340,2339,2340,
 &end
#
#    4 ASP  HN            4 ASP  HA          4.50    (#    138:20  Unique         2.28, 2.80 A)
 &rst
  ixpk= 138, nxpk= 20, iat=  52,  54, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 ASP  HN            4 ASP  HA          4.50    (#    139:20  Unique         3.49, 3.54 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  64,  54, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:141      4 ASP  HA          5.50    (#    141:20  Single Ambig)
 &rst
  ixpk= 141, nxpk= 20, iat=  -1,  54, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  68,  69,  87,  88,
 &end
#
#    3 ASP  HB+           4 ASP  HA          5.50    (#    142:20  Unique         3.84, 5.06 A)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  54, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  44,  45,
 &end
#
#    4 ASP  HB+           4 ASP  HA          3.50    (#    143:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 143, nxpk= 20, iat=  -1,  54, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  56,  57,
 &end
#
#    4 ASP  HB-           4 ASP  HA          3.50    (#    144:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1,  54, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  56,  57,
 &end
#
#   90 PRO  HG+           4 ASP  HA          5.50    (#    145:20  Unique         3.11, 5.73 A)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1,  54, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1475,1476,
 &end
#
#    4 ASP  HA            4 ASP  HB-         4.50    (#    146:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 146, nxpk= 20, iat=  54,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  56,  57,
 &end
#
#    4 ASP  HA            4 ASP  HB+         3.50    (#    147:20  Unique         2.39, 2.80 A)
 &rst
  ixpk= 147, nxpk= 20, iat=  54,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=  56,  57,
 &end
#
#    5 ASP  HN            4 ASP  HB+         5.50    (#    148:20  Unique         1.90, 2.54 A)
 &rst
  ixpk= 148, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  56,  57,
 &end
#
#    5 ASP  HN            4 ASP  HB-         5.50    (#    149:20  Unique         1.90, 2.54 A)
 &rst
  ixpk= 149, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  56,  57,
 &end
#
#    6 GLY  HN            5 ASP  HA          5.50    (#    150:20  Unique         3.04, 3.46 A)
 &rst
  ixpk= 150, nxpk= 20, iat=  76,  66, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:151      0 AMB  20-1:151    4.50    (#    151:20  Double Ambig)
 &rst
  ixpk= 151, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  64,1449,
 igr2=  66,1425,
 &end
#
#    0 AMB  20-2:154      0 AMB  20-1:154    3.50    (#    154:20  Double Ambig)
 &rst
  ixpk= 154, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  68,  69,1462,1463,1462,1463,
 igr2=  66,1425,
 &end
#
#    5 ASP  HB-           5 ASP  HA          3.50    (#    155:20  Unique         2.45, 2.80 A)
 &rst
  ixpk= 155, nxpk= 20, iat=  -1,  66, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  68,  69,
 &end
#
#    5 ASP  HA            5 ASP  HB+         4.50    (#    156:20  Unique         2.45, 2.80 A)
 &rst
  ixpk= 156, nxpk= 20, iat=  66,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  68,  69,
 &end
#
#    7 TYR  HD            5 ASP  HB+         5.50    (#    157:20  Unique         3.21, 5.55 A)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=  68,  69,
 &end
#
#    5 ASP  HN            5 ASP  HB+         5.50    (#    158:20  Unique         2.08, 2.96 A)
 &rst
  ixpk= 158, nxpk= 20, iat=  64,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  68,  69,
 &end
#
#    0 AMB  20-2:159      0 AMB  20-1:159    5.50    (#    159:20  Double Ambig)
 &rst
  ixpk= 159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1525,1526,1527,1522,1523,
 igr2=  78,  79,  78,  79,
 &end
#
#    0 AMB  20-2:160      6 GLY  HA-         5.50    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1525,1526,1527,1522,1523,
 igr2=  78,  79,
 &end
#
#   93 ILE  HG1-          6 GLY  HA+         5.50    (#    161:20  Unique         1.97, 4.09 A)
 &rst
  ixpk= 161, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1522,1523,
 igr2=  78,  79,
 &end
#
#   93 ILE  HG1-          6 GLY  HA-         5.50    (#    162:20  Unique         1.97, 4.09 A)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1522,1523,
 igr2=  78,  79,
 &end
#
#    2 ILE  QG2           6 GLY  HA+         5.50    (#    163:20  Unique         1.95, 3.39 A)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2=  78,  79,
 &end
#
#    2 ILE  QG2           6 GLY  HA-         5.50    (#    164:20  Unique         1.95, 3.39 A)
 &rst
  ixpk= 164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2=  78,  79,
 &end
#
#   90 PRO  HG-           6 GLY  HA+         5.50    (#    165:20  Unique         1.99, 3.99 A)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1475,1476,
 igr2=  78,  79,
 &end
#
#    0 AMB  20-2:166      6 GLY  HA-         5.50    (#    166:20  Single Ambig)
 &rst
  ixpk= 166, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1475,1476,1478,1479,
 igr2=  78,  79,
 &end
#
#    0 AMB  20-2:167     43 GLY  HA-         5.50    (#    167:20  Single Ambig)
 &rst
  ixpk= 167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 674, 675, 674, 675, 653, 654, 677, 678,
 igr2= 665, 666,
 &end
#
#    6 GLY  HN            6 GLY  HA-         4.50    (#    168:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 168, nxpk= 20, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  78,  79,
 &end
#
#    6 GLY  HN            6 GLY  HA+         5.50    (#    169:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 169, nxpk= 20, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  78,  79,
 &end
#
#    7 TYR  HN            7 TYR  HA          5.50    (#    170:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 170, nxpk= 20, iat=  83,  85, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ARG  HN            7 TYR  HA          4.50    (#    171:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 171, nxpk= 20, iat= 104,  85, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   94 GLY  HN            7 TYR  HA          5.50    (#    172:20  Unique         2.70, 3.19 A)
 &rst
  ixpk= 172, nxpk= 20, iat=1531,  85, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HD1          74 TRP  HA          5.50    (#    173:20  Unique         3.88, 4.12 A)
 &rst
  ixpk= 173, nxpk= 20, iat=1159,1153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 TYR  HD            7 TYR  HA          5.50    (#    174:20  Unique         1.73, 3.24 A)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#   95 GLN  HA            7 TYR  HA          5.50    (#    175:20  Unique         2.71, 3.39 A)
 &rst
  ixpk= 175, nxpk= 20, iat=1540,  85, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:177      0 AMB  20-1:177    5.50    (#    177:20  Double Ambig)
 &rst
  ixpk= 177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1155,1156,  87,  88,
 igr2=1153,  85,
 &end
#
#    7 TYR  HB-           7 TYR  HA          5.50    (#    178:20  Unique         2.46, 2.78 A)
 &rst
  ixpk= 178, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#  133 VAL  HB          130 TRP  HA          5.50    (#    179:20  Unique         2.36, 3.43 A)
 &rst
  ixpk= 179, nxpk= 20, iat=2173,2112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:180      0 AMB  20-1:180    5.50    (#    180:20  Double Ambig)
 &rst
  ixpk= 180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1607,1608,1179,1180, 111, 112, 108, 109,
 igr2=1153,  85,
 &end
#
#    0 AMB  20-2:181      0 AMB  20-1:181    5.50    (#    181:20  Double Ambig)
 &rst
  ixpk= 181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2459,2460,2461,1201,1202,
 igr2=2112,  85,
 &end
#
#  133 VAL  MGY         130 TRP  HA          5.50    (#    182:20  Unique         1.95, 3.74 A)
 &rst
  ixpk= 182, nxpk= 20, iat=  -1,2112, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:183      7 TYR  HA          5.50    (#    183:20  Single Ambig)
 &rst
  ixpk= 183, nxpk= 20, iat=  -1,  85, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1522,1523,1525,1526,1527,
 &end
#
#    0 AMB  20-2:184      0 AMB  20-1:184    5.50    (#    184:20  Double Ambig)
 &rst
  ixpk= 184, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1=  27,  28,  29,1562,1563,1270,1271,1272,1274,1275,
      1276, 329, 330, 331, 333, 334, 335,
 igr2=  85,1153,2112,
 &end
#
#    0 AMB  20-2:185      0 AMB  20-1:185    5.50    (#    185:20  Double Ambig)
 &rst
  ixpk= 185, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1562,1563,  27,  28,  29,
 igr2=  87,  88,  87,  88,
 &end
#
#   96 LYS  HB+           7 TYR  HB+         5.50    (#    186:20  Unique         1.94, 2.79 A)
 &rst
  ixpk= 186, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1559,1560,
 igr2=  87,  88,
 &end
#
#    7 TYR  HA            7 TYR  HB+         5.50    (#    187:20  Unique         2.46, 2.78 A)
 &rst
  ixpk= 187, nxpk= 20, iat=  85,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  87,  88,
 &end
#
#    7 TYR  HD            7 TYR  HB+         5.50    (#    188:20  Unique         2.35, 3.08 A)
 &rst
  ixpk= 188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=  87,  88,
 &end
#
#    7 TYR  HN            7 TYR  HB+         5.50    (#    189:20  Unique         2.24, 3.06 A)
 &rst
  ixpk= 189, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  87,  88,
 &end
#
#    0 AMB  20-2:190      7 TYR  HB-         5.50    (#    190:20  Single Ambig)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=1562,1563,  27,  28,  29,
 igr2=  87,  88,
 &end
#
#    7 TYR  HA            7 TYR  HB-         5.50    (#    191:20  Unique         2.46, 2.78 A)
 &rst
  ixpk= 191, nxpk= 20, iat=  85,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  87,  88,
 &end
#
#   95 GLN  HA            7 TYR  HB-         5.50    (#    192:20  Unique         2.97, 4.24 A)
 &rst
  ixpk= 192, nxpk= 20, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  87,  88,
 &end
#
#    7 TYR  HD            7 TYR  HB-         5.50    (#    193:20  Unique         2.35, 3.08 A)
 &rst
  ixpk= 193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=  87,  88,
 &end
#
#    7 TYR  HE            7 TYR  HB-         5.50    (#    194:20  Unique         4.64, 5.06 A)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=  87,  88,
 &end
#
#    7 TYR  HN            7 TYR  HB-         5.50    (#    195:20  Unique         2.24, 3.06 A)
 &rst
  ixpk= 195, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  87,  88,
 &end
#
#    3 ASP  HN            8 ARG  HA          5.50    (#    196:20  Unique         3.74, 4.50 A)
 &rst
  ixpk= 196, nxpk= 20, iat=  40, 106, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ARG  HN            8 ARG  HA          5.50    (#    197:20  Unique         2.84, 2.88 A)
 &rst
  ixpk= 197, nxpk= 20, iat= 104, 106, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:198      8 ARG  HA          5.50    (#    198:20  Single Ambig)
 &rst
  ixpk= 198, nxpk= 20, iat=  -1, 106, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130, 129, 130,
 &end
#
#    2 ILE  HA            8 ARG  HA          5.50    (#    199:20  Unique         2.21, 3.05 A)
 &rst
  ixpk= 199, nxpk= 20, iat=  23, 106, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:200      8 ARG  HA          4.50    (#    200:20  Single Ambig)
 &rst
  ixpk= 200, nxpk= 20, iat=  -1, 106, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 111, 112, 108, 109, 108, 109,
 &end
#
#    8 ARG  HN            0 AMB  20-1:201    5.50    (#    201:20  Single Ambig)
 &rst
  ixpk= 201, nxpk= 20, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 108, 109, 108, 109,
 &end
#
#    8 ARG  HA            0 AMB  20-1:203    5.50    (#    203:20  Single Ambig)
 &rst
  ixpk= 203, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 108, 109, 108, 109,
 &end
#
#  163 PRO  HD-         163 PRO  HB-         5.50    (#    204:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2689,2690,
 &end
#
#  163 PRO  HD+         163 PRO  HB-         5.50    (#    205:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 205, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2689,2690,
 &end
#
#    0 AMB  20-2:206      0 AMB  20-1:206    5.50    (#    206:20  Double Ambig)
 &rst
  ixpk= 206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 114, 115, 114, 115,
 igr2= 108, 109, 108, 109,
 &end
#
#    8 ARG  HG-           0 AMB  20-1:207    4.50    (#    207:20  Single Ambig)
 &rst
  ixpk= 207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 111, 112,
 igr2= 108, 109, 108, 109,
 &end
#
#    0 AMB  20-2:208      0 AMB  20-1:208    5.50    (#    208:20  Double Ambig)
 &rst
  ixpk= 208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1=1491,1492,1493,1495,1496,1497, 622, 623, 624, 162,
       163, 164, 166, 167, 168,
 igr2= 108, 109, 108, 109, 108, 109,
 &end
#
#    2 ILE  QD1           0 AMB  20-1:209    4.50    (#    209:20  Single Ambig)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=  34,  35,  36,
 igr2= 108, 109, 108, 109,
 &end
#
#    8 ARG  HA            8 ARG  HG-         5.50    (#    211:20  Unique         2.05, 3.11 A)
 &rst
  ixpk= 211, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 111, 112,
 &end
#
#    8 ARG  HA            8 ARG  HG+         5.50    (#    212:20  Unique         2.05, 3.11 A)
 &rst
  ixpk= 212, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 111, 112,
 &end
#
#    8 ARG  HD+           8 ARG  HG-         4.50    (#    213:20  Unique         2.22, 2.67 A)
 &rst
  ixpk= 213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 114, 115,
 igr2= 111, 112,
 &end
#
#    0 AMB  20-2:214      0 AMB  20-1:214    3.50    (#    214:20  Double Ambig)
 &rst
  ixpk= 214, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 114, 115,1326,1327,1326,1327,
 igr2= 111, 112,1323,1324,1323,1324,
 &end
#
#    8 ARG  HN            8 ARG  HD+         5.50    (#    218:20  Unique         4.34, 4.94 A)
 &rst
  ixpk= 218, nxpk= 20, iat= 104,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:219      0 AMB  20-1:219    5.50    (#    219:20  Double Ambig)
 &rst
  ixpk= 219, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 151, 152,1550,1551,
 igr2= 114, 115, 114, 115,
 &end
#
#   40 ILE  HN            8 ARG  HD+         5.50    (#    220:20  Unique         4.30, 6.44 A)
 &rst
  ixpk= 220, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:221      0 AMB  20-1:221    5.50    (#    221:20  Double Ambig)
 &rst
  ixpk= 221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 151, 152,1550,1551,
 igr2= 114, 115, 114, 115,
 &end
#
#    8 ARG  HA            8 ARG  HD+         5.50    (#    222:20  Unique         2.00, 4.32 A)
 &rst
  ixpk= 222, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    8 ARG  HA            8 ARG  HD-         5.50    (#    223:20  Unique         2.00, 4.32 A)
 &rst
  ixpk= 223, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:226      0 AMB  20-1:226    5.50    (#    226:20  Double Ambig)
 &rst
  ixpk= 226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 129, 130, 129, 130,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:227      8 ARG  HD-         5.50    (#    227:20  Single Ambig)
 &rst
  ixpk= 227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 129, 130, 129, 130,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:228      0 AMB  20-1:228    4.50    (#    228:20  Double Ambig)
 &rst
  ixpk= 228, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 108, 109, 108, 109, 111, 112,
 igr2= 114, 115, 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:229      0 AMB  20-1:229    2.80    (#    229:20  Double Ambig)
 &rst
  ixpk= 229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.99, r4= 6.49,
 igr1= 108, 109, 108, 109,2388,2389,2388,2389,2388,2389,
       111, 112,
 igr2= 114, 115,2394,2395,2394,2395,2394,2395,
 &end
#
#    8 ARG  HG-           8 ARG  HD+         5.50    (#    230:20  Unique         2.22, 2.67 A)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 111, 112,
 igr2= 114, 115,
 &end
#
#    0 AMB  20-2:231      0 AMB  20-1:231    2.80    (#    231:20  Double Ambig)
 &rst
  ixpk= 231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 111, 112,2391,2392,
 igr2= 114, 115,2394,2395,2394,2395,
 &end
#
#    0 AMB  20-2:232      0 AMB  20-1:232    5.50    (#    232:20  Double Ambig)
 &rst
  ixpk= 232, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  34,  35,  36,1349,1350,1351,1353,1354,1355,
 igr2= 114, 115, 114, 115,
 &end
#
#    0 AMB  20-2:233      8 ARG  HD-         5.50    (#    233:20  Single Ambig)
 &rst
  ixpk= 233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  34,  35,  36,1349,1350,1351,1353,1354,1355,
 igr2= 114, 115,
 &end
#
#   10 ASN  HN            9 PRO  HA          4.50    (#    234:20  Unique         2.15, 2.18 A)
 &rst
  ixpk= 234, nxpk= 20, iat= 142, 138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   96 LYS  HN            9 PRO  HA          5.50    (#    235:20  Unique         3.54, 4.03 A)
 &rst
  ixpk= 235, nxpk= 20, iat=1555, 138, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HN            9 PRO  HA          5.50    (#    236:20  Unique         4.24, 4.66 A)
 &rst
  ixpk= 236, nxpk= 20, iat= 616, 138, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+          9 PRO  HA          5.50    (#    237:20  Unique         3.70, 4.97 A)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   97 GLN  HA            9 PRO  HA          5.50    (#    238:20  Unique         4.12, 4.64 A)
 &rst
  ixpk= 238, nxpk= 20, iat=1579, 138, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:239      9 PRO  HA          5.50    (#    239:20  Single Ambig)
 &rst
  ixpk= 239, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130, 129, 130,
 &end
#
#    9 PRO  HG+           9 PRO  HA          5.50    (#    240:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 240, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 132, 133,
 &end
#
#    0 AMB  20-2:241      9 PRO  HA          5.50    (#    241:20  Single Ambig)
 &rst
  ixpk= 241, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1568,1569, 135, 136,
 &end
#
#    0 AMB  20-2:242      9 PRO  HA          5.50    (#    242:20  Single Ambig)
 &rst
  ixpk= 242, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1568,1569, 135, 136,
 &end
#
#    0 AMB  20-2:244      9 PRO  HA          5.50    (#    244:20  Single Ambig)
 &rst
  ixpk= 244, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1559,1560, 626, 627,
 &end
#
#   40 ILE  QD1           9 PRO  HA          5.50    (#    245:20  Unique         2.34, 3.95 A)
 &rst
  ixpk= 245, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 629, 630, 631,
 &end
#
#   96 LYS  HG+           9 PRO  HA          5.50    (#    246:20  Unique         2.91, 4.56 A)
 &rst
  ixpk= 246, nxpk= 20, iat=  -1, 138, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1562,1563,
 &end
#
#   40 ILE  QD1           9 PRO  HB-         5.50    (#    247:20  Unique         2.00, 3.91 A)
 &rst
  ixpk= 247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 629, 630, 631,
 igr2= 135, 136,
 &end
#
#   40 ILE  HG1+          9 PRO  HB-         5.50    (#    248:20  Unique         2.74, 4.72 A)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 626, 627,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:250      0 AMB  20-1:250    4.50    (#    250:20  Double Ambig)
 &rst
  ixpk= 250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 629, 630, 631,2162,2163,
 igr2= 135, 136,2230,
 &end
#
#  137 VAL  MGY         136 VAL  HB          5.50    (#    251:20  Unique         2.20, 5.74 A)
 &rst
  ixpk= 251, nxpk= 20, iat=  -1,2230, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#   40 ILE  HB            9 PRO  HB-         5.50    (#    252:20  Unique         1.94, 2.93 A)
 &rst
  ixpk= 252, nxpk= 20, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:253      0 AMB  20-1:253    4.50    (#    253:20  Double Ambig)
 &rst
  ixpk= 253, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 620,2293,2294,
 igr2= 135, 136,2230,
 &end
#
#    9 PRO  HG+           9 PRO  HB-         5.50    (#    254:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 254, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 132, 133,
 igr2= 135, 136,
 &end
#
#    9 PRO  HG+           9 PRO  HB+         5.50    (#    255:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 132, 133,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:256      9 PRO  HB-         5.50    (#    256:20  Single Ambig)
 &rst
  ixpk= 256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 129, 130, 129, 130,
 igr2= 135, 136,
 &end
#
#    0 AMB  20-2:257      0 AMB  20-1:257    5.50    (#    257:20  Double Ambig)
 &rst
  ixpk= 257, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 129, 130, 129, 130,
 igr2= 135, 136, 135, 136,
 &end
#
#    9 PRO  HA            9 PRO  HB-         5.50    (#    258:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 258, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#    9 PRO  HA            9 PRO  HB+         5.50    (#    259:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 259, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#   10 ASN  HD2+          9 PRO  HB-         5.50    (#    260:20  Unique         5.69, 6.75 A)
 &rst
  ixpk= 260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 135, 136,
 &end
#
#   74 TRP  HH2           9 PRO  HB-         5.50    (#    262:20  Unique         5.84, 6.22 A)
 &rst
  ixpk= 262, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#   24 TRP  HZ2         136 VAL  HB          5.50    (#    263:20  Unique         1.95, 4.16 A)
 &rst
  ixpk= 263, nxpk= 20, iat= 369,2230, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HN            9 PRO  HB-         5.50    (#    264:20  Unique         3.59, 4.01 A)
 &rst
  ixpk= 264, nxpk= 20, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#   10 ASN  HN            9 PRO  HB+         5.50    (#    265:20  Unique         3.59, 4.01 A)
 &rst
  ixpk= 265, nxpk= 20, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 135, 136,
 &end
#
#   40 ILE  HN            9 PRO  HG+         5.50    (#    266:20  Unique         3.89, 4.80 A)
 &rst
  ixpk= 266, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 132, 133,
 &end
#
#    0 AMB  20-2:268      0 AMB  20-1:268    5.50    (#    268:20  Double Ambig)
 &rst
  ixpk= 268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 138, 144,
 igr2= 132, 133, 132, 133,
 &end
#
#    8 ARG  HA            9 PRO  HG+         5.50    (#    269:20  Unique         4.14, 4.27 A)
 &rst
  ixpk= 269, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 132, 133,
 &end
#
#    0 AMB  20-2:270      0 AMB  20-1:270    5.50    (#    270:20  Double Ambig)
 &rst
  ixpk= 270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  23,   6,
 igr2= 132, 133, 132, 133,
 &end
#
#    0 AMB  20-2:271      0 AMB  20-1:271    4.50    (#    271:20  Double Ambig)
 &rst
  ixpk= 271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 129, 130, 129, 130,
 igr2= 132, 133, 132, 133,
 &end
#
#    1 MET  HG+           9 PRO  HG+         5.50    (#    272:20  Unique         1.98, 3.70 A)
 &rst
  ixpk= 272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  11,  12,
 igr2= 132, 133,
 &end
#
#    9 PRO  HB+           9 PRO  HG+         5.50    (#    273:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 273, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 135, 136,
 igr2= 132, 133,
 &end
#
#    9 PRO  HB-           9 PRO  HG+         5.50    (#    274:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 274, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 135, 136,
 igr2= 132, 133,
 &end
#
#   40 ILE  HB            9 PRO  HG+         5.50    (#    275:20  Unique         2.91, 4.08 A)
 &rst
  ixpk= 275, nxpk= 20, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 132, 133,
 &end
#
#    2 ILE  QG2           9 PRO  HG+         5.50    (#    277:20  Unique         5.55, 7.35 A)
 &rst
  ixpk= 277, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2= 132, 133,
 &end
#
#    3 ASP  HN            0 AMB  20-1:278    5.50    (#    278:20  Single Ambig)
 &rst
  ixpk= 278, nxpk= 20, iat=  40,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:279      0 AMB  20-1:279    5.50    (#    279:20  Double Ambig)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 104,  76,
 igr2= 129, 130, 129, 130, 129, 130,
 &end
#
#    9 PRO  HA            0 AMB  20-1:280    5.50    (#    280:20  Single Ambig)
 &rst
  ixpk= 280, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 129, 130, 129, 130,
 &end
#
#    2 ILE  HA            0 AMB  20-1:281    5.50    (#    281:20  Single Ambig)
 &rst
  ixpk= 281, nxpk= 20, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:282      0 AMB  20-1:282    5.50    (#    282:20  Double Ambig)
 &rst
  ixpk= 282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  85,  54,
 igr2= 129, 130, 129, 130, 129, 130,
 &end
#
#    8 ARG  HA            0 AMB  20-1:283    4.50    (#    283:20  Single Ambig)
 &rst
  ixpk= 283, nxpk= 20, iat= 106,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 129, 130, 129, 130,
 &end
#
#    1 MET  HG-           0 AMB  20-1:284    5.50    (#    284:20  Single Ambig)
 &rst
  ixpk= 284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  11,  12,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:285      0 AMB  20-1:285    5.50    (#    285:20  Double Ambig)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  11,  12,  11,  12,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:286      0 AMB  20-1:286    5.50    (#    286:20  Double Ambig)
 &rst
  ixpk= 286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  44,  45,  44,  45,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:287      0 AMB  20-1:287    5.50    (#    287:20  Double Ambig)
 &rst
  ixpk= 287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 132, 133, 132, 133,
 igr2= 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:288      0 AMB  20-1:288    5.50    (#    288:20  Double Ambig)
 &rst
  ixpk= 288, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 135, 136, 135, 136,  15,  16,  17,1568,1569,
 igr2= 129, 130, 129, 130, 129, 130, 129, 130,
 &end
#
#    0 AMB  20-2:289      0 AMB  20-1:289    3.50    (#    289:20  Double Ambig)
 &rst
  ixpk= 289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.54, r4= 8.04,
 igr1= 111, 112, 111, 112, 132, 133, 108, 109, 108, 109,
      
 igr2= 129, 130, 129, 130, 129, 130, 129, 130, 129, 130,
      
 &end
#
#    8 ARG  HG-           0 AMB  20-1:290    5.50    (#    290:20  Single Ambig)
 &rst
  ixpk= 290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 111, 112,
 igr2= 129, 130, 129, 130,
 &end
#
#    2 ILE  HG1-          0 AMB  20-1:291    5.50    (#    291:20  Single Ambig)
 &rst
  ixpk= 291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  31,  32,
 igr2= 129, 130, 129, 130,
 &end
#
#    2 ILE  QD1           0 AMB  20-1:292    5.50    (#    292:20  Single Ambig)
 &rst
  ixpk= 292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  34,  35,  36,
 igr2= 129, 130, 129, 130,
 &end
#
#   40 ILE  QG2           0 AMB  20-1:293    5.50    (#    293:20  Single Ambig)
 &rst
  ixpk= 293, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 622, 623, 624,
 igr2= 129, 130, 129, 130,
 &end
#
#   11 VAL  MGX          10 ASN  HA          5.50    (#    294:20  Unique         3.00, 4.65 A)
 &rst
  ixpk= 294, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   40 ILE  HG1+         10 ASN  HA          5.50    (#    295:20  Unique         2.00, 3.30 A)
 &rst
  ixpk= 295, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   11 VAL  MGY          10 ASN  HA          5.50    (#    296:20  Unique         3.00, 4.65 A)
 &rst
  ixpk= 296, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   40 ILE  HG1-         10 ASN  HA          5.50    (#    297:20  Unique         2.00, 3.30 A)
 &rst
  ixpk= 297, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#    0 AMB  20-2:298     10 ASN  HA          5.50    (#    298:20  Single Ambig)
 &rst
  ixpk= 298, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 135, 136, 160,
 &end
#
#    0 AMB  20-2:300     10 ASN  HA          5.50    (#    300:20  Single Ambig)
 &rst
  ixpk= 300, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1581,1582,1545,1546,
 &end
#
#   10 ASN  HB-          10 ASN  HA          5.50    (#    301:20  Unique         2.24, 2.60 A)
 &rst
  ixpk= 301, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB+          10 ASN  HA          5.50    (#    302:20  Unique         2.24, 2.60 A)
 &rst
  ixpk= 302, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   39 GLY  HA-          10 ASN  HA          5.50    (#    303:20  Unique         1.96, 2.99 A)
 &rst
  ixpk= 303, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 611, 612,
 &end
#
#   39 GLY  HA+          10 ASN  HA          5.50    (#    304:20  Unique         1.96, 2.99 A)
 &rst
  ixpk= 304, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 611, 612,
 &end
#
#   10 ASN  HD2-         10 ASN  HA          5.50    (#    305:20  Unique         3.83, 4.62 A)
 &rst
  ixpk= 305, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HD2+         10 ASN  HA          5.50    (#    306:20  Unique         3.83, 4.62 A)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1, 144, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   40 ILE  HN           10 ASN  HA          5.50    (#    307:20  Unique         1.86, 1.95 A)
 &rst
  ixpk= 307, nxpk= 20, iat= 616, 144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   39 GLY  HN           10 ASN  HA          5.50    (#    308:20  Unique         1.94, 2.59 A)
 &rst
  ixpk= 308, nxpk= 20, iat= 609, 144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 GLY  HN           10 ASN  HA          5.50    (#    309:20  Unique         3.43, 4.07 A)
 &rst
  ixpk= 309, nxpk= 20, iat= 602, 144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           10 ASN  HA          4.50    (#    310:20  Unique         2.57, 2.72 A)
 &rst
  ixpk= 310, nxpk= 20, iat= 156, 144, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HN           10 ASN  HA          5.50    (#    311:20  Unique         2.89, 2.91 A)
 &rst
  ixpk= 311, nxpk= 20, iat= 142, 144, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:312      0 AMB  20-1:312    5.50    (#    312:20  Double Ambig)
 &rst
  ixpk= 312, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1= 162, 163, 164, 166, 167, 168,1565,1566,
 igr2= 146, 147, 146, 147,
 &end
#
#    0 AMB  20-2:313     10 ASN  HB-         5.50    (#    313:20  Single Ambig)
 &rst
  ixpk= 313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 162, 163, 164, 166, 167, 168,1565,1566,
 igr2= 146, 147,
 &end
#
#   11 VAL  MGY          10 ASN  HB+         5.50    (#    314:20  Unique         3.73, 5.70 A)
 &rst
  ixpk= 314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:315     10 ASN  HB-         5.50    (#    315:20  Single Ambig)
 &rst
  ixpk= 315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 162, 163, 164, 166, 167, 168, 629, 630, 631,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:316      0 AMB  20-1:316    5.50    (#    316:20  Double Ambig)
 &rst
  ixpk= 316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1542,1543, 620,
 igr2= 146, 147, 146, 147,
 &end
#
#   40 ILE  HG1-         10 ASN  HB-         5.50    (#    317:20  Unique         4.23, 5.56 A)
 &rst
  ixpk= 317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 626, 627,
 igr2= 146, 147,
 &end
#
#   95 GLN  HB+          10 ASN  HB-         5.50    (#    319:20  Unique         4.27, 6.21 A)
 &rst
  ixpk= 319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,
 igr2= 146, 147,
 &end
#
#   97 GLN  HB+          10 ASN  HB+         5.50    (#    320:20  Unique         1.96, 3.81 A)
 &rst
  ixpk= 320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1581,1582,
 igr2= 146, 147,
 &end
#
#   97 GLN  HB+          10 ASN  HB-         5.50    (#    321:20  Unique         1.96, 3.81 A)
 &rst
  ixpk= 321, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1581,1582,
 igr2= 146, 147,
 &end
#
#   10 ASN  HA           10 ASN  HB+         5.50    (#    322:20  Unique         2.24, 2.60 A)
 &rst
  ixpk= 322, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   10 ASN  HA           10 ASN  HB-         5.50    (#    323:20  Unique         2.24, 2.60 A)
 &rst
  ixpk= 323, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   39 GLY  HA+          10 ASN  HB-         5.50    (#    324:20  Unique         2.08, 4.09 A)
 &rst
  ixpk= 324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 146, 147,
 &end
#
#   39 GLY  HA+          10 ASN  HB+         5.50    (#    325:20  Unique         2.08, 4.09 A)
 &rst
  ixpk= 325, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:326     10 ASN  HB-         5.50    (#    326:20  Single Ambig)
 &rst
  ixpk= 326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 158,1557,
 igr2= 146, 147,
 &end
#
#    0 AMB  20-2:327      0 AMB  20-1:327    5.50    (#    327:20  Double Ambig)
 &rst
  ixpk= 327, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 158,1557,
 igr2= 146, 147, 146, 147,
 &end
#
#   97 GLN  HA           10 ASN  HB+         5.50    (#    328:20  Unique         3.02, 4.61 A)
 &rst
  ixpk= 328, nxpk= 20, iat=1579,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   97 GLN  HA           10 ASN  HB-         5.50    (#    329:20  Unique         3.02, 4.61 A)
 &rst
  ixpk= 329, nxpk= 20, iat=1579,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2-         10 ASN  HB+         5.50    (#    330:20  Unique         2.11, 3.20 A)
 &rst
  ixpk= 330, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2-         10 ASN  HB-         5.50    (#    331:20  Unique         2.11, 3.20 A)
 &rst
  ixpk= 331, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2+         10 ASN  HB+         5.50    (#    332:20  Unique         2.11, 3.20 A)
 &rst
  ixpk= 332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   10 ASN  HD2+         10 ASN  HB-         5.50    (#    333:20  Unique         2.11, 3.20 A)
 &rst
  ixpk= 333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 146, 147,
 &end
#
#   38 GLY  HN           10 ASN  HB-         5.50    (#    335:20  Unique         1.91, 2.95 A)
 &rst
  ixpk= 335, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   38 GLY  HN           10 ASN  HB+         5.50    (#    336:20  Unique         1.91, 2.95 A)
 &rst
  ixpk= 336, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           10 ASN  HB+         5.50    (#    337:20  Unique         1.88, 2.45 A)
 &rst
  ixpk= 337, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           10 ASN  HB-         5.50    (#    338:20  Unique         1.88, 2.45 A)
 &rst
  ixpk= 338, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   10 ASN  HN           10 ASN  HB-         5.50    (#    339:20  Unique         2.94, 3.56 A)
 &rst
  ixpk= 339, nxpk= 20, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   10 ASN  HN           10 ASN  HB+         5.50    (#    340:20  Unique         2.94, 3.56 A)
 &rst
  ixpk= 340, nxpk= 20, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 146, 147,
 &end
#
#   11 VAL  HN           11 VAL  HA          5.50    (#    341:20  Unique         2.88, 2.91 A)
 &rst
  ixpk= 341, nxpk= 20, iat= 156, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           11 VAL  HA          5.50    (#    343:20  Unique         1.89, 2.21 A)
 &rst
  ixpk= 343, nxpk= 20, iat=1594, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 GLY  HN           11 VAL  HA          4.50    (#    344:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 344, nxpk= 20, iat= 172, 158, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 TRP  HH2          11 VAL  HA          5.50    (#    345:20  Unique         4.81, 5.25 A)
 &rst
  ixpk= 345, nxpk= 20, iat=1166, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HA           11 VAL  HA          5.50    (#    347:20  Unique         2.58, 3.08 A)
 &rst
  ixpk= 347, nxpk= 20, iat=1579, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HA           11 VAL  HA          5.50    (#    348:20  Unique         4.84, 5.16 A)
 &rst
  ixpk= 348, nxpk= 20, iat=1618, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:349     11 VAL  HA          5.50    (#    349:20  Single Ambig)
 &rst
  ixpk= 349, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 174, 175, 618,
 &end
#
#   11 VAL  HB           11 VAL  HA          5.50    (#    350:20  Unique         2.43, 2.59 A)
 &rst
  ixpk= 350, nxpk= 20, iat= 160, 158, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HB-          11 VAL  HA          5.50    (#    352:20  Unique         5.25, 6.36 A)
 &rst
  ixpk= 352, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          11 VAL  HA          4.50    (#    353:20  Unique         2.02, 3.39 A)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HD-          11 VAL  HA          5.50    (#    354:20  Unique         5.25, 5.97 A)
 &rst
  ixpk= 354, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1604,1605,
 &end
#
#   11 VAL  MGX          11 VAL  HA          5.50    (#    355:20  Unique         2.02, 3.39 A)
 &rst
  ixpk= 355, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          11 VAL  HA          5.50    (#    356:20  Unique         3.13, 4.71 A)
 &rst
  ixpk= 356, nxpk= 20, iat=  -1, 158, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#    0 AMB  20-2:357     11 VAL  HB          4.50    (#    357:20  Single Ambig)
 &rst
  ixpk= 357, nxpk= 20, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 162, 163, 164, 166, 167, 168, 192, 193, 194,
 &end
#
#   11 VAL  MGY          11 VAL  HB          4.50    (#    358:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:360     11 VAL  HB          5.50    (#    360:20  Single Ambig)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=1604,1605, 829, 830, 831, 833, 834, 835,1688,1689,
      1690,1692,1693,1694,
 &end
#
#   50 MET  HG-          11 VAL  HB          5.50    (#    361:20  Unique         2.06, 3.56 A)
 &rst
  ixpk= 361, nxpk= 20, iat=  -1, 160, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 755, 756,
 &end
#
#   11 VAL  HA           11 VAL  HB          5.50    (#    363:20  Unique         2.43, 2.59 A)
 &rst
  ixpk= 363, nxpk= 20, iat= 158, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 GLY  HN           11 VAL  HB          5.50    (#    365:20  Unique         2.96, 3.40 A)
 &rst
  ixpk= 365, nxpk= 20, iat= 172, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           11 VAL  HB          5.50    (#    366:20  Unique         3.60, 4.27 A)
 &rst
  ixpk= 366, nxpk= 20, iat=1594, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           11 VAL  HB          5.50    (#    367:20  Unique         3.31, 3.80 A)
 &rst
  ixpk= 367, nxpk= 20, iat= 156, 160, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           11 VAL  MGX         4.50    (#    368:20  Unique         2.06, 3.69 A)
 &rst
  ixpk= 368, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   38 GLY  HN           11 VAL  MGX         5.50    (#    369:20  Unique         2.87, 5.40 A)
 &rst
  ixpk= 369, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  100 PHE  HN           11 VAL  MGX         5.50    (#    370:20  Unique         4.47, 7.44 A)
 &rst
  ixpk= 370, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   39 GLY  HN           11 VAL  MGX         5.50    (#    371:20  Unique         2.38, 4.43 A)
 &rst
  ixpk= 371, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:372     11 VAL  MGX         5.50    (#    372:20  Single Ambig)
 &rst
  ixpk= 372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 748, 810,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HN           11 VAL  MGX         5.50    (#    373:20  Unique         2.34, 4.81 A)
 &rst
  ixpk= 373, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   12 GLY  HN           11 VAL  MGX         5.50    (#    374:20  Unique         3.15, 4.89 A)
 &rst
  ixpk= 374, nxpk= 20, iat= 172,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:375     11 VAL  MGX         5.50    (#    375:20  Single Ambig)
 &rst
  ixpk= 375, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 773, 782, 847, 855,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HA           11 VAL  MGX         5.50    (#    376:20  Unique         2.02, 3.39 A)
 &rst
  ixpk= 376, nxpk= 20, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   10 ASN  HA           11 VAL  MGX         5.50    (#    377:20  Unique         3.00, 4.65 A)
 &rst
  ixpk= 377, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:378     11 VAL  MGX         5.50    (#    378:20  Single Ambig)
 &rst
  ixpk= 378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 587,1618,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   13 ILE  HA           11 VAL  MGX         5.50    (#    379:20  Unique         4.73, 7.26 A)
 &rst
  ixpk= 379, nxpk= 20, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   50 MET  HA           11 VAL  MGX         4.50    (#    380:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 380, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   38 GLY  HA-          11 VAL  MGX         5.50    (#    381:20  Unique         1.95, 5.75 A)
 &rst
  ixpk= 381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 604, 605,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   51 TYR  HA           11 VAL  MGX         5.50    (#    382:20  Unique         4.92, 7.04 A)
 &rst
  ixpk= 382, nxpk= 20, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:383     11 VAL  MGX         5.50    (#    383:20  Single Ambig)
 &rst
  ixpk= 383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 589, 590, 677, 678, 713, 714, 674, 675, 674, 675,
       710, 711,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:384     11 VAL  MGX         5.50    (#    384:20  Single Ambig)
 &rst
  ixpk= 384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 790, 791, 824, 825,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HB           11 VAL  MGX         3.50    (#    385:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 385, nxpk= 20, iat= 160,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:386     11 VAL  MGX         3.50    (#    386:20  Single Ambig)
 &rst
  ixpk= 386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 742, 743, 744, 755, 756,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:388     11 VAL  MGX         4.50    (#    388:20  Single Ambig)
 &rst
  ixpk= 388, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1= 752, 753, 814, 815, 816, 189, 190,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HN           11 VAL  MGY         5.50    (#    391:20  Unique         2.06, 3.69 A)
 &rst
  ixpk= 391, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  145 ARG  HN          133 VAL  MGX         5.50    (#    392:20  Unique         2.57, 5.17 A)
 &rst
  ixpk= 392, nxpk= 20, iat=2384,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:393      0 AMB  20-1:393    5.50    (#    393:20  Double Ambig)
 &rst
  ixpk= 393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2532, 706,
 igr2=2549,2550,2551,2553,2554,2555, 162, 163, 164, 166,
       167, 168,
 &end
#
#    0 AMB  20-2:394     11 VAL  MGY         5.50    (#    394:20  Single Ambig)
 &rst
  ixpk= 394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 748, 810,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:395      0 AMB  20-1:395    5.50    (#    395:20  Double Ambig)
 &rst
  ixpk= 395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1594,1399,
 igr2= 162, 163, 164, 166, 167, 168,1491,1492,1493,1495,
      1496,1497,
 &end
#
#    0 AMB  20-2:396      0 AMB  20-1:396    5.50    (#    396:20  Double Ambig)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 172,1078,
 igr2= 162, 163, 164, 166, 167, 168,2549,2550,2551,2553,
      2554,2555,
 &end
#
#  154 VAL  HN          154 VAL  MGX         3.50    (#    397:20  Unique         2.08, 3.85 A)
 &rst
  ixpk= 397, nxpk= 20, iat=2543,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#   74 TRP  HH2          11 VAL  MGY         3.50    (#    398:20  Unique         3.24, 5.34 A)
 &rst
  ixpk= 398, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#  103 GLN  HE2-        154 VAL  MGX         5.50    (#    399:20  Unique         2.41, 6.71 A)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#   11 VAL  HA           11 VAL  MGY         5.50    (#    400:20  Unique         2.02, 3.39 A)
 &rst
  ixpk= 400, nxpk= 20, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:401      0 AMB  20-1:401    5.50    (#    401:20  Double Ambig)
 &rst
  ixpk= 401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 618,  78,  79,2187,
 igr2= 162, 163, 164, 166, 167, 168,1491,1492,1493,1495,
      1496,1497,2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:402      0 AMB  20-1:402    4.50    (#    402:20  Double Ambig)
 &rst
  ixpk= 402, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 698,2596,2597,2596,2597,
 igr2= 162, 163, 164, 166, 167, 168,2549,2550,2551,2553,
      2554,2555,
 &end
#
#    0 AMB  20-2:403      0 AMB  20-1:403    5.50    (#    403:20  Double Ambig)
 &rst
  ixpk= 403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 604, 605,2386,
 igr2= 162, 163, 164, 166, 167, 168,2175,2176,2177,2179,
      2180,2181,
 &end
#
#    0 AMB  20-2:404      0 AMB  20-1:404    4.50    (#    404:20  Double Ambig)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2114,2115,1403,1404,2171,
 igr2=2175,2176,2177,2179,2180,2181,1491,1492,1493,1495,
      1496,1497,
 &end
#
#    0 AMB  20-2:405      0 AMB  20-1:405    5.50    (#    405:20  Double Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=2506,2507,2394,2395,2394,2395,
 igr2=2549,2550,2551,2553,2554,2555,2175,2176,2177,2179,
      2180,2181,
 &end
#
#    0 AMB  20-2:406      0 AMB  20-1:406    2.80    (#    406:20  Double Ambig)
 &rst
  ixpk= 406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.54, r4= 6.04,
 igr1=2388,2389,2388,2389,2547,
 igr2=2175,2176,2177,2179,2180,2181,2549,2550,2551,2553,
      2554,2555,
 &end
#
#    0 AMB  20-2:407      0 AMB  20-1:407    2.80    (#    407:20  Double Ambig)
 &rst
  ixpk= 407, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.86, r4= 6.36,
 igr1=2192,2193, 742, 743, 744, 755, 756,
 igr2=2175,2176,2177,2179,2180,2181, 162, 163, 164, 166,
       167, 168,
 &end
#
#    0 AMB  20-2:410      0 AMB  20-1:410    5.50    (#    410:20  Double Ambig)
 &rst
  ixpk= 410, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.06, r4=11.56,
 igr1= 189, 190, 162, 163, 164, 166, 167, 168, 192, 193,
       194,
 igr2= 174, 175, 174, 175, 174, 175,
 &end
#
#    0 AMB  20-2:411     12 GLY  HA-         5.50    (#    411:20  Single Ambig)
 &rst
  ixpk= 411, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1= 189, 190, 162, 163, 164, 166, 167, 168, 192, 193,
       194,
 igr2= 174, 175,
 &end
#
#    0 AMB  20-2:413      0 AMB  20-1:413    5.50    (#    413:20  Double Ambig)
 &rst
  ixpk= 413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1581,1582, 589, 590,
 igr2= 174, 175, 174, 175,
 &end
#
#    0 AMB  20-2:414     12 GLY  HA-         5.50    (#    414:20  Single Ambig)
 &rst
  ixpk= 414, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1618, 587,
 igr2= 174, 175,
 &end
#
#    0 AMB  20-2:415      0 AMB  20-1:415    5.50    (#    415:20  Double Ambig)
 &rst
  ixpk= 415, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1618, 587,
 igr2= 174, 175, 174, 175,
 &end
#
#   13 ILE  HN           12 GLY  HA-         5.50    (#    416:20  Unique         2.14, 2.65 A)
 &rst
  ixpk= 416, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   13 ILE  HN           12 GLY  HA+         5.50    (#    417:20  Unique         2.14, 2.65 A)
 &rst
  ixpk= 417, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   38 GLY  HN           12 GLY  HA+         5.50    (#    418:20  Unique         4.26, 5.46 A)
 &rst
  ixpk= 418, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   38 GLY  HN           12 GLY  HA-         5.50    (#    419:20  Unique         4.26, 5.46 A)
 &rst
  ixpk= 419, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 174, 175,
 &end
#
#   14 VAL  HN           13 ILE  HA          5.50    (#    420:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 420, nxpk= 20, iat= 198, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 PHE  HN           13 ILE  HA          5.50    (#    421:20  Unique         3.30, 3.81 A)
 &rst
  ixpk= 421, nxpk= 20, iat=1640, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ILE  HN           13 ILE  HA          5.50    (#    422:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 422, nxpk= 20, iat= 179, 181, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ILE  HG1-         13 ILE  HA          5.50    (#    424:20  Unique         2.64, 3.24 A)
 &rst
  ixpk= 424, nxpk= 20, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 189, 190,
 &end
#
#   50 MET  HG-          13 ILE  HA          5.50    (#    425:20  Unique         3.68, 4.60 A)
 &rst
  ixpk= 425, nxpk= 20, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 755, 756,
 &end
#
#    0 AMB  20-2:426     13 ILE  HA          5.50    (#    426:20  Single Ambig)
 &rst
  ixpk= 426, nxpk= 20, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 185, 186, 187, 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:427     13 ILE  HA          5.50    (#    427:20  Single Ambig)
 &rst
  ixpk= 427, nxpk= 20, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#   14 VAL  MGX          13 ILE  HA          5.50    (#    428:20  Unique         3.49, 5.47 A)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1, 181, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   13 ILE  HG1+         13 ILE  HB          4.50    (#    429:20  Unique         2.42, 2.46 A)
 &rst
  ixpk= 429, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 189, 190,
 &end
#
#   13 ILE  QG2          13 ILE  HB          3.50    (#    430:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 430, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 185, 186, 187,
 &end
#
#    0 AMB  20-2:431     13 ILE  HB          5.50    (#    431:20  Single Ambig)
 &rst
  ixpk= 431, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 189, 190, 814, 815, 816,
 &end
#
#   57 GLU  HB+          13 ILE  HB          5.50    (#    433:20  Unique         3.60, 4.67 A)
 &rst
  ixpk= 433, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 878, 879,
 &end
#
#   36 PRO  HB+          13 ILE  HB          5.50    (#    434:20  Unique         2.13, 3.08 A)
 &rst
  ixpk= 434, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 578, 579,
 &end
#
#    0 AMB  20-2:435     13 ILE  HB          5.50    (#    435:20  Single Ambig)
 &rst
  ixpk= 435, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 174, 175, 812,
 &end
#
#    0 AMB  20-2:436     13 ILE  HB          5.50    (#    436:20  Single Ambig)
 &rst
  ixpk= 436, nxpk= 20, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 181, 581,
 &end
#
#   13 ILE  HN           13 ILE  HB          5.50    (#    439:20  Unique         2.26, 2.48 A)
 &rst
  ixpk= 439, nxpk= 20, iat= 179, 183, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  HN           13 ILE  HB          5.50    (#    440:20  Unique         4.09, 4.27 A)
 &rst
  ixpk= 440, nxpk= 20, iat= 198, 183, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:441     13 ILE  HG1-        4.50    (#    441:20  Single Ambig)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 185, 186, 187,
 igr2= 189, 190,
 &end
#
#    0 AMB  20-2:442      0 AMB  20-1:442    4.50    (#    442:20  Double Ambig)
 &rst
  ixpk= 442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 185, 186, 187,
 igr2= 189, 190, 189, 190, 189, 190,
 &end
#
#    0 AMB  20-2:443      0 AMB  20-1:443    5.50    (#    443:20  Double Ambig)
 &rst
  ixpk= 443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 824, 825, 183,
 igr2= 189, 190, 189, 190,
 &end
#
#    0 AMB  20-2:444      0 AMB  20-1:444    5.50    (#    444:20  Double Ambig)
 &rst
  ixpk= 444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 755, 756, 827,
 igr2= 189, 190, 189, 190,
 &end
#
#    0 AMB  20-2:445     13 ILE  HG1-        5.50    (#    445:20  Single Ambig)
 &rst
  ixpk= 445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 916, 917,1943,1944, 946, 947,
 igr2= 189, 190,
 &end
#
#    0 AMB  20-2:446     13 ILE  HG1-        5.50    (#    446:20  Single Ambig)
 &rst
  ixpk= 446, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 755, 756, 827,
 igr2= 189, 190,
 &end
#
#   36 PRO  HB-          13 ILE  HG1+        5.50    (#    448:20  Unique         2.79, 4.74 A)
 &rst
  ixpk= 448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 578, 579,
 igr2= 189, 190,
 &end
#
#   13 ILE  HA           13 ILE  HG1-        5.50    (#    451:20  Unique         2.64, 3.24 A)
 &rst
  ixpk= 451, nxpk= 20, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 189, 190,
 &end
#
#   13 ILE  HA           13 ILE  HG1+        5.50    (#    452:20  Unique         2.64, 3.24 A)
 &rst
  ixpk= 452, nxpk= 20, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 189, 190,
 &end
#
#   13 ILE  HN           13 ILE  HG1-        5.50    (#    456:20  Unique         2.34, 3.62 A)
 &rst
  ixpk= 456, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 189, 190,
 &end
#
#   13 ILE  HN           13 ILE  HG1+        5.50    (#    457:20  Unique         2.34, 3.62 A)
 &rst
  ixpk= 457, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 189, 190,
 &end
#
#   14 VAL  HN           13 ILE  HG1+        5.50    (#    459:20  Unique         4.64, 5.03 A)
 &rst
  ixpk= 459, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 189, 190,
 &end
#
#   14 VAL  HN           13 ILE  QD1         5.50    (#    460:20  Unique         3.10, 4.19 A)
 &rst
  ixpk= 460, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#   54 LEU  HN           13 ILE  QD1         5.50    (#    461:20  Unique         2.16, 4.33 A)
 &rst
  ixpk= 461, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:462      0 AMB  20-1:462    5.50    (#    462:20  Double Ambig)
 &rst
  ixpk= 462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 810,  83,
 igr2= 192, 193, 194,1525,1526,1527,
 &end
#
#    0 AMB  20-2:463     13 ILE  QD1         5.50    (#    463:20  Single Ambig)
 &rst
  ixpk= 463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 179, 839,
 igr2= 192, 193, 194,
 &end
#
#   51 TYR  HD           13 ILE  QD1         5.50    (#    464:20  Unique         4.29, 6.25 A)
 &rst
  ixpk= 464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 773, 782,
 igr2= 192, 193, 194,
 &end
#
#   13 ILE  HA           13 ILE  QD1         5.50    (#    465:20  Unique         1.95, 2.82 A)
 &rst
  ixpk= 465, nxpk= 20, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#   54 LEU  HA           13 ILE  QD1         5.50    (#    466:20  Unique         2.25, 4.12 A)
 &rst
  ixpk= 466, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#   50 MET  HA           13 ILE  QD1         5.50    (#    467:20  Unique         3.44, 4.73 A)
 &rst
  ixpk= 467, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 192, 193, 194,
 &end
#
#   36 PRO  HB+          13 ILE  QD1         5.50    (#    468:20  Unique         4.79, 6.65 A)
 &rst
  ixpk= 468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 578, 579,
 igr2= 192, 193, 194,
 &end
#
#   50 MET  HG+          13 ILE  QD1         2.80    (#    469:20  Unique         1.99, 3.96 A)
 &rst
  ixpk= 469, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 755, 756,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:470     13 ILE  QD1         2.80    (#    470:20  Single Ambig)
 &rst
  ixpk= 470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 824, 825, 755, 756,
 igr2= 192, 193, 194,
 &end
#
#    0 AMB  20-2:471     13 ILE  QD1         2.80    (#    471:20  Single Ambig)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 189, 190, 814, 815, 816,
 igr2= 192, 193, 194,
 &end
#
#  102 LEU  HN           13 ILE  QG2         5.50    (#    472:20  Unique         4.49, 6.13 A)
 &rst
  ixpk= 472, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 185, 186, 187,
 &end
#
#   15 ILE  HN           13 ILE  QG2         5.50    (#    473:20  Unique         2.89, 3.67 A)
 &rst
  ixpk= 473, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 185, 186, 187,
 &end
#
#   14 VAL  HN           13 ILE  QG2         4.50    (#    474:20  Unique         2.23, 3.45 A)
 &rst
  ixpk= 474, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 185, 186, 187,
 &end
#
#  105 VAL  HN          105 VAL  MGX         3.50    (#    475:20  Unique         1.98, 3.73 A)
 &rst
  ixpk= 475, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#   66 ARG  HN          105 VAL  MGX         4.50    (#    476:20  Unique         3.05, 5.39 A)
 &rst
  ixpk= 476, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:477      0 AMB  20-1:477    5.50    (#    477:20  Double Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1=1715, 874,1640,
 igr2=1740,1741,1742,1744,1745,1746, 185, 186, 187,
 &end
#
#   64 ASP  HN          105 VAL  MGX         5.50    (#    478:20  Unique         4.48, 6.99 A)
 &rst
  ixpk= 478, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#   13 ILE  HN           13 ILE  QG2         5.50    (#    479:20  Unique         3.93, 4.52 A)
 &rst
  ixpk= 479, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 185, 186, 187,
 &end
#
#  106 SER  HN          105 VAL  MGX         5.50    (#    480:20  Unique         2.18, 4.81 A)
 &rst
  ixpk= 480, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#   65 VAL  HN          105 VAL  MGX         5.50    (#    481:20  Unique         2.91, 5.22 A)
 &rst
  ixpk= 481, nxpk= 20, iat=1000,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:482      0 AMB  20-1:482    5.50    (#    482:20  Double Ambig)
 &rst
  ixpk= 482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.97, r4=11.47,
 igr1= 773, 782,1029,1710,1711, 847, 855,
 igr2= 185, 186, 187,1740,1741,1742,1744,1745,1746,
 &end
#
#   65 VAL  HA          105 VAL  MGX         4.50    (#    483:20  Unique         1.93, 4.27 A)
 &rst
  ixpk= 483, nxpk= 20, iat=1002,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:484      0 AMB  20-1:484    3.50    (#    484:20  Double Ambig)
 &rst
  ixpk= 484, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 181,1717,
 igr2= 185, 186, 187,1740,1741,1742,1744,1745,1746,
 &end
#
#   64 ASP  HA          105 VAL  MGX         3.50    (#    485:20  Unique         2.53, 5.10 A)
 &rst
  ixpk= 485, nxpk= 20, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  HA          105 VAL  MGX         4.50    (#    486:20  Unique         2.18, 3.17 A)
 &rst
  ixpk= 486, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#  106 SER  HB-         105 VAL  MGX         5.50    (#    487:20  Unique         3.22, 6.85 A)
 &rst
  ixpk= 487, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1754,1755,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:488    105 VAL  MGX         5.50    (#    488:20  Single Ambig)
 &rst
  ixpk= 488, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1026,1027,1026,1027, 268, 269, 268, 269,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:490     13 ILE  QG2         5.50    (#    490:20  Single Ambig)
 &rst
  ixpk= 490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1644,1645,1644,1645, 769, 770,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:491      0 AMB  20-1:491    2.80    (#    491:20  Double Ambig)
 &rst
  ixpk= 491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1=1738, 343, 344,
 igr2=1740,1741,1742,1744,1745,1746, 185, 186, 187,
 &end
#
#   54 LEU  HB+          13 ILE  QG2         4.50    (#    492:20  Unique         2.18, 5.86 A)
 &rst
  ixpk= 492, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 824, 825,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:493     13 ILE  QG2         4.50    (#    493:20  Single Ambig)
 &rst
  ixpk= 493, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 578, 579, 218,
 igr2= 185, 186, 187,
 &end
#
#   15 ILE  HG1-         13 ILE  QG2         2.80    (#    494:20  Unique         2.24, 3.34 A)
 &rst
  ixpk= 494, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 224, 225,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:495     13 ILE  QG2         2.80    (#    495:20  Single Ambig)
 &rst
  ixpk= 495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 824, 825, 183,
 igr2= 185, 186, 187,
 &end
#
#    0 AMB  20-2:496     13 ILE  QG2         4.50    (#    496:20  Single Ambig)
 &rst
  ixpk= 496, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 189, 190, 350, 351, 352,
 igr2= 185, 186, 187,
 &end
#
#   14 VAL  MGX          14 VAL  HA          5.50    (#    499:20  Unique         2.04, 3.12 A)
 &rst
  ixpk= 499, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGY          14 VAL  HA          5.50    (#    500:20  Unique         2.04, 3.12 A)
 &rst
  ixpk= 500, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:501     14 VAL  HA          5.50    (#    501:20  Single Ambig)
 &rst
  ixpk= 501, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 185, 186, 187, 227, 228, 229,
 &end
#
#   14 VAL  HB           14 VAL  HA          5.50    (#    502:20  Unique         2.94, 3.00 A)
 &rst
  ixpk= 502, nxpk= 20, iat= 202, 200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  HN           14 VAL  HA          5.50    (#    503:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 503, nxpk= 20, iat= 198, 200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HN           14 VAL  HA          5.50    (#    504:20  Unique         2.27, 2.28 A)
 &rst
  ixpk= 504, nxpk= 20, iat= 214, 200, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HN           81 LYS  HB+         4.50    (#    506:20  Unique         2.28, 4.16 A)
 &rst
  ixpk= 506, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1298,1299,
 &end
#
#    0 AMB  20-2:507      0 AMB  20-1:507    5.50    (#    507:20  Double Ambig)
 &rst
  ixpk= 507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1226,1235, 446, 454, 847, 855,
 igr2=1542,1543,1929,1930,
 &end
#
#    0 AMB  20-2:509      0 AMB  20-1:509    5.50    (#    509:20  Double Ambig)
 &rst
  ixpk= 509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1196, 138,
 igr2=1542,1543,1542,1543,
 &end
#
#   81 LYS  HA           81 LYS  HB+         3.50    (#    510:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 510, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1298,1299,
 &end
#
#    0 AMB  20-2:511      0 AMB  20-1:511    5.50    (#    511:20  Double Ambig)
 &rst
  ixpk= 511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 114, 115,1923,1924,
 igr2=1542,1543,1929,1930,
 &end
#
#  119 PRO  HD-         119 PRO  HB-         5.50    (#    512:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 512, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1923,1924,
 igr2=1929,1930,
 &end
#
#   14 VAL  MGX          14 VAL  HB          5.50    (#    514:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 514, nxpk= 20, iat=  -1, 202, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:516      0 AMB  20-1:516    3.50    (#    516:20  Double Ambig)
 &rst
  ixpk= 516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1301,1302,1926,1927, 111, 112,
 igr2=1298,1299,1929,1930,1542,1543,
 &end
#
#    0 AMB  20-2:517      0 AMB  20-1:517    3.50    (#    517:20  Double Ambig)
 &rst
  ixpk= 517, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1304,1305,1304,1305,1926,1927,
 igr2=1298,1299,1298,1299,1929,1930,
 &end
#
#  102 LEU  HN           14 VAL  MGX         5.50    (#    518:20  Unique         3.74, 5.26 A)
 &rst
  ixpk= 518, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   15 ILE  HN           14 VAL  MGX         5.50    (#    519:20  Unique         3.57, 4.93 A)
 &rst
  ixpk= 519, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HN           14 VAL  MGX         5.50    (#    520:20  Unique         2.53, 4.13 A)
 &rst
  ixpk= 520, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  100 PHE  HN           14 VAL  MGX         5.50    (#    521:20  Unique         2.53, 5.33 A)
 &rst
  ixpk= 521, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HN           14 VAL  MGX         5.50    (#    522:20  Unique         3.92, 6.03 A)
 &rst
  ixpk= 522, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   13 ILE  HN           14 VAL  MGX         5.50    (#    523:20  Unique         3.52, 6.07 A)
 &rst
  ixpk= 523, nxpk= 20, iat= 179,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:524     14 VAL  MGX         5.50    (#    524:20  Single Ambig)
 &rst
  ixpk= 524, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1629, 306,2559,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HH2          14 VAL  MGX         5.50    (#    525:20  Unique         4.75, 7.11 A)
 &rst
  ixpk= 525, nxpk= 20, iat=1631,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HE3          14 VAL  MGX         4.50    (#    526:20  Unique         1.97, 3.60 A)
 &rst
  ixpk= 526, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:528     14 VAL  MGX         4.50    (#    528:20  Single Ambig)
 &rst
  ixpk= 528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2371,2380,1710,1711,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   15 ILE  HA           14 VAL  MGX         5.50    (#    529:20  Unique         4.36, 6.13 A)
 &rst
  ixpk= 529, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HA           14 VAL  MGX         5.50    (#    530:20  Unique         2.62, 4.24 A)
 &rst
  ixpk= 530, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   13 ILE  HA           14 VAL  MGX         5.50    (#    531:20  Unique         3.49, 5.47 A)
 &rst
  ixpk= 531, nxpk= 20, iat= 181,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:532     14 VAL  MGX         5.50    (#    532:20  Single Ambig)
 &rst
  ixpk= 532, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2450, 341,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HA           14 VAL  MGX         5.50    (#    533:20  Unique         2.04, 3.12 A)
 &rst
  ixpk= 533, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HB+          14 VAL  MGX         5.50    (#    534:20  Unique         1.98, 5.05 A)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  151 PHE  HB-          14 VAL  MGX         5.50    (#    535:20  Unique         3.71, 7.36 A)
 &rst
  ixpk= 535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2506,2507,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HB-          14 VAL  MGX         5.50    (#    536:20  Unique         1.98, 5.05 A)
 &rst
  ixpk= 536, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HB           14 VAL  MGX         4.50    (#    537:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 537, nxpk= 20, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:538     14 VAL  MGX         5.50    (#    538:20  Single Ambig)
 &rst
  ixpk= 538, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 183, 755, 756,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:539     14 VAL  MGX         5.50    (#    539:20  Single Ambig)
 &rst
  ixpk= 539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2563, 755, 756,2526,2527,2528,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  148 MET  ME           14 VAL  MGX         5.50    (#    540:20  Unique         3.94, 7.14 A)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2459,2460,2461,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HG           14 VAL  MGX         5.50    (#    541:20  Unique         2.15, 5.98 A)
 &rst
  ixpk= 541, nxpk= 20, iat=1667,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGY          14 VAL  MGX         5.50    (#    542:20  Unique         2.08, 6.17 A)
 &rst
  ixpk= 542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  147 VAL  MGX          14 VAL  MGX         4.50    (#    543:20  Unique         1.98, 5.15 A)
 &rst
  ixpk= 543, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  147 VAL  MGY          14 VAL  MGX         5.50    (#    544:20  Unique         1.98, 5.15 A)
 &rst
  ixpk= 544, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  102 LEU  HN           14 VAL  MGY         5.50    (#    546:20  Unique         3.74, 5.26 A)
 &rst
  ixpk= 546, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   16 CYS  HN           14 VAL  MGY         5.50    (#    547:20  Unique         3.97, 6.57 A)
 &rst
  ixpk= 547, nxpk= 20, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   15 ILE  HN           14 VAL  MGY         5.50    (#    548:20  Unique         3.57, 4.93 A)
 &rst
  ixpk= 548, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HN           14 VAL  MGY         5.50    (#    549:20  Unique         2.53, 4.13 A)
 &rst
  ixpk= 549, nxpk= 20, iat= 198,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:550     14 VAL  MGY         5.50    (#    550:20  Single Ambig)
 &rst
  ixpk= 550, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1629, 306,2559,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  103 GLN  HE2+         14 VAL  MGY         5.50    (#    551:20  Unique         6.06, 8.84 A)
 &rst
  ixpk= 551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   99 TRP  HE3          14 VAL  MGY         5.50    (#    552:20  Unique         1.97, 3.60 A)
 &rst
  ixpk= 552, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:554     14 VAL  MGY         5.50    (#    554:20  Single Ambig)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2371,2380,1710,1711,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  HA           14 VAL  MGY         5.50    (#    555:20  Unique         3.17, 5.76 A)
 &rst
  ixpk= 555, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  129 TYR  HE           14 VAL  MGY         5.50    (#    556:20  Unique         3.15, 7.31 A)
 &rst
  ixpk= 556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2099,2104,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  101 LEU  HA           14 VAL  MGY         5.50    (#    557:20  Unique         2.62, 4.24 A)
 &rst
  ixpk= 557, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HA           14 VAL  MGY         5.50    (#    558:20  Unique         2.04, 3.12 A)
 &rst
  ixpk= 558, nxpk= 20, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   16 CYS  HB-          14 VAL  MGY         5.50    (#    559:20  Unique         3.81, 7.38 A)
 &rst
  ixpk= 559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 237, 238,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  HB           14 VAL  MGY         5.50    (#    560:20  Unique         2.55, 5.88 A)
 &rst
  ixpk= 560, nxpk= 20, iat= 327,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  HB           14 VAL  MGY         4.50    (#    561:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 561, nxpk= 20, iat= 202,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  148 MET  ME           14 VAL  MGY         4.50    (#    562:20  Unique         3.94, 7.14 A)
 &rst
  ixpk= 562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2459,2460,2461,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:563     14 VAL  MGY         5.50    (#    563:20  Single Ambig)
 &rst
  ixpk= 563, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 189, 190, 350, 351, 352,1063,1064,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  20-2:564     14 VAL  MGY         5.50    (#    564:20  Single Ambig)
 &rst
  ixpk= 564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1667,1664,1665,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGX         127 VAL  MGY         5.50    (#    565:20  Unique         1.99, 6.61 A)
 &rst
  ixpk= 565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  147 VAL  MGX          14 VAL  MGY         5.50    (#    567:20  Unique         1.98, 5.15 A)
 &rst
  ixpk= 567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#   84 VAL  MGX          93 ILE  HB          5.50    (#    568:20  Unique         4.42, 6.39 A)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1,1516, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          93 ILE  HB          5.50    (#    569:20  Unique         4.56, 6.79 A)
 &rst
  ixpk= 569, nxpk= 20, iat=  -1,1516, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:570     93 ILE  HB          3.50    (#    570:20  Single Ambig)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,1516, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1525,1526,1527,1522,1523,
 &end
#
#    0 AMB  20-2:571      0 AMB  20-1:571    4.50    (#    571:20  Double Ambig)
 &rst
  ixpk= 571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=1522,1523, 895, 896, 897, 899, 900, 901, 895, 896,
       897, 899, 900, 901,
 igr2=1516, 218,
 &end
#
#   15 ILE  QG2          15 ILE  HB          4.50    (#    572:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 572, nxpk= 20, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 220, 221, 222,
 &end
#
#    0 AMB  20-2:573      0 AMB  20-1:573    2.80    (#    573:20  Double Ambig)
 &rst
  ixpk= 573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1518,1519,1520, 224, 225,
 igr2=1516, 218,
 &end
#
#  102 LEU  HB-          15 ILE  HB          5.50    (#    574:20  Unique         4.80, 5.68 A)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#   15 ILE  HG1-         15 ILE  HB          5.50    (#    575:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1, 218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 224, 225,
 &end
#
#    0 AMB  20-2:576      0 AMB  20-1:576    5.50    (#    576:20  Double Ambig)
 &rst
  ixpk= 576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 919,1686, 248, 249,1198,1199,
 igr2= 218,1516,
 &end
#
#   93 ILE  HA           93 ILE  HB          4.50    (#    577:20  Unique         2.30, 2.42 A)
 &rst
  ixpk= 577, nxpk= 20, iat=1514,1516, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   94 GLY  HN           93 ILE  HB          5.50    (#    579:20  Unique         4.01, 4.35 A)
 &rst
  ixpk= 579, nxpk= 20, iat=1531,1516, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 ILE  HN           93 ILE  HB          5.50    (#    580:20  Unique         3.60, 3.69 A)
 &rst
  ixpk= 580, nxpk= 20, iat=1512,1516, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HN           15 ILE  HB          5.50    (#    581:20  Unique         3.14, 3.75 A)
 &rst
  ixpk= 581, nxpk= 20, iat= 339, 218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HN           15 ILE  HB          5.50    (#    582:20  Unique         2.23, 2.42 A)
 &rst
  ixpk= 582, nxpk= 20, iat= 214, 218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN           15 ILE  HB          5.50    (#    583:20  Unique         4.09, 4.35 A)
 &rst
  ixpk= 583, nxpk= 20, iat= 233, 218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HN           15 ILE  HG1+        5.50    (#    584:20  Unique         2.38, 3.22 A)
 &rst
  ixpk= 584, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 224, 225,
 &end
#
#   15 ILE  HN           15 ILE  HG1-        5.50    (#    585:20  Unique         2.38, 3.22 A)
 &rst
  ixpk= 585, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 224, 225,
 &end
#
#   15 ILE  HA           15 ILE  HG1-        5.50    (#    586:20  Unique         2.60, 3.25 A)
 &rst
  ixpk= 586, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 224, 225,
 &end
#
#   15 ILE  HA           15 ILE  HG1+        5.50    (#    587:20  Unique         2.60, 3.25 A)
 &rst
  ixpk= 587, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 224, 225,
 &end
#
#   15 ILE  HB           15 ILE  HG1+        5.50    (#    588:20  Unique         2.29, 2.46 A)
 &rst
  ixpk= 588, nxpk= 20, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 224, 225,
 &end
#
#    0 AMB  20-2:589      0 AMB  20-1:589    5.50    (#    589:20  Double Ambig)
 &rst
  ixpk= 589, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 970, 971, 218,
 igr2= 976, 977, 224, 225,
 &end
#
#   15 ILE  QG2          15 ILE  HG1+        5.50    (#    590:20  Unique         2.39, 3.54 A)
 &rst
  ixpk= 590, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 220, 221, 222,
 igr2= 224, 225,
 &end
#
#   15 ILE  QG2          15 ILE  HG1-        5.50    (#    591:20  Unique         2.39, 3.54 A)
 &rst
  ixpk= 591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 220, 221, 222,
 igr2= 224, 225,
 &end
#
#  102 LEU  HN           15 ILE  QD1         5.50    (#    592:20  Unique         3.55, 4.87 A)
 &rst
  ixpk= 592, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HN           15 ILE  QD1         5.50    (#    593:20  Unique         3.82, 4.67 A)
 &rst
  ixpk= 593, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#   16 CYS  HN           15 ILE  QD1         5.50    (#    594:20  Unique         2.50, 4.64 A)
 &rst
  ixpk= 594, nxpk= 20, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#  105 VAL  HN           15 ILE  QD1         5.50    (#    595:20  Unique         4.04, 5.78 A)
 &rst
  ixpk= 595, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#  104 LEU  HN           15 ILE  QD1         5.50    (#    596:20  Unique         3.08, 5.43 A)
 &rst
  ixpk= 596, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HA           15 ILE  QD1         5.50    (#    598:20  Unique         1.98, 2.98 A)
 &rst
  ixpk= 598, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#  104 LEU  HA           15 ILE  QD1         5.50    (#    599:20  Unique         2.38, 4.41 A)
 &rst
  ixpk= 599, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:600     15 ILE  QD1         5.50    (#    600:20  Single Ambig)
 &rst
  ixpk= 600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 893, 878, 879,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:601     15 ILE  QD1         5.50    (#    601:20  Single Ambig)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1719,1720, 343, 344,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  HB           15 ILE  QD1         3.50    (#    602:20  Unique         3.57, 3.91 A)
 &rst
  ixpk= 602, nxpk= 20, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 227, 228, 229,
 &end
#
#  102 LEU  HG           15 ILE  QD1         5.50    (#    603:20  Unique         2.15, 4.37 A)
 &rst
  ixpk= 603, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:604     15 ILE  QD1         3.50    (#    604:20  Single Ambig)
 &rst
  ixpk= 604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1683,1684, 224, 225,
 igr2= 227, 228, 229,
 &end
#
#   23 MET  ME           15 ILE  QD1         5.50    (#    605:20  Unique         3.28, 6.99 A)
 &rst
  ixpk= 605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 350, 351, 352,
 igr2= 227, 228, 229,
 &end
#
#  104 LEU  MDY          15 ILE  QD1         5.50    (#    606:20  Unique         3.00, 6.70 A)
 &rst
  ixpk= 606, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2= 227, 228, 229,
 &end
#
#   15 ILE  QG2          15 ILE  QD1         3.50    (#    607:20  Unique         2.06, 3.51 A)
 &rst
  ixpk= 607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 220, 221, 222,
 igr2= 227, 228, 229,
 &end
#
#    0 AMB  20-2:608     15 ILE  QD1         5.50    (#    608:20  Single Ambig)
 &rst
  ixpk= 608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 227, 228, 229,
 &end
#
#  111 ILE  QD1          15 ILE  QD1         5.50    (#    609:20  Unique         4.79, 7.66 A)
 &rst
  ixpk= 609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1818,1819,1820,
 igr2= 227, 228, 229,
 &end
#
#   16 CYS  HN           15 ILE  QG2         4.50    (#    610:20  Unique         2.30, 3.79 A)
 &rst
  ixpk= 610, nxpk= 20, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HN           15 ILE  QG2         5.50    (#    611:20  Unique         3.90, 4.51 A)
 &rst
  ixpk= 611, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#   23 MET  HN           15 ILE  QG2         5.50    (#    612:20  Unique         3.63, 5.44 A)
 &rst
  ixpk= 612, nxpk= 20, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:613     15 ILE  QG2         5.50    (#    613:20  Single Ambig)
 &rst
  ixpk= 613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1698, 198,
 igr2= 220, 221, 222,
 &end
#
#  104 LEU  HN           15 ILE  QG2         5.50    (#    614:20  Unique         2.79, 4.24 A)
 &rst
  ixpk= 614, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#  126 TRP  HZ2          15 ILE  QG2         5.50    (#    615:20  Unique         4.74, 6.35 A)
 &rst
  ixpk= 615, nxpk= 20, iat=2051,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#  126 TRP  HH2          15 ILE  QG2         5.50    (#    616:20  Unique         3.05, 5.71 A)
 &rst
  ixpk= 616, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#   17 ASN  HD2+         15 ILE  QG2         5.50    (#    617:20  Unique         2.65, 4.72 A)
 &rst
  ixpk= 617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 253, 254,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HA           15 ILE  QG2         5.50    (#    618:20  Unique         2.40, 3.20 A)
 &rst
  ixpk= 618, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#  103 GLN  HA           15 ILE  QG2         5.50    (#    619:20  Unique         4.04, 5.30 A)
 &rst
  ixpk= 619, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#  104 LEU  HA           15 ILE  QG2         5.50    (#    620:20  Unique         2.68, 3.74 A)
 &rst
  ixpk= 620, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 220, 221, 222,
 &end
#
#   16 CYS  HB-          15 ILE  QG2         5.50    (#    621:20  Unique         4.46, 6.23 A)
 &rst
  ixpk= 621, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 237, 238,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:622     15 ILE  QG2         4.50    (#    622:20  Single Ambig)
 &rst
  ixpk= 622, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1719,1720, 343, 344, 343, 344,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HB           15 ILE  QG2         3.50    (#    623:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 623, nxpk= 20, iat= 218,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  HG1-         15 ILE  QG2         4.50    (#    624:20  Unique         2.39, 3.54 A)
 &rst
  ixpk= 624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 224, 225,
 igr2= 220, 221, 222,
 &end
#
#  104 LEU  HB-          15 ILE  QG2         4.50    (#    625:20  Unique         2.01, 3.73 A)
 &rst
  ixpk= 625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1719,1720,
 igr2= 220, 221, 222,
 &end
#
#    0 AMB  20-2:626     15 ILE  QG2         4.50    (#    626:20  Single Ambig)
 &rst
  ixpk= 626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 220, 221, 222,
 &end
#
#   15 ILE  QD1          15 ILE  QG2         2.80    (#    627:20  Unique         2.06, 3.51 A)
 &rst
  ixpk= 627, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 227, 228, 229,
 igr2= 220, 221, 222,
 &end
#
#   16 CYS  HN           16 CYS  HA          5.50    (#    628:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 628, nxpk= 20, iat= 233, 235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HN           16 CYS  HA          5.50    (#    629:20  Unique         3.63, 4.09 A)
 &rst
  ixpk= 629, nxpk= 20, iat= 339, 235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           16 CYS  HA          4.50    (#    630:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 630, nxpk= 20, iat= 244, 235, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 GLN  HN           16 CYS  HA          5.50    (#    631:20  Unique         3.34, 4.01 A)
 &rst
  ixpk= 631, nxpk= 20, iat= 306, 235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2+         16 CYS  HA          5.50    (#    632:20  Unique         4.33, 5.30 A)
 &rst
  ixpk= 632, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   22 VAL  HA           16 CYS  HA          5.50    (#    633:20  Unique         2.69, 3.41 A)
 &rst
  ixpk= 633, nxpk= 20, iat= 325, 235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HA           16 CYS  HA          5.50    (#    635:20  Unique         4.38, 4.41 A)
 &rst
  ixpk= 635, nxpk= 20, iat= 216, 235, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HB+          16 CYS  HA          5.50    (#    636:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 636, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#   16 CYS  HB-          16 CYS  HA          5.50    (#    637:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 637, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#    0 AMB  20-2:638     16 CYS  HA          5.50    (#    638:20  Single Ambig)
 &rst
  ixpk= 638, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 327,
 &end
#
#   22 VAL  MGY          16 CYS  HA          5.50    (#    640:20  Unique         3.92, 6.31 A)
 &rst
  ixpk= 640, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  101 LEU  MDX          16 CYS  HA          5.50    (#    641:20  Unique         4.58, 6.21 A)
 &rst
  ixpk= 641, nxpk= 20, iat=  -1, 235, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  MDX          16 CYS  HB+         5.50    (#    642:20  Unique         2.13, 4.58 A)
 &rst
  ixpk= 642, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2= 237, 238,
 &end
#
#  101 LEU  MDX          16 CYS  HB-         5.50    (#    643:20  Unique         2.13, 4.58 A)
 &rst
  ixpk= 643, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2= 237, 238,
 &end
#
#  155 VAL  MGX          16 CYS  HB+         5.50    (#    644:20  Unique         1.96, 4.18 A)
 &rst
  ixpk= 644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2= 237, 238,
 &end
#
#   22 VAL  MGY          16 CYS  HB+         5.50    (#    645:20  Unique         3.81, 7.71 A)
 &rst
  ixpk= 645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 237, 238,
 &end
#
#  155 VAL  MGX           0 AMB  20-1:646    5.50    (#    646:20  Single Ambig)
 &rst
  ixpk= 646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2= 237, 238,2582,2583,
 &end
#
#   22 VAL  MGY          16 CYS  HB-         5.50    (#    647:20  Unique         3.81, 7.71 A)
 &rst
  ixpk= 647, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 237, 238,
 &end
#
#    0 AMB  20-2:648      0 AMB  20-1:648    5.50    (#    648:20  Double Ambig)
 &rst
  ixpk= 648, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.58, r4=10.08,
 igr1=2565,2566,2567,2569,2570,2571,1667,
 igr2= 237, 238,2582,2583,
 &end
#
#    0 AMB  20-2:649      0 AMB  20-1:649    5.50    (#    649:20  Double Ambig)
 &rst
  ixpk= 649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.58, r4=10.08,
 igr1=2565,2566,2567,2569,2570,2571,1667,
 igr2= 237, 238, 237, 238,
 &end
#
#    0 AMB  20-2:650      0 AMB  20-1:650    5.50    (#    650:20  Double Ambig)
 &rst
  ixpk= 650, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 262, 263, 265, 266,
 igr2= 237, 238, 237, 238,
 &end
#
#   22 VAL  HA           16 CYS  HB+         5.50    (#    652:20  Unique         4.04, 5.30 A)
 &rst
  ixpk= 652, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   22 VAL  HA           16 CYS  HB-         5.50    (#    653:20  Unique         4.04, 5.30 A)
 &rst
  ixpk= 653, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   16 CYS  HA           16 CYS  HB+         5.50    (#    654:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 654, nxpk= 20, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   16 CYS  HA           16 CYS  HB-         5.50    (#    655:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 655, nxpk= 20, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   17 ASN  HN           16 CYS  HB-         5.50    (#    656:20  Unique         2.91, 3.84 A)
 &rst
  ixpk= 656, nxpk= 20, iat= 244,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   17 ASN  HN           16 CYS  HB+         5.50    (#    657:20  Unique         2.91, 3.84 A)
 &rst
  ixpk= 657, nxpk= 20, iat= 244,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   16 CYS  HN           16 CYS  HB+         5.50    (#    658:20  Unique         2.23, 3.01 A)
 &rst
  ixpk= 658, nxpk= 20, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   16 CYS  HN           16 CYS  HB-         5.50    (#    659:20  Unique         2.23, 3.01 A)
 &rst
  ixpk= 659, nxpk= 20, iat= 233,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 237, 238,
 &end
#
#   18 ARG  HN           17 ASN  HA          5.50    (#    660:20  Unique         2.33, 2.83 A)
 &rst
  ixpk= 660, nxpk= 20, iat= 258, 246, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           17 ASN  HA          5.50    (#    661:20  Unique         2.79, 2.89 A)
 &rst
  ixpk= 661, nxpk= 20, iat= 244, 246, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HB+          17 ASN  HA          5.50    (#    662:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1, 246, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
#    0 AMB  20-2:663     17 ASN  HA          5.50    (#    663:20  Single Ambig)
 &rst
  ixpk= 663, nxpk= 20, iat=  -1, 246, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 262, 263,1702,1703, 286, 287,
 &end
#
#   17 ASN  HB-          17 ASN  HA          5.50    (#    665:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 665, nxpk= 20, iat=  -1, 246, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
#   18 ARG  HG+          17 ASN  HB+         5.50    (#    666:20  Unique         2.39, 5.01 A)
 &rst
  ixpk= 666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 265, 266,
 igr2= 248, 249,
 &end
#
#   18 ARG  HG+          17 ASN  HB-         5.50    (#    667:20  Unique         2.39, 5.01 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 265, 266,
 igr2= 248, 249,
 &end
#
#   17 ASN  HA           17 ASN  HB+         5.50    (#    668:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 668, nxpk= 20, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 248, 249,
 &end
#
#   17 ASN  HA           17 ASN  HB-         5.50    (#    669:20  Unique         2.26, 2.65 A)
 &rst
  ixpk= 669, nxpk= 20, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 248, 249,
 &end
#
#   17 ASN  HD2+         17 ASN  HB-         5.50    (#    671:20  Unique         2.12, 3.38 A)
 &rst
  ixpk= 671, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 253, 254,
 igr2= 248, 249,
 &end
#
#   17 ASN  HD2+         17 ASN  HB+         5.50    (#    672:20  Unique         2.12, 3.38 A)
 &rst
  ixpk= 672, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 253, 254,
 igr2= 248, 249,
 &end
#
#   18 ARG  HN           17 ASN  HB-         5.50    (#    673:20  Unique         1.90, 3.64 A)
 &rst
  ixpk= 673, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 248, 249,
 &end
#
#   18 ARG  HN           17 ASN  HB+         5.50    (#    674:20  Unique         1.90, 3.64 A)
 &rst
  ixpk= 674, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 248, 249,
 &end
#
#    0 AMB  20-2:675     18 ARG  HA          5.50    (#    675:20  Single Ambig)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,2565,2566,2567,2569,
      2570,2571,
 &end
#
#   18 ARG  HG-          18 ARG  HA          4.50    (#    676:20  Unique         2.64, 3.38 A)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 265, 266,
 &end
#
#    0 AMB  20-2:677     18 ARG  HA          3.50    (#    677:20  Single Ambig)
 &rst
  ixpk= 677, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 262, 263, 265, 266,
 &end
#
#   18 ARG  HB+          18 ARG  HA          4.50    (#    678:20  Unique         2.25, 2.59 A)
 &rst
  ixpk= 678, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 262, 263,
 &end
#
#    0 AMB  20-2:679     18 ARG  HA          5.50    (#    679:20  Single Ambig)
 &rst
  ixpk= 679, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2626,2627, 289, 290,
 &end
#
#    0 AMB  20-2:680     18 ARG  HA          5.50    (#    680:20  Single Ambig)
 &rst
  ixpk= 680, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 268, 269, 268, 269,
 &end
#
#   17 ASN  HA           18 ARG  HA          5.50    (#    681:20  Unique         4.30, 4.68 A)
 &rst
  ixpk= 681, nxpk= 20, iat= 246, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2-         18 ARG  HA          5.50    (#    682:20  Unique         3.33, 5.19 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#  103 GLN  HE2+         18 ARG  HA          5.50    (#    683:20  Unique         3.33, 5.19 A)
 &rst
  ixpk= 683, nxpk= 20, iat=  -1, 260, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   19 GLN  HN           18 ARG  HA          5.50    (#    684:20  Unique         2.80, 3.15 A)
 &rst
  ixpk= 684, nxpk= 20, iat= 282, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 ARG  HN           18 ARG  HA          5.50    (#    685:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 685, nxpk= 20, iat= 258, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLY  HN           18 ARG  HA          5.50    (#    686:20  Unique         3.50, 3.98 A)
 &rst
  ixpk= 686, nxpk= 20, iat= 299, 260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 ARG  HG-          18 ARG  HB+         3.50    (#    687:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 265, 266,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:688      0 AMB  20-1:688    4.50    (#    688:20  Double Ambig)
 &rst
  ixpk= 688, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 268, 269, 268, 269,
 igr2= 262, 263, 262, 263,
 &end
#
#    0 AMB  20-2:689     18 ARG  HB-         4.50    (#    689:20  Single Ambig)
 &rst
  ixpk= 689, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 268, 269, 268, 269,
 igr2= 262, 263,
 &end
#
#    0 AMB  20-2:690      0 AMB  20-1:690    5.50    (#    690:20  Double Ambig)
 &rst
  ixpk= 690, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 260,2489,
 igr2= 262, 263,2475,2476,
 &end
#
#   18 ARG  HA           18 ARG  HB+         5.50    (#    691:20  Unique         2.25, 2.59 A)
 &rst
  ixpk= 691, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 262, 263,
 &end
#
#   82 ARG  HA           82 ARG  HB+         4.50    (#    692:20  Unique         2.27, 2.47 A)
 &rst
  ixpk= 692, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1320,1321,
 &end
#
#    0 AMB  20-2:693      0 AMB  20-1:693    5.50    (#    693:20  Double Ambig)
 &rst
  ixpk= 693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2467,1290,
 igr2=2475,2476,1304,1305,1304,1305,
 &end
#
#   18 ARG  HN           18 ARG  HB+         4.50    (#    694:20  Unique         2.72, 3.57 A)
 &rst
  ixpk= 694, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 262, 263,
 &end
#
#   52 ARG  HN           52 ARG  HB-         5.50    (#    695:20  Unique         2.15, 2.56 A)
 &rst
  ixpk= 695, nxpk= 20, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 790, 791,
 &end
#
#    0 AMB  20-2:696      0 AMB  20-1:696    5.50    (#    696:20  Double Ambig)
 &rst
  ixpk= 696, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.56, r4=11.06,
 igr1=1538,1761,1501,1016,1375,
 igr2=1249,1250,1249,1250, 262, 263,1249,1250,1249,1250,
      
 &end
#
#   18 ARG  HN           18 ARG  HG+         5.50    (#    699:20  Unique         1.79, 3.11 A)
 &rst
  ixpk= 699, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 265, 266,
 &end
#
#   18 ARG  HN           18 ARG  HG-         5.50    (#    700:20  Unique         1.79, 3.11 A)
 &rst
  ixpk= 700, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 265, 266,
 &end
#
#   19 GLN  HN           18 ARG  HG+         5.50    (#    701:20  Unique         2.83, 4.42 A)
 &rst
  ixpk= 701, nxpk= 20, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:702      0 AMB  20-1:702    5.50    (#    702:20  Double Ambig)
 &rst
  ixpk= 702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 282,2269,
 igr2= 265, 266,2318,2319,
 &end
#
#   18 ARG  HA           18 ARG  HG+         4.50    (#    703:20  Unique         2.64, 3.38 A)
 &rst
  ixpk= 703, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 265, 266,
 &end
#
#   18 ARG  HA           18 ARG  HG-         4.50    (#    704:20  Unique         2.64, 3.38 A)
 &rst
  ixpk= 704, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 265, 266,
 &end
#
#    0 AMB  20-2:705      0 AMB  20-1:705    2.80    (#    705:20  Double Ambig)
 &rst
  ixpk= 705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=2418,2419,2418,2419, 268, 269, 268, 269,
 igr2=2415,2416, 265, 266, 265, 266,
 &end
#
#    0 AMB  20-2:706     18 ARG  HG-         2.80    (#    706:20  Single Ambig)
 &rst
  ixpk= 706, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 268, 269, 268, 269,
 igr2= 265, 266,
 &end
#
#   18 ARG  HB+          18 ARG  HG-         2.80    (#    707:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 262, 263,
 igr2= 265, 266,
 &end
#
#   18 ARG  HB+          18 ARG  HG+         2.80    (#    708:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 708, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 262, 263,
 igr2= 265, 266,
 &end
#
#   18 ARG  HN            0 AMB  20-1:709    5.50    (#    709:20  Single Ambig)
 &rst
  ixpk= 709, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:710      0 AMB  20-1:710    4.50    (#    710:20  Double Ambig)
 &rst
  ixpk= 710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=2634,2635,2634,2635, 294, 295, 294, 295,
 igr2= 268, 269, 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:711      0 AMB  20-1:711    4.50    (#    711:20  Double Ambig)
 &rst
  ixpk= 711, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1= 446, 454,2209,1710,1711,1710,1711,
 igr2=1955,1956,2321,2322, 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:712      0 AMB  20-1:712    5.50    (#    712:20  Double Ambig)
 &rst
  ixpk= 712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1867,1868,1710,1711,2371,2380,
 igr2=1955,1956, 268, 269, 268, 269,2321,2322,
 &end
#
#   19 GLN  HE2-          0 AMB  20-1:713    5.50    (#    713:20  Single Ambig)
 &rst
  ixpk= 713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 294, 295,
 igr2= 268, 269, 268, 269,
 &end
#
#   18 ARG  HA            0 AMB  20-1:714    5.50    (#    714:20  Single Ambig)
 &rst
  ixpk= 714, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:715    141 ARG  HD-         5.50    (#    715:20  Single Ambig)
 &rst
  ixpk= 715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2313,2273,2274,
 igr2=2321,2322,
 &end
#
#    0 AMB  20-2:716      0 AMB  20-1:716    3.50    (#    716:20  Double Ambig)
 &rst
  ixpk= 716, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 262, 263, 262, 263,
 igr2= 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:717      0 AMB  20-1:717    2.80    (#    717:20  Double Ambig)
 &rst
  ixpk= 717, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=2192,2193, 265, 266,
 igr2=2321,2322, 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:718      0 AMB  20-1:718    2.80    (#    718:20  Double Ambig)
 &rst
  ixpk= 718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1= 262, 263,2315,2316, 265, 266, 265, 266,2318,2319,
      
 igr2= 268, 269, 268, 269,2321,2322, 268, 269,
 &end
#
#    0 AMB  20-2:719      0 AMB  20-1:719    2.80    (#    719:20  Double Ambig)
 &rst
  ixpk= 719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 265, 266, 265, 266,
 igr2= 268, 269, 268, 269,
 &end
#
#   68 LEU  HN           68 LEU  HA          5.50    (#    721:20  Unique         2.92, 2.93 A)
 &rst
  ixpk= 721, nxpk= 20, iat=1059,1061, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLY  HN           19 GLN  HA          5.50    (#    722:20  Unique         2.93, 3.27 A)
 &rst
  ixpk= 722, nxpk= 20, iat= 299, 284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  HN           68 LEU  HA          5.50    (#    723:20  Unique         3.37, 3.48 A)
 &rst
  ixpk= 723, nxpk= 20, iat=1078,1061, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HN           19 GLN  HA          4.50    (#    724:20  Unique         2.73, 2.90 A)
 &rst
  ixpk= 724, nxpk= 20, iat= 282, 284, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 ARG  HA           19 GLN  HA          5.50    (#    725:20  Unique         4.38, 4.51 A)
 &rst
  ixpk= 725, nxpk= 20, iat= 260, 284, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:726     19 GLN  HA          3.50    (#    726:20  Single Ambig)
 &rst
  ixpk= 726, nxpk= 20, iat=  -1, 284, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2626,2627, 286, 287, 289, 290,
 &end
#
#   19 GLN  HB-          19 GLN  HA          4.50    (#    727:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 727, nxpk= 20, iat=  -1, 284, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 286, 287,
 &end
#
#    0 AMB  20-2:728      0 AMB  20-1:728    5.50    (#    728:20  Double Ambig)
 &rst
  ixpk= 728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1023,1024, 265, 266,
 igr2=1061, 284,
 &end
#
#   68 LEU  HB+          68 LEU  HA          5.50    (#    729:20  Unique         2.29, 2.81 A)
 &rst
  ixpk= 729, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#   68 LEU  HB-          68 LEU  HA          4.50    (#    730:20  Unique         2.29, 2.81 A)
 &rst
  ixpk= 730, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   68 LEU  MDY          68 LEU  HA          3.50    (#    731:20  Unique         1.99, 3.52 A)
 &rst
  ixpk= 731, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#   68 LEU  MDX          68 LEU  HA          5.50    (#    732:20  Unique         1.99, 3.52 A)
 &rst
  ixpk= 732, nxpk= 20, iat=  -1,1061, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#    0 AMB  20-2:733      0 AMB  20-1:733    5.50    (#    733:20  Double Ambig)
 &rst
  ixpk= 733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 265, 266, 742, 743, 744,
 igr2= 286, 287, 725, 726,
 &end
#
#   19 GLN  HA           19 GLN  HB+         4.50    (#    737:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 737, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 286, 287,
 &end
#
#   19 GLN  HA           19 GLN  HB-         4.50    (#    738:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 738, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 286, 287,
 &end
#
#   45 SER  HA           48 GLN  HB-         5.50    (#    739:20  Unique         5.11, 6.26 A)
 &rst
  ixpk= 739, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 725, 726,
 &end
#
#   19 GLN  HN           19 GLN  HB-         4.50    (#    740:20  Unique         2.51, 3.32 A)
 &rst
  ixpk= 740, nxpk= 20, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 286, 287,
 &end
#
#   19 GLN  HN           19 GLN  HB+         5.50    (#    741:20  Unique         2.51, 3.32 A)
 &rst
  ixpk= 741, nxpk= 20, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 286, 287,
 &end
#
#    0 AMB  20-2:742      0 AMB  20-1:742    3.50    (#    742:20  Double Ambig)
 &rst
  ixpk= 742, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 286, 287, 262, 263,
 igr2= 289, 290, 289, 290,
 &end
#
#   19 GLN  HB-           0 AMB  20-1:743    3.50    (#    743:20  Single Ambig)
 &rst
  ixpk= 743, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 286, 287,
 igr2= 289, 290, 313, 314,
 &end
#
#   19 GLN  HA           19 GLN  HG+         4.50    (#    744:20  Unique         2.54, 3.23 A)
 &rst
  ixpk= 744, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 289, 290,
 &end
#
#   19 GLN  HA           19 GLN  HG-         4.50    (#    745:20  Unique         2.54, 3.23 A)
 &rst
  ixpk= 745, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 289, 290,
 &end
#
#   20 GLY  HN           19 GLN  HG+         5.50    (#    746:20  Unique         2.57, 4.61 A)
 &rst
  ixpk= 746, nxpk= 20, iat= 299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 289, 290,
 &end
#
#    0 AMB  20-2:747      0 AMB  20-1:747    5.50    (#    747:20  Double Ambig)
 &rst
  ixpk= 747, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 299,2078,
 igr2= 289, 290, 313, 314, 313, 314,
 &end
#
#   18 ARG  HN           19 GLN  HG+         5.50    (#    748:20  Unique         2.87, 5.22 A)
 &rst
  ixpk= 748, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 289, 290,
 &end
#
#   18 ARG  HN           19 GLN  HG-         5.50    (#    749:20  Unique         2.87, 5.22 A)
 &rst
  ixpk= 749, nxpk= 20, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 289, 290,
 &end
#
#   19 GLN  HN           19 GLN  HG+         5.50    (#    750:20  Unique         1.79, 3.33 A)
 &rst
  ixpk= 750, nxpk= 20, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 289, 290,
 &end
#
#   19 GLN  HN           19 GLN  HG-         4.50    (#    751:20  Unique         1.79, 3.33 A)
 &rst
  ixpk= 751, nxpk= 20, iat= 282,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 289, 290,
 &end
#
#   19 GLN  HE2+         19 GLN  HG+         5.50    (#    752:20  Unique         2.12, 3.29 A)
 &rst
  ixpk= 752, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 294, 295,
 igr2= 289, 290,
 &end
#
#   19 GLN  HE2+         19 GLN  HG-         5.50    (#    753:20  Unique         2.12, 3.29 A)
 &rst
  ixpk= 753, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 294, 295,
 igr2= 289, 290,
 &end
#
#  159 GLN  HE2-         19 GLN  HG+         5.50    (#    754:20  Unique         5.12, 6.58 A)
 &rst
  ixpk= 754, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2634,2635,
 igr2= 289, 290,
 &end
#
#  159 GLN  HE2-          0 AMB  20-1:755    5.50    (#    755:20  Single Ambig)
 &rst
  ixpk= 755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2634,2635,
 igr2= 313, 314, 289, 290,
 &end
#
#   20 GLY  HN           20 GLY  HA-         4.50    (#    756:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 756, nxpk= 20, iat= 299,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 301, 302,
 &end
#
#   21 GLN  HN           20 GLY  HA-         5.50    (#    757:20  Unique         2.70, 3.20 A)
 &rst
  ixpk= 757, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 301, 302,
 &end
#
#   19 GLN  HA           20 GLY  HA-         5.50    (#    758:20  Unique         4.39, 4.76 A)
 &rst
  ixpk= 758, nxpk= 20, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 301, 302,
 &end
#
#   20 GLY  HN           20 GLY  HA+         4.50    (#    759:20  Unique         2.30, 2.67 A)
 &rst
  ixpk= 759, nxpk= 20, iat= 299,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 301, 302,
 &end
#
#   21 GLN  HN           20 GLY  HA+         5.50    (#    760:20  Unique         2.70, 3.20 A)
 &rst
  ixpk= 760, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 301, 302,
 &end
#
#    0 AMB  20-2:762      0 AMB  20-1:762    5.50    (#    762:20  Double Ambig)
 &rst
  ixpk= 762, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.76, r4=11.26,
 igr1= 286, 287,2607,2608, 262, 263,1722,
 igr2= 301, 302, 301, 302, 301, 302, 301, 302,
 &end
#
#    0 AMB  20-2:763     20 GLY  HA-         5.50    (#    763:20  Single Ambig)
 &rst
  ixpk= 763, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 286, 287,2607,2608, 262, 263,
 igr2= 301, 302,
 &end
#
#    0 AMB  20-2:764      0 AMB  20-1:764    5.50    (#    764:20  Double Ambig)
 &rst
  ixpk= 764, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 289, 290, 313, 314,
 igr2= 301, 302, 301, 302,
 &end
#
#    0 AMB  20-2:765     20 GLY  HA-         5.50    (#    765:20  Single Ambig)
 &rst
  ixpk= 765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 289, 290, 313, 314,2626,2627,
 igr2= 301, 302,
 &end
#
#  155 VAL  MGX          20 GLY  HA+         4.50    (#    766:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2= 301, 302,
 &end
#
#  155 VAL  MGX          20 GLY  HA-         5.50    (#    767:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 767, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2= 301, 302,
 &end
#
#   21 GLN  HN           21 GLN  HB-         5.50    (#    768:20  Unique         2.42, 3.47 A)
 &rst
  ixpk= 768, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 310, 311,
 &end
#
#    0 AMB  20-2:770     21 GLN  HB-         5.50    (#    770:20  Single Ambig)
 &rst
  ixpk= 770, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2042,2043,2042,2043,
 igr2= 310, 311,
 &end
#
#   21 GLN  HN           21 GLN  HB+         5.50    (#    771:20  Unique         2.42, 3.47 A)
 &rst
  ixpk= 771, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 310, 311,
 &end
#
#    0 AMB  20-2:772      0 AMB  20-1:772    5.50    (#    772:20  Double Ambig)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 318, 319,2397,
 igr2= 310, 311,2173,
 &end
#
#   22 VAL  HN           21 GLN  HB+         5.50    (#    773:20  Unique         1.81, 2.76 A)
 &rst
  ixpk= 773, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 310, 311,
 &end
#
#    0 AMB  20-2:775      0 AMB  20-1:775    5.50    (#    775:20  Double Ambig)
 &rst
  ixpk= 775, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2042,2043,2042,2043,
 igr2= 310, 311, 310, 311,
 &end
#
#   22 VAL  HN           21 GLN  HG+         5.50    (#    776:20  Unique         3.58, 4.47 A)
 &rst
  ixpk= 776, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 313, 314,
 &end
#
#   22 VAL  HN           21 GLN  HG-         5.50    (#    777:20  Unique         3.58, 4.47 A)
 &rst
  ixpk= 777, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 313, 314,
 &end
#
#   21 GLN  HN           21 GLN  HG-         5.50    (#    778:20  Unique         1.97, 3.71 A)
 &rst
  ixpk= 778, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 313, 314,
 &end
#
#   21 GLN  HN            0 AMB  20-1:779    5.50    (#    779:20  Single Ambig)
 &rst
  ixpk= 779, nxpk= 20, iat= 306,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 313, 314, 289, 290,
 &end
#
#   21 GLN  HE2+         21 GLN  HG-         5.50    (#    780:20  Unique         2.12, 3.19 A)
 &rst
  ixpk= 780, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 318, 319,
 igr2= 313, 314,
 &end
#
#    0 AMB  20-2:781      0 AMB  20-1:781    5.50    (#    781:20  Double Ambig)
 &rst
  ixpk= 781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 318, 319, 294, 295, 318, 319,
 igr2= 289, 290, 313, 314,
 &end
#
#   21 GLN  HE2-         21 GLN  HG-         5.50    (#    782:20  Unique         2.12, 3.19 A)
 &rst
  ixpk= 782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 318, 319,
 igr2= 313, 314,
 &end
#
#   21 GLN  HE2-          0 AMB  20-1:783    5.50    (#    783:20  Single Ambig)
 &rst
  ixpk= 783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 318, 319,
 igr2= 289, 290, 313, 314,
 &end
#
#   14 VAL  MGY          22 VAL  HA          5.50    (#    786:20  Unique         3.17, 5.76 A)
 &rst
  ixpk= 786, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGY          22 VAL  HA          4.50    (#    787:20  Unique         2.01, 3.36 A)
 &rst
  ixpk= 787, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HB           22 VAL  HA          5.50    (#    788:20  Unique         2.38, 2.63 A)
 &rst
  ixpk= 788, nxpk= 20, iat= 327, 325, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:789     22 VAL  HA          5.50    (#    789:20  Single Ambig)
 &rst
  ixpk= 789, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 237, 238, 360, 361,
 &end
#
#   16 CYS  HA           22 VAL  HA          5.50    (#    790:20  Unique         2.69, 3.41 A)
 &rst
  ixpk= 790, nxpk= 20, iat= 235, 325, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           22 VAL  HA          5.50    (#    793:20  Unique         4.12, 4.82 A)
 &rst
  ixpk= 793, nxpk= 20, iat= 244, 325, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HN           22 VAL  HA          5.50    (#    794:20  Unique         2.15, 2.21 A)
 &rst
  ixpk= 794, nxpk= 20, iat= 339, 325, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  MGY          22 VAL  HB          5.50    (#    795:20  Unique         2.55, 5.88 A)
 &rst
  ixpk= 795, nxpk= 20, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   22 VAL  MGY          22 VAL  HB          5.50    (#    796:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 796, nxpk= 20, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   71 THR  MG2         150 GLU  HG+         5.50    (#    797:20  Unique         2.56, 5.75 A)
 &rst
  ixpk= 797, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=2494,2495,
 &end
#
#    0 AMB  20-2:798     22 VAL  HB          5.50    (#    798:20  Single Ambig)
 &rst
  ixpk= 798, nxpk= 20, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=2459,2460,2461,2162,2163,
 &end
#
#   22 VAL  MGX          22 VAL  HB          4.50    (#    799:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1, 327, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HA           22 VAL  HB          5.50    (#    800:20  Unique         2.38, 2.63 A)
 &rst
  ixpk= 800, nxpk= 20, iat= 325, 327, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HN           22 VAL  HB          5.50    (#    801:20  Unique         2.36, 3.42 A)
 &rst
  ixpk= 801, nxpk= 20, iat= 339, 327, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:802     22 VAL  MGX         5.50    (#    802:20  Single Ambig)
 &rst
  ixpk= 802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2159,2160, 204, 205, 206, 208, 209, 210,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   14 VAL  MGY          22 VAL  MGX         5.50    (#    803:20  Unique         2.08, 6.17 A)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  127 VAL  MGX          22 VAL  MGX         4.50    (#    804:20  Unique         1.99, 6.61 A)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  148 MET  ME           22 VAL  MGX         5.50    (#    805:20  Unique         1.98, 3.99 A)
 &rst
  ixpk= 805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2459,2460,2461,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  132 PRO  HG+          22 VAL  MGX         5.50    (#    806:20  Unique         1.97, 4.15 A)
 &rst
  ixpk= 806, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2159,2160,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:807     22 VAL  MGX         5.50    (#    807:20  Single Ambig)
 &rst
  ixpk= 807, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 327, 310, 311,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HA           22 VAL  MGX         5.50    (#    808:20  Unique         2.00, 4.72 A)
 &rst
  ixpk= 808, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  152 ALA  HA           22 VAL  MGX         5.50    (#    809:20  Unique         5.31, 8.57 A)
 &rst
  ixpk= 809, nxpk= 20, iat=2524,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HA           22 VAL  MGX         5.50    (#    810:20  Unique         2.01, 3.36 A)
 &rst
  ixpk= 810, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:811     22 VAL  MGX         5.50    (#    811:20  Single Ambig)
 &rst
  ixpk= 811, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 369,1710,1711,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HN           22 VAL  MGX         5.50    (#    812:20  Unique         1.93, 3.62 A)
 &rst
  ixpk= 812, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  127 VAL  HN           22 VAL  MGX         5.50    (#    813:20  Unique         2.84, 5.86 A)
 &rst
  ixpk= 813, nxpk= 20, iat=2062,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HN           22 VAL  MGY         5.50    (#    814:20  Unique         1.93, 3.62 A)
 &rst
  ixpk= 814, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HN           22 VAL  MGY         5.50    (#    815:20  Unique         4.08, 7.03 A)
 &rst
  ixpk= 815, nxpk= 20, iat=2089,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:816     22 VAL  MGY         5.50    (#    816:20  Single Ambig)
 &rst
  ixpk= 816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 244,2502,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   16 CYS  HA           22 VAL  MGY         5.50    (#    817:20  Unique         3.92, 6.31 A)
 &rst
  ixpk= 817, nxpk= 20, iat= 235,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   22 VAL  HA           22 VAL  MGY         5.50    (#    818:20  Unique         2.01, 3.36 A)
 &rst
  ixpk= 818, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:819     22 VAL  MGY         4.50    (#    819:20  Single Ambig)
 &rst
  ixpk= 819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2097,2106,2099,2104,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HA           22 VAL  MGY         5.50    (#    820:20  Unique         2.00, 4.72 A)
 &rst
  ixpk= 820, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:821      0 AMB  20-1:821    5.50    (#    821:20  Double Ambig)
 &rst
  ixpk= 821, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1281,1282, 360, 361,
 igr2=1349,1350,1351,1353,1354,1355, 329, 330, 331, 333,
       334, 335,
 &end
#
#    0 AMB  20-2:822      0 AMB  20-1:822    5.50    (#    822:20  Double Ambig)
 &rst
  ixpk= 822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 237, 238,1505,1506, 555, 556,
 igr2= 329, 330, 331, 333, 334, 335,1349,1350,1351,1353,
      1354,1355,
 &end
#
#    0 AMB  20-2:823     22 VAL  MGY         4.50    (#    823:20  Single Ambig)
 &rst
  ixpk= 823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 327, 310, 311,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   14 VAL  MGY          22 VAL  MGY         4.50    (#    824:20  Unique         2.08, 6.17 A)
 &rst
  ixpk= 824, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2= 329, 330, 331, 333, 334, 335,
 &end
#
#   24 TRP  HN           23 MET  HA          5.50    (#    825:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 825, nxpk= 20, iat= 356, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:826     23 MET  HA          3.50    (#    826:20  Single Ambig)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 343, 344, 343, 344,
 &end
#
#  127 VAL  HN           23 MET  HA          5.50    (#    827:20  Unique         4.47, 5.06 A)
 &rst
  ixpk= 827, nxpk= 20, iat=2062, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HN           23 MET  HA          5.50    (#    828:20  Unique         2.72, 2.78 A)
 &rst
  ixpk= 828, nxpk= 20, iat= 339, 341, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HB-          23 MET  HA          5.50    (#    830:20  Unique         4.14, 4.73 A)
 &rst
  ixpk= 830, nxpk= 20, iat=  -1, 341, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   23 MET  HN            0 AMB  20-1:831    5.50    (#    831:20  Single Ambig)
 &rst
  ixpk= 831, nxpk= 20, iat= 339,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 343, 344, 343, 344,
 &end
#
#   22 VAL  MGX           0 AMB  20-1:832    5.50    (#    832:20  Single Ambig)
 &rst
  ixpk= 832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2455,2456, 343, 344, 343, 344,
 &end
#
#   24 TRP  HN           23 MET  ME          5.50    (#    833:20  Unique         3.23, 5.29 A)
 &rst
  ixpk= 833, nxpk= 20, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:834     23 MET  ME          5.50    (#    834:20  Single Ambig)
 &rst
  ixpk= 834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 339,1838,
 igr2= 350, 351, 352,
 &end
#
#   58 VAL  HN           23 MET  ME          5.50    (#    836:20  Unique         3.60, 5.15 A)
 &rst
  ixpk= 836, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 350, 351, 352,
 &end
#
#  126 TRP  HH2          23 MET  ME          5.50    (#    837:20  Unique         2.37, 5.10 A)
 &rst
  ixpk= 837, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 350, 351, 352,
 &end
#
#   23 MET  HA           23 MET  ME          5.50    (#    839:20  Unique         3.18, 4.76 A)
 &rst
  ixpk= 839, nxpk= 20, iat= 341,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 350, 351, 352,
 &end
#
#   58 VAL  HB           23 MET  ME          5.50    (#    840:20  Unique         1.98, 4.60 A)
 &rst
  ixpk= 840, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:841     23 MET  ME          5.50    (#    841:20  Single Ambig)
 &rst
  ixpk= 841, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 343, 344, 343, 344,
 igr2= 350, 351, 352,
 &end
#
#  113 MET  HG-          23 MET  ME          5.50    (#    843:20  Unique         3.10, 5.79 A)
 &rst
  ixpk= 843, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1845,1846,
 igr2= 350, 351, 352,
 &end
#
#  113 MET  ME           23 MET  ME          4.50    (#    844:20  Unique         1.97, 4.54 A)
 &rst
  ixpk= 844, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1849,1850,1851,
 igr2= 350, 351, 352,
 &end
#
#   15 ILE  HG1-         23 MET  ME          4.50    (#    845:20  Unique         1.95, 4.96 A)
 &rst
  ixpk= 845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 224, 225,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:846     23 MET  ME          4.50    (#    846:20  Single Ambig)
 &rst
  ixpk= 846, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 220, 221, 222,1724,1725,1726,1728,1729,1730,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:847     23 MET  ME          2.80    (#    847:20  Single Ambig)
 &rst
  ixpk= 847, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2= 350, 351, 352,
 &end
#
#    0 AMB  20-2:848     23 MET  ME          4.50    (#    848:20  Single Ambig)
 &rst
  ixpk= 848, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 350, 351, 352,
 &end
#
#   25 ALA  MB           23 MET  ME          4.50    (#    849:20  Unique         1.98, 4.71 A)
 &rst
  ixpk= 849, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 384, 385, 386,
 igr2= 350, 351, 352,
 &end
#
#  111 ILE  QG2          23 MET  ME          4.50    (#    850:20  Unique         3.36, 6.62 A)
 &rst
  ixpk= 850, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1811,1812,1813,
 igr2= 350, 351, 352,
 &end
#
#  111 ILE  QD1          23 MET  ME          3.50    (#    851:20  Unique         3.48, 6.14 A)
 &rst
  ixpk= 851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1818,1819,1820,
 igr2= 350, 351, 352,
 &end
#
#   24 TRP  HB-          24 TRP  HA          5.50    (#    852:20  Unique         2.66, 2.84 A)
 &rst
  ixpk= 852, nxpk= 20, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   24 TRP  HB+          24 TRP  HA          5.50    (#    853:20  Unique         2.66, 2.84 A)
 &rst
  ixpk= 853, nxpk= 20, iat=  -1, 358, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   25 ALA  HN           24 TRP  HA          5.50    (#    855:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 855, nxpk= 20, iat= 380, 358, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HN           24 TRP  HA          5.50    (#    856:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 856, nxpk= 20, iat= 356, 358, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HN           24 TRP  HB+         5.50    (#    857:20  Unique         2.33, 2.82 A)
 &rst
  ixpk= 857, nxpk= 20, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#   24 TRP  HN           24 TRP  HB-         5.50    (#    858:20  Unique         2.33, 2.82 A)
 &rst
  ixpk= 858, nxpk= 20, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#   24 TRP  HD1          24 TRP  HB+         5.50    (#    859:20  Unique         2.55, 3.02 A)
 &rst
  ixpk= 859, nxpk= 20, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#   24 TRP  HD1          24 TRP  HB-         5.50    (#    860:20  Unique         2.55, 3.02 A)
 &rst
  ixpk= 860, nxpk= 20, iat= 364,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#   24 TRP  HA           24 TRP  HB-         5.50    (#    861:20  Unique         2.66, 2.84 A)
 &rst
  ixpk= 861, nxpk= 20, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#   24 TRP  HA           24 TRP  HB+         5.50    (#    862:20  Unique         2.66, 2.84 A)
 &rst
  ixpk= 862, nxpk= 20, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 360, 361,
 &end
#
#  127 VAL  MGX          24 TRP  HB+         5.50    (#    864:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2= 360, 361,
 &end
#
#  127 VAL  MGY          24 TRP  HB+         5.50    (#    865:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2= 360, 361,
 &end
#
#  127 VAL  MGY          24 TRP  HB-         5.50    (#    866:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2= 360, 361,
 &end
#
#  127 VAL  MGX          24 TRP  HB-         5.50    (#    867:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2= 360, 361,
 &end
#
#   25 ALA  MB           25 ALA  HA          5.50    (#    868:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 868, nxpk= 20, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#   40 ILE  QG2          41 ASN  HA          5.50    (#    869:20  Unique         3.95, 4.98 A)
 &rst
  ixpk= 869, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#  113 MET  ME           25 ALA  HA          5.50    (#    870:20  Unique         2.69, 4.49 A)
 &rst
  ixpk= 870, nxpk= 20, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1849,1850,1851,
 &end
#
#    0 AMB  20-2:871     41 ASN  HA          5.50    (#    871:20  Single Ambig)
 &rst
  ixpk= 871, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 653, 654,  15,  16,  17,
 &end
#
#    0 AMB  20-2:872     41 ASN  HA          5.50    (#    872:20  Single Ambig)
 &rst
  ixpk= 872, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 674, 675, 674, 675, 653, 654, 677, 678,   8,   9,
         8,   9,
 &end
#
#   41 ASN  HB-          41 ASN  HA          5.50    (#    873:20  Unique         2.41, 2.84 A)
 &rst
  ixpk= 873, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 639, 640,
 &end
#
#   41 ASN  HB+          41 ASN  HA          5.50    (#    874:20  Unique         2.41, 2.84 A)
 &rst
  ixpk= 874, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 639, 640,
 &end
#
#    0 AMB  20-2:875      0 AMB  20-1:875    5.50    (#    875:20  Double Ambig)
 &rst
  ixpk= 875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 360, 361, 796, 797,
 igr2= 382, 637,
 &end
#
#   42 PRO  HD-          41 ASN  HA          5.50    (#    876:20  Unique         2.23, 2.41 A)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   42 PRO  HD+          41 ASN  HA          4.50    (#    877:20  Unique         2.23, 2.41 A)
 &rst
  ixpk= 877, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 650, 651,
 &end
#
#  124 TRP  HA           25 ALA  HA          5.50    (#    878:20  Unique         4.60, 4.97 A)
 &rst
  ixpk= 878, nxpk= 20, iat=1992, 382, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 ASN  HD2-         41 ASN  HA          5.50    (#    879:20  Unique         1.95, 3.67 A)
 &rst
  ixpk= 879, nxpk= 20, iat=  -1, 637, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 644, 645,
 &end
#
#   33 TRP  HH2          25 ALA  HA          5.50    (#    880:20  Unique         3.77, 4.35 A)
 &rst
  ixpk= 880, nxpk= 20, iat= 525, 382, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:881     25 ALA  HA          5.50    (#    881:20  Single Ambig)
 &rst
  ixpk= 881, nxpk= 20, iat=  -1, 382, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 390, 380,
 &end
#
#  124 TRP  HN           25 ALA  HA          5.50    (#    882:20  Unique         2.76, 3.18 A)
 &rst
  ixpk= 882, nxpk= 20, iat=1990, 382, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 ASN  HN           41 ASN  HA          5.50    (#    883:20  Unique         2.76, 2.88 A)
 &rst
  ixpk= 883, nxpk= 20, iat= 635, 637, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:884     25 ALA  MB          5.50    (#    884:20  Single Ambig)
 &rst
  ixpk= 884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2= 384, 385, 386,
 &end
#
#   26 ARG  HG+          25 ALA  MB          5.50    (#    885:20  Unique         4.81, 7.51 A)
 &rst
  ixpk= 885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 397, 398,
 igr2= 384, 385, 386,
 &end
#
#   23 MET  ME           25 ALA  MB          5.50    (#    886:20  Unique         1.98, 4.71 A)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 350, 351, 352,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:887     25 ALA  MB          3.50    (#    887:20  Single Ambig)
 &rst
  ixpk= 887, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1849,1850,1851,1842,1843,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:888     25 ALA  MB          5.50    (#    888:20  Single Ambig)
 &rst
  ixpk= 888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1994,1995,1975,1976,
 igr2= 384, 385, 386,
 &end
#
#  121 PHE  HB-          25 ALA  MB          5.50    (#    889:20  Unique         1.98, 3.31 A)
 &rst
  ixpk= 889, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1955,1956,
 igr2= 384, 385, 386,
 &end
#
#  121 PHE  HB+          25 ALA  MB          5.50    (#    890:20  Unique         1.98, 3.31 A)
 &rst
  ixpk= 890, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1955,1956,
 igr2= 384, 385, 386,
 &end
#
#   25 ALA  HA           25 ALA  MB          4.50    (#    891:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 891, nxpk= 20, iat= 382,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 384, 385, 386,
 &end
#
#   24 TRP  HA           25 ALA  MB          5.50    (#    892:20  Unique         4.32, 4.98 A)
 &rst
  ixpk= 892, nxpk= 20, iat= 358,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 384, 385, 386,
 &end
#
#  124 TRP  HA           25 ALA  MB          5.50    (#    893:20  Unique         4.79, 6.15 A)
 &rst
  ixpk= 893, nxpk= 20, iat=1992,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:895     25 ALA  MB          4.50    (#    895:20  Single Ambig)
 &rst
  ixpk= 895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=2053, 446, 454,
 igr2= 384, 385, 386,
 &end
#
#  123 GLY  HN           25 ALA  MB          5.50    (#    896:20  Unique         1.92, 3.54 A)
 &rst
  ixpk= 896, nxpk= 20, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:897     25 ALA  MB          3.50    (#    897:20  Single Ambig)
 &rst
  ixpk= 897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 380, 390,
 igr2= 384, 385, 386,
 &end
#
#  122 ASP  HN           25 ALA  MB          5.50    (#    898:20  Unique         2.85, 4.93 A)
 &rst
  ixpk= 898, nxpk= 20, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 384, 385, 386,
 &end
#
#  125 ARG  HN           25 ALA  MB          5.50    (#    899:20  Unique         3.86, 6.04 A)
 &rst
  ixpk= 899, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 384, 385, 386,
 &end
#
#   27 ARG  HN           26 ARG  HA          5.50    (#    901:20  Unique         2.14, 2.20 A)
 &rst
  ixpk= 901, nxpk= 20, iat= 414, 392, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HN           26 ARG  HA          5.50    (#    902:20  Unique         2.81, 2.85 A)
 &rst
  ixpk= 902, nxpk= 20, iat= 390, 392, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HA           26 ARG  HA          5.50    (#    903:20  Unique         1.95, 2.67 A)
 &rst
  ixpk= 903, nxpk= 20, iat= 512, 392, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HG+          26 ARG  HA          5.50    (#    906:20  Unique         2.19, 3.17 A)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1, 392, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   26 ARG  HG-          26 ARG  HA          5.50    (#    908:20  Unique         2.19, 3.17 A)
 &rst
  ixpk= 908, nxpk= 20, iat=  -1, 392, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   26 ARG  HG-           0 AMB  20-1:910    5.50    (#    910:20  Single Ambig)
 &rst
  ixpk= 910, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 397, 398,
 igr2= 394, 395, 394, 395,
 &end
#
#   26 ARG  HA            0 AMB  20-1:912    5.50    (#    912:20  Single Ambig)
 &rst
  ixpk= 912, nxpk= 20, iat= 392,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 394, 395, 394, 395,
 &end
#
#  123 GLY  HN            0 AMB  20-1:913    5.50    (#    913:20  Single Ambig)
 &rst
  ixpk= 913, nxpk= 20, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 394, 395, 394, 395,
 &end
#
#   26 ARG  HE            0 AMB  20-1:915    5.50    (#    915:20  Single Ambig)
 &rst
  ixpk= 915, nxpk= 20, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 394, 395, 394, 395,
 &end
#
#   27 ARG  HN            0 AMB  20-1:916    5.50    (#    916:20  Single Ambig)
 &rst
  ixpk= 916, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 394, 395, 394, 395,
 &end
#
#   27 ARG  HN           26 ARG  HG+         5.50    (#    917:20  Unique         2.21, 3.27 A)
 &rst
  ixpk= 917, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 397, 398,
 &end
#
#   26 ARG  HE           26 ARG  HG+         5.50    (#    918:20  Unique         2.15, 3.09 A)
 &rst
  ixpk= 918, nxpk= 20, iat= 403,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 397, 398,
 &end
#
#    0 AMB  20-2:920      0 AMB  20-1:920    5.50    (#    920:20  Double Ambig)
 &rst
  ixpk= 920, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 482,2258,
 igr2= 400, 401, 400, 401,2321,2322,
 &end
#
#    0 AMB  20-2:922      0 AMB  20-1:922    5.50    (#    922:20  Double Ambig)
 &rst
  ixpk= 922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2337,1736,
 igr2=2321,2322, 268, 269, 268, 269,
 &end
#
#  134 ARG  HA            0 AMB  20-1:923    5.50    (#    923:20  Single Ambig)
 &rst
  ixpk= 923, nxpk= 20, iat=2187,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2195,2196,2195,2196,2321,2322,
 &end
#
#    0 AMB  20-2:924      0 AMB  20-1:924    5.50    (#    924:20  Double Ambig)
 &rst
  ixpk= 924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2260,1985,1986,
 igr2=2321,2322, 400, 401, 400, 401,
 &end
#
#    0 AMB  20-2:925      0 AMB  20-1:925    3.50    (#    925:20  Double Ambig)
 &rst
  ixpk= 925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1068,1069,1070,1072,1073,1074,1740,1741,1742,1744,
      1745,1746,
 igr2=1026,1027,1026,1027,1026,1027,
 &end
#
#    0 AMB  20-2:926      0 AMB  20-1:926    4.50    (#    926:20  Double Ambig)
 &rst
  ixpk= 926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1=1053,1054,1055,1740,1741,1742,1744,1745,1746,
 igr2=1026,1027,1026,1027,1026,1027, 268, 269, 268, 269,
      
 &end
#
#   26 ARG  HG-           0 AMB  20-1:927    5.50    (#    927:20  Single Ambig)
 &rst
  ixpk= 927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 397, 398,
 igr2= 400, 401, 400, 401,
 &end
#
#    0 AMB  20-2:928      0 AMB  20-1:928    3.50    (#    928:20  Double Ambig)
 &rst
  ixpk= 928, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2315,2316,2189,2190,2189,2190,
 igr2=2321,2322,2195,2196,2195,2196,
 &end
#
#    0 AMB  20-2:929     27 ARG  HA          5.50    (#    929:20  Single Ambig)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 418, 419,1940,1941,
 &end
#
#   27 ARG  HD-          27 ARG  HA          5.50    (#    930:20  Unique         2.08, 3.20 A)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#   27 ARG  HD+          27 ARG  HA          5.50    (#    931:20  Unique         2.08, 3.20 A)
 &rst
  ixpk= 931, nxpk= 20, iat=  -1, 416, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#  121 PHE  HA           27 ARG  HA          5.50    (#    932:20  Unique         1.86, 2.16 A)
 &rst
  ixpk= 932, nxpk= 20, iat=1953, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HN           27 ARG  HA          5.50    (#    934:20  Unique         2.74, 2.81 A)
 &rst
  ixpk= 934, nxpk= 20, iat= 414, 416, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HN           27 ARG  HB-         5.50    (#    935:20  Unique         2.07, 2.62 A)
 &rst
  ixpk= 935, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#   27 ARG  HN           27 ARG  HB+         5.50    (#    936:20  Unique         2.07, 2.62 A)
 &rst
  ixpk= 936, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#   31 HIS  HN           27 ARG  HB-         5.50    (#    937:20  Unique         1.92, 3.97 A)
 &rst
  ixpk= 937, nxpk= 20, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#   30 GLN  HN           27 ARG  HB-         5.50    (#    938:20  Unique         1.92, 3.91 A)
 &rst
  ixpk= 938, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#    0 AMB  20-2:939      0 AMB  20-1:939    5.50    (#    939:20  Double Ambig)
 &rst
  ixpk= 939, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1226,1235, 446, 454,
 igr2=2299,2300, 418, 419,
 &end
#
#   28 PHE  HD            0 AMB  20-1:940    5.50    (#    940:20  Single Ambig)
 &rst
  ixpk= 940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 446, 454,
 igr2= 418, 419,1940,1941,
 &end
#
#   27 ARG  HA           27 ARG  HB-         5.50    (#    941:20  Unique         2.27, 2.80 A)
 &rst
  ixpk= 941, nxpk= 20, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#   27 ARG  HA           27 ARG  HB+         5.50    (#    942:20  Unique         2.27, 2.80 A)
 &rst
  ixpk= 942, nxpk= 20, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 418, 419,
 &end
#
#    0 AMB  20-2:943     27 ARG  HB-         5.50    (#    943:20  Single Ambig)
 &rst
  ixpk= 943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 503, 504, 503, 504, 460, 461,
 igr2= 418, 419,
 &end
#
#    0 AMB  20-2:944      0 AMB  20-1:944    5.50    (#    944:20  Double Ambig)
 &rst
  ixpk= 944, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2260, 503, 504, 460, 461,
 igr2=2315,2316, 418, 419, 418, 419,
 &end
#
#   27 ARG  HD+          27 ARG  HB-         5.50    (#    945:20  Unique         1.96, 3.26 A)
 &rst
  ixpk= 945, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2= 418, 419,
 &end
#
#    0 AMB  20-2:947      0 AMB  20-1:947    4.50    (#    947:20  Double Ambig)
 &rst
  ixpk= 947, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 424, 425, 424, 425,
 igr2= 418, 419,1940,1941,
 &end
#
#    0 AMB  20-2:948      0 AMB  20-1:948    5.50    (#    948:20  Double Ambig)
 &rst
  ixpk= 948, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 472, 473, 472, 473,
 igr2= 418, 419, 418, 419,
 &end
#
#   95 GLN  HG-         140 LYS  HD+         5.50    (#    949:20  Unique         4.31, 7.22 A)
 &rst
  ixpk= 949, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545,1546,
 igr2=2299,2300,
 &end
#
#   27 ARG  HN           27 ARG  HG-         5.50    (#    950:20  Unique         3.37, 4.26 A)
 &rst
  ixpk= 950, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 421, 422,
 &end
#
#   27 ARG  HN           27 ARG  HG+         5.50    (#    951:20  Unique         3.37, 4.26 A)
 &rst
  ixpk= 951, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 421, 422,
 &end
#
#   28 PHE  HD           27 ARG  HG-         5.50    (#    952:20  Unique         2.74, 6.42 A)
 &rst
  ixpk= 952, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2= 421, 422,
 &end
#
#   27 ARG  HA           27 ARG  HG-         5.50    (#    954:20  Unique         2.04, 3.01 A)
 &rst
  ixpk= 954, nxpk= 20, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 421, 422,
 &end
#
#   27 ARG  HD+          27 ARG  HG-         5.50    (#    955:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2= 421, 422,
 &end
#
#   27 ARG  HG-          27 ARG  HD+         5.50    (#    958:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 421, 422,
 igr2= 424, 425,
 &end
#
#   27 ARG  HA           27 ARG  HD+         5.50    (#    961:20  Unique         2.08, 3.20 A)
 &rst
  ixpk= 961, nxpk= 20, iat= 416,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 424, 425,
 &end
#
#   28 PHE  HD           27 ARG  HD+         5.50    (#    963:20  Unique         2.77, 6.00 A)
 &rst
  ixpk= 963, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2= 424, 425,
 &end
#
#   27 ARG  HN           27 ARG  HD-         5.50    (#    966:20  Unique         2.84, 4.77 A)
 &rst
  ixpk= 966, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 424, 425,
 &end
#
#   28 PHE  HB-          28 PHE  HA          5.50    (#    967:20  Unique         2.24, 2.55 A)
 &rst
  ixpk= 967, nxpk= 20, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#   28 PHE  HB+          28 PHE  HA          5.50    (#    968:20  Unique         2.24, 2.55 A)
 &rst
  ixpk= 968, nxpk= 20, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#  122 ASP  HB+          28 PHE  HA          5.50    (#    969:20  Unique         2.26, 3.73 A)
 &rst
  ixpk= 969, nxpk= 20, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#    0 AMB  20-2:970      0 AMB  20-1:970    5.50    (#    970:20  Double Ambig)
 &rst
  ixpk= 970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 460, 461,1923,1924,
 igr2= 440, 861,
 &end
#
#    0 AMB  20-2:971      0 AMB  20-1:971    5.50    (#    971:20  Double Ambig)
 &rst
  ixpk= 971, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 446, 454, 847, 855,
 igr2= 440, 861,
 &end
#
#   30 GLN  HN           28 PHE  HA          5.50    (#    973:20  Unique         3.23, 4.21 A)
 &rst
  ixpk= 973, nxpk= 20, iat= 465, 440, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HN           28 PHE  HA          5.50    (#    974:20  Unique         2.27, 2.77 A)
 &rst
  ixpk= 974, nxpk= 20, iat= 438, 440, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:975     28 PHE  HA          4.50    (#    975:20  Single Ambig)
 &rst
  ixpk= 975, nxpk= 20, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 458, 482,
 &end
#
#   28 PHE  HA           28 PHE  HB+         5.50    (#    976:20  Unique         2.24, 2.55 A)
 &rst
  ixpk= 976, nxpk= 20, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 442, 443,
 &end
#
#   28 PHE  HA           28 PHE  HB-         5.50    (#    977:20  Unique         2.24, 2.55 A)
 &rst
  ixpk= 977, nxpk= 20, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 442, 443,
 &end
#
#   28 PHE  HD           28 PHE  HB-         5.50    (#    978:20  Unique         2.29, 3.04 A)
 &rst
  ixpk= 978, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2= 442, 443,
 &end
#
#   28 PHE  HD           28 PHE  HB+         5.50    (#    979:20  Unique         2.29, 3.04 A)
 &rst
  ixpk= 979, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2= 442, 443,
 &end
#
#   28 PHE  HN           28 PHE  HB+         5.50    (#    980:20  Unique         2.07, 2.96 A)
 &rst
  ixpk= 980, nxpk= 20, iat= 438,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 442, 443,
 &end
#
#   28 PHE  HN           28 PHE  HB-         5.50    (#    981:20  Unique         2.07, 2.96 A)
 &rst
  ixpk= 981, nxpk= 20, iat= 438,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 442, 443,
 &end
#
#   28 PHE  HD           29 GLY  HA+         5.50    (#    982:20  Unique         2.87, 5.27 A)
 &rst
  ixpk= 982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2= 460, 461,
 &end
#
#   30 GLN  HN           29 GLY  HA+         5.50    (#    984:20  Unique         2.44, 3.18 A)
 &rst
  ixpk= 984, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 460, 461,
 &end
#
#   30 GLN  HN           29 GLY  HA-         5.50    (#    985:20  Unique         2.44, 3.18 A)
 &rst
  ixpk= 985, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 460, 461,
 &end
#
#   29 GLY  HN           29 GLY  HA-         4.50    (#    986:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 986, nxpk= 20, iat= 458,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 460, 461,
 &end
#
#   29 GLY  HN           29 GLY  HA+         3.50    (#    987:20  Unique         2.30, 2.66 A)
 &rst
  ixpk= 987, nxpk= 20, iat= 458,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 460, 461,
 &end
#
#    0 AMB  20-2:988     30 GLN  HA          5.50    (#    988:20  Single Ambig)
 &rst
  ixpk= 988, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 482, 458,
 &end
#
#   30 GLN  HN           30 GLN  HA          5.50    (#    989:20  Unique         2.70, 2.87 A)
 &rst
  ixpk= 989, nxpk= 20, iat= 465, 467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HN           30 GLN  HA          5.50    (#    990:20  Unique         4.11, 4.72 A)
 &rst
  ixpk= 990, nxpk= 20, iat= 499, 467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 GLN  HE2+         30 GLN  HA          5.50    (#    991:20  Unique         4.27, 5.44 A)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 477, 478,
 &end
#
#    0 AMB  20-2:992     30 GLN  HA          5.50    (#    992:20  Single Ambig)
 &rst
  ixpk= 992, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 460, 461, 503, 504, 503, 504,
 &end
#
#    0 AMB  20-2:993     30 GLN  HA          5.50    (#    993:20  Single Ambig)
 &rst
  ixpk= 993, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 486, 487, 460, 461,
 &end
#
#    0 AMB  20-2:994     30 GLN  HA          3.50    (#    994:20  Single Ambig)
 &rst
  ixpk= 994, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 472, 473, 472, 473,
 &end
#
#   30 GLN  HB-          30 GLN  HA          4.50    (#    995:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 995, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 469, 470,
 &end
#
#   27 ARG  HB-          30 GLN  HA          5.50    (#    996:20  Unique         3.98, 5.33 A)
 &rst
  ixpk= 996, nxpk= 20, iat=  -1, 467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 418, 419,
 &end
#
#    0 AMB  20-2:997      0 AMB  20-1:997    5.50    (#    997:20  Double Ambig)
 &rst
  ixpk= 997, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 482, 458,
 igr2= 469, 470, 469, 470,
 &end
#
#    0 AMB  20-2:998     30 GLN  HB-         5.50    (#    998:20  Single Ambig)
 &rst
  ixpk= 998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 482, 458,
 igr2= 469, 470,
 &end
#
#   30 GLN  HN           30 GLN  HB+         5.50    (#    999:20  Unique         2.14, 2.77 A)
 &rst
  ixpk= 999, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 470,
 &end
#
#   30 GLN  HN           30 GLN  HB-         5.50    (#   1000:20  Unique         2.14, 2.77 A)
 &rst
  ixpk= 1000, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 470,
 &end
#
#   32 SER  HN           30 GLN  HB+         5.50    (#   1001:20  Unique         2.14, 3.82 A)
 &rst
  ixpk= 1001, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 470,
 &end
#
#   32 SER  HN           30 GLN  HB-         5.50    (#   1002:20  Unique         2.14, 3.82 A)
 &rst
  ixpk= 1002, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 470,
 &end
#
#   30 GLN  HA           30 GLN  HB-         5.50    (#   1003:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 1003, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 469, 470,
 &end
#
#   30 GLN  HA           30 GLN  HB+         4.50    (#   1004:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 1004, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 469, 470,
 &end
#
#    0 AMB  20-2:1007     0 AMB  20-1:1007   5.50    (#   1007:20  Double Ambig)
 &rst
  ixpk= 1007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 482, 458,
 igr2= 472, 473, 472, 473,
 &end
#
#   30 GLN  HN            0 AMB  20-1:1008   4.50    (#   1008:20  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 20, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:1009     0 AMB  20-1:1009   4.50    (#   1009:20  Double Ambig)
 &rst
  ixpk= 1009, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 477, 478, 477, 478,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:1010     0 AMB  20-1:1010   5.50    (#   1010:20  Double Ambig)
 &rst
  ixpk= 1010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 889,2279,2283,
 igr2= 893,1545,1546,
 &end
#
#   77 TYR  HD           95 GLN  HG-         5.50    (#   1011:20  Unique         3.48, 6.25 A)
 &rst
  ixpk= 1011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1226,1235,
 igr2=1545,1546,
 &end
#
#   32 SER  HN            0 AMB  20-1:1012   5.50    (#   1012:20  Single Ambig)
 &rst
  ixpk= 1012, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 472, 473, 472, 473,
 &end
#
#   30 GLN  HE2-          0 AMB  20-1:1013   5.50    (#   1013:20  Single Ambig)
 &rst
  ixpk= 1013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 477, 478,
 igr2= 472, 473, 472, 473,
 &end
#
#   30 GLN  HA            0 AMB  20-1:1014   3.50    (#   1014:20  Single Ambig)
 &rst
  ixpk= 1014, nxpk= 20, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:1015     0 AMB  20-1:1015   5.50    (#   1015:20  Double Ambig)
 &rst
  ixpk= 1015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 503, 504, 503, 504,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:1016     0 AMB  20-1:1016   3.50    (#   1016:20  Double Ambig)
 &rst
  ixpk= 1016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 418, 419, 418, 419, 469, 470,
 igr2= 472, 473, 472, 473, 472, 473,
 &end
#
#   27 ARG  HG-           0 AMB  20-1:1018   5.50    (#   1018:20  Single Ambig)
 &rst
  ixpk= 1018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 421, 422,
 igr2= 472, 473, 472, 473,
 &end
#
#    0 AMB  20-2:1019    58 VAL  HB          2.80    (#   1019:20  Single Ambig)
 &rst
  ixpk= 1019, nxpk= 20, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#    0 AMB  20-2:1020    58 VAL  HB          5.50    (#   1020:20  Single Ambig)
 &rst
  ixpk= 1020, nxpk= 20, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  111 ILE  QG2          58 VAL  HB          5.50    (#   1022:20  Unique         2.06, 4.70 A)
 &rst
  ixpk= 1022, nxpk= 20, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#   26 ARG  HG-          31 HIS  HA          5.50    (#   1023:20  Unique         1.99, 2.96 A)
 &rst
  ixpk= 1023, nxpk= 20, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   31 HIS  HB-          31 HIS  HA          5.50    (#   1024:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1024, nxpk= 20, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#   31 HIS  HB+          31 HIS  HA          5.50    (#   1025:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1025, nxpk= 20, iat=  -1, 484, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#   32 SER  HN           31 HIS  HA          5.50    (#   1026:20  Unique         2.47, 2.83 A)
 &rst
  ixpk= 1026, nxpk= 20, iat= 499, 484, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HD2          31 HIS  HA          5.50    (#   1027:20  Unique         2.40, 2.82 A)
 &rst
  ixpk= 1027, nxpk= 20, iat= 495, 484, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HN           31 HIS  HA          5.50    (#   1028:20  Unique         2.27, 2.28 A)
 &rst
  ixpk= 1028, nxpk= 20, iat= 482, 484, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HN           31 HIS  HB+         5.50    (#   1029:20  Unique         3.22, 3.79 A)
 &rst
  ixpk= 1029, nxpk= 20, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   31 HIS  HN           31 HIS  HB-         5.50    (#   1030:20  Unique         3.22, 3.79 A)
 &rst
  ixpk= 1030, nxpk= 20, iat= 482,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   31 HIS  HD2          31 HIS  HB-         5.50    (#   1032:20  Unique         2.98, 3.61 A)
 &rst
  ixpk= 1032, nxpk= 20, iat= 495,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   32 SER  HN           31 HIS  HB+         5.50    (#   1033:20  Unique         3.88, 4.29 A)
 &rst
  ixpk= 1033, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   32 SER  HN           31 HIS  HB-         5.50    (#   1034:20  Unique         3.88, 4.29 A)
 &rst
  ixpk= 1034, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   31 HIS  HA           31 HIS  HB+         5.50    (#   1035:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1035, nxpk= 20, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   31 HIS  HA           31 HIS  HB-         5.50    (#   1036:20  Unique         2.38, 2.75 A)
 &rst
  ixpk= 1036, nxpk= 20, iat= 484,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 486, 487,
 &end
#
#   33 TRP  HN            0 AMB  20-1:1039   4.50    (#   1039:20  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 503, 504, 503, 504,
 &end
#
#   27 ARG  HN            0 AMB  20-1:1040   5.50    (#   1040:20  Single Ambig)
 &rst
  ixpk= 1040, nxpk= 20, iat= 414,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 503, 504, 503, 504,
 &end
#
#   32 SER  HN            0 AMB  20-1:1041   5.50    (#   1041:20  Single Ambig)
 &rst
  ixpk= 1041, nxpk= 20, iat= 499,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 503, 504, 503, 504,
 &end
#
#   32 SER  HA            0 AMB  20-1:1042   4.50    (#   1042:20  Single Ambig)
 &rst
  ixpk= 1042, nxpk= 20, iat= 501,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 503, 504, 503, 504,
 &end
#
#    0 AMB  20-2:1044    32 SER  HB-         5.50    (#   1044:20  Single Ambig)
 &rst
  ixpk= 1044, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 472, 473, 472, 473,
 igr2= 503, 504,
 &end
#
#   30 GLN  HB-           0 AMB  20-1:1045   5.50    (#   1045:20  Single Ambig)
 &rst
  ixpk= 1045, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 469, 470,
 igr2= 503, 504, 503, 504,
 &end
#
#   27 ARG  HN           33 TRP  HA          5.50    (#   1047:20  Unique         2.80, 3.29 A)
 &rst
  ixpk= 1047, nxpk= 20, iat= 414, 512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HN           33 TRP  HA          5.50    (#   1048:20  Unique         2.87, 2.89 A)
 &rst
  ixpk= 1048, nxpk= 20, iat= 510, 512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HD1          33 TRP  HA          5.50    (#   1050:20  Unique         3.01, 4.17 A)
 &rst
  ixpk= 1050, nxpk= 20, iat= 518, 512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HA           33 TRP  HA          5.50    (#   1051:20  Unique         1.95, 2.67 A)
 &rst
  ixpk= 1051, nxpk= 20, iat= 392, 512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HB+          33 TRP  HA          5.50    (#   1052:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 1052, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#   33 TRP  HB-          33 TRP  HA          5.50    (#   1053:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 1053, nxpk= 20, iat=  -1, 512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#   33 TRP  HA           33 TRP  HB-         5.50    (#   1054:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 1054, nxpk= 20, iat= 512,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   30 GLN  HE2-         33 TRP  HB-         5.50    (#   1055:20  Unique         5.98, 6.93 A)
 &rst
  ixpk= 1055, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 477, 478,
 igr2= 514, 515,
 &end
#
#   30 GLN  HE2-         33 TRP  HB+         5.50    (#   1056:20  Unique         5.98, 6.93 A)
 &rst
  ixpk= 1056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 477, 478,
 igr2= 514, 515,
 &end
#
#   33 TRP  HD1          33 TRP  HB+         5.50    (#   1057:20  Unique         2.56, 3.28 A)
 &rst
  ixpk= 1057, nxpk= 20, iat= 518,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   33 TRP  HN           33 TRP  HB+         5.50    (#   1058:20  Unique         2.11, 3.13 A)
 &rst
  ixpk= 1058, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   33 TRP  HN           33 TRP  HB-         5.50    (#   1059:20  Unique         2.11, 3.13 A)
 &rst
  ixpk= 1059, nxpk= 20, iat= 510,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   24 TRP  HE1          33 TRP  HB+         5.50    (#   1062:20  Unique         2.40, 2.99 A)
 &rst
  ixpk= 1062, nxpk= 20, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 514, 515,
 &end
#
#   34 GLN  HN           34 GLN  HA          5.50    (#   1063:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1063, nxpk= 20, iat= 534, 536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 PHE  HN           34 GLN  HA          5.50    (#   1064:20  Unique         2.43, 2.47 A)
 &rst
  ixpk= 1064, nxpk= 20, iat= 551, 536, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1065    34 GLN  HA          5.50    (#   1065:20  Single Ambig)
 &rst
  ixpk= 1065, nxpk= 20, iat=  -1, 536, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 538, 539, 538, 539,
 &end
#
#   57 GLU  HG-          57 GLU  HA          5.50    (#   1066:20  Unique         2.13, 3.03 A)
 &rst
  ixpk= 1066, nxpk= 20, iat=  -1, 876, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   57 GLU  HB+          57 GLU  HA          5.50    (#   1067:20  Unique         2.39, 2.77 A)
 &rst
  ixpk= 1067, nxpk= 20, iat=  -1, 876, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 878, 879,
 &end
#
#   34 GLN  HA           34 GLN  HB-         5.50    (#   1068:20  Unique         2.41, 2.77 A)
 &rst
  ixpk= 1068, nxpk= 20, iat= 536,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 538, 539,
 &end
#
#   34 GLN  HA           34 GLN  HB+         5.50    (#   1069:20  Unique         2.41, 2.77 A)
 &rst
  ixpk= 1069, nxpk= 20, iat= 536,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 538, 539,
 &end
#
#   34 GLN  HN           34 GLN  HB-         5.50    (#   1070:20  Unique         2.35, 2.96 A)
 &rst
  ixpk= 1070, nxpk= 20, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 538, 539,
 &end
#
#   34 GLN  HN           34 GLN  HB+         5.50    (#   1071:20  Unique         2.35, 2.96 A)
 &rst
  ixpk= 1071, nxpk= 20, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 538, 539,
 &end
#
#   87 ASP  HN           87 ASP  HA          4.50    (#   1072:20  Unique         2.85, 2.92 A)
 &rst
  ixpk= 1072, nxpk= 20, iat=1423,1425, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1074    85 ARG  HA          5.50    (#   1074:20  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1403,1404,1361,
 &end
#
#   35 PHE  HB-          35 PHE  HA          5.50    (#   1075:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 1075, nxpk= 20, iat=  -1, 553, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 555, 556,
 &end
#
#   35 PHE  HN           35 PHE  HB+         5.50    (#   1076:20  Unique         2.08, 2.91 A)
 &rst
  ixpk= 1076, nxpk= 20, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 555, 556,
 &end
#
#   35 PHE  HN           35 PHE  HB-         5.50    (#   1077:20  Unique         2.08, 2.91 A)
 &rst
  ixpk= 1077, nxpk= 20, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 555, 556,
 &end
#
#   35 PHE  HA           35 PHE  HB-         5.50    (#   1078:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 1078, nxpk= 20, iat= 553,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 555, 556,
 &end
#
#   35 PHE  HA           35 PHE  HB+         5.50    (#   1079:20  Unique         2.35, 2.59 A)
 &rst
  ixpk= 1079, nxpk= 20, iat= 553,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 555, 556,
 &end
#
#    0 AMB  20-2:1082    36 PRO  HA          5.50    (#   1082:20  Single Ambig)
 &rst
  ixpk= 1082, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 589, 590, 878, 879,
 &end
#
#   36 PRO  HB+          36 PRO  HA          5.50    (#   1083:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1083, nxpk= 20, iat=  -1, 581, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 578, 579,
 &end
#
#   37 GLN  HN           36 PRO  HA          5.50    (#   1086:20  Unique         3.37, 3.51 A)
 &rst
  ixpk= 1086, nxpk= 20, iat= 585, 581, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 GLN  HN           36 PRO  HB+         5.50    (#   1087:20  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1087, nxpk= 20, iat= 585,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 578, 579,
 &end
#
#   37 GLN  HN           36 PRO  HB-         5.50    (#   1088:20  Unique         1.89, 2.92 A)
 &rst
  ixpk= 1088, nxpk= 20, iat= 585,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 578, 579,
 &end
#
#    0 AMB  20-2:1090     0 AMB  20-1:1090   5.50    (#   1090:20  Double Ambig)
 &rst
  ixpk= 1090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 847, 855, 773, 782,
 igr2= 970, 971, 970, 971,
 &end
#
#   36 PRO  HA           36 PRO  HB+         5.50    (#   1091:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1091, nxpk= 20, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 578, 579,
 &end
#
#   36 PRO  HA           36 PRO  HB-         5.50    (#   1092:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1092, nxpk= 20, iat= 581,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 578, 579,
 &end
#
#    0 AMB  20-2:1093     0 AMB  20-1:1093   5.50    (#   1093:20  Double Ambig)
 &rst
  ixpk= 1093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 878, 879, 589, 590,
 igr2= 578, 579, 578, 579,
 &end
#
#    0 AMB  20-2:1094     0 AMB  20-1:1094   5.50    (#   1094:20  Double Ambig)
 &rst
  ixpk= 1094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1=1943,1944, 755, 756, 418, 419,2299,2300,
 igr2= 578, 579, 578, 579, 578, 579, 578, 579,
 &end
#
#   63 LYS  HD-          63 LYS  HB+         2.80    (#   1095:20  Unique         2.02, 3.11 A)
 &rst
  ixpk= 1095, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 976, 977,
 igr2= 970, 971,
 &end
#
#    0 AMB  20-2:1096     0 AMB  20-1:1096   5.50    (#   1096:20  Double Ambig)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 189, 190, 814, 815, 816,
 igr2= 578, 579, 578, 579,
 &end
#
#    0 AMB  20-2:1097     0 AMB  20-1:1097   3.50    (#   1097:20  Double Ambig)
 &rst
  ixpk= 1097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 973, 974, 973, 974,
 igr2= 970, 971, 970, 971,
 &end
#
#   13 ILE  HG1+         36 PRO  HB+         5.50    (#   1098:20  Unique         2.79, 4.74 A)
 &rst
  ixpk= 1098, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 189, 190,
 igr2= 578, 579,
 &end
#
#    0 AMB  20-2:1099     0 AMB  20-1:1099   5.50    (#   1099:20  Double Ambig)
 &rst
  ixpk= 1099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901,
 igr2= 578, 579, 578, 579,
 &end
#
#    0 AMB  20-2:1101     0 AMB  20-1:1101   5.50    (#   1101:20  Double Ambig)
 &rst
  ixpk= 1101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,1688,1689,
      1690,1692,1693,1694,
 igr2= 578, 579, 970, 971, 970, 971,
 &end
#
#   41 ASN  HA           42 PRO  HG+         5.50    (#   1102:20  Unique         4.38, 4.55 A)
 &rst
  ixpk= 1102, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 653, 654,
 &end
#
#   42 PRO  HA           42 PRO  HG+         5.50    (#   1103:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 1103, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD+          42 PRO  HG+         5.50    (#   1104:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1104, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD-          42 PRO  HG+         5.50    (#   1105:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   43 GLY  HN           42 PRO  HG+         5.50    (#   1106:20  Unique         4.87, 5.37 A)
 &rst
  ixpk= 1106, nxpk= 20, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 653, 654,
 &end
#
#   41 ASN  HA           42 PRO  HG-         5.50    (#   1107:20  Unique         4.38, 4.55 A)
 &rst
  ixpk= 1107, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 653, 654,
 &end
#
#   42 PRO  HA           42 PRO  HG-         5.50    (#   1108:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 1108, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD+          42 PRO  HG-         5.50    (#   1109:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1109, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   42 PRO  HD-          42 PRO  HG-         5.50    (#   1110:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 653, 654,
 &end
#
#   41 ASN  HB+          42 PRO  HG-         5.50    (#   1111:20  Unique         3.65, 5.14 A)
 &rst
  ixpk= 1111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 653, 654,
 &end
#
#   41 ASN  HB+          42 PRO  HG+         5.50    (#   1112:20  Unique         3.65, 5.14 A)
 &rst
  ixpk= 1112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB+          42 PRO  HG+         4.50    (#   1113:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB+          42 PRO  HG-         5.50    (#   1114:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1114, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB-          42 PRO  HG+         4.50    (#   1115:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#   42 PRO  HB-          42 PRO  HG-         5.50    (#   1116:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1116, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 653, 654,
 &end
#
#    0 AMB  20-2:1118     0 AMB  20-1:1118   5.50    (#   1118:20  Double Ambig)
 &rst
  ixpk= 1118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 793, 794, 742, 743, 744,
 igr2= 650, 651, 650, 651,
 &end
#
#   42 PRO  HB-          42 PRO  HD+         5.50    (#   1119:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB-          42 PRO  HD-         5.50    (#   1120:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   42 PRO  HG-          42 PRO  HD-         5.50    (#   1121:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 653, 654,
 igr2= 650, 651,
 &end
#
#   42 PRO  HG-          42 PRO  HD+         5.50    (#   1122:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 1122, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 653, 654,
 igr2= 650, 651,
 &end
#
#    0 AMB  20-2:1123     0 AMB  20-1:1123   5.50    (#   1123:20  Double Ambig)
 &rst
  ixpk= 1123, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 653, 654,   8,   9,
 igr2= 650, 651, 650, 651,
 &end
#
#    0 AMB  20-2:1124    42 PRO  HD-         4.50    (#   1124:20  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 653, 654,   8,   9,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HD-         5.50    (#   1125:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HD+         5.50    (#   1126:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB-          42 PRO  HD+         5.50    (#   1127:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1127, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB-          42 PRO  HD-         5.50    (#   1128:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB+          42 PRO  HD-         5.50    (#   1129:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   41 ASN  HB+          42 PRO  HD+         5.50    (#   1130:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 650, 651,
 &end
#
#   42 PRO  HA           42 PRO  HD+         5.50    (#   1131:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1131, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 650, 651,
 &end
#
#   42 PRO  HA           42 PRO  HD-         5.50    (#   1132:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1132, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 650, 651,
 &end
#
#   41 ASN  HA           42 PRO  HD+         4.50    (#   1133:20  Unique         2.23, 2.41 A)
 &rst
  ixpk= 1133, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 650, 651,
 &end
#
#   41 ASN  HA           42 PRO  HD-         4.50    (#   1134:20  Unique         2.23, 2.41 A)
 &rst
  ixpk= 1134, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 650, 651,
 &end
#
#   41 ASN  HN           42 PRO  HD+         5.50    (#   1135:20  Unique         4.70, 4.91 A)
 &rst
  ixpk= 1135, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 650, 651,
 &end
#
#   41 ASN  HN           42 PRO  HD-         5.50    (#   1136:20  Unique         4.70, 4.91 A)
 &rst
  ixpk= 1136, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 650, 651,
 &end
#
#   38 GLY  HN           37 GLN  HA          4.50    (#   1137:20  Unique         2.16, 2.27 A)
 &rst
  ixpk= 1137, nxpk= 20, iat= 602, 587, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 GLN  HN           37 GLN  HA          5.50    (#   1138:20  Unique         2.27, 2.30 A)
 &rst
  ixpk= 1138, nxpk= 20, iat= 585, 587, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ILE  HN           37 GLN  HA          5.50    (#   1139:20  Unique         3.88, 4.79 A)
 &rst
  ixpk= 1139, nxpk= 20, iat= 179, 587, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 GLY  HA+          37 GLN  HA          5.50    (#   1140:20  Unique         2.57, 4.10 A)
 &rst
  ixpk= 1140, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#   95 GLN  HG+          37 GLN  HA          5.50    (#   1141:20  Unique         5.21, 7.99 A)
 &rst
  ixpk= 1141, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1546,
 &end
#
#   37 GLN  HB-          37 GLN  HA          5.50    (#   1142:20  Unique         2.24, 2.75 A)
 &rst
  ixpk= 1142, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 589, 590,
 &end
#
#   37 GLN  HB+          37 GLN  HA          5.50    (#   1143:20  Unique         2.24, 2.75 A)
 &rst
  ixpk= 1143, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 589, 590,
 &end
#
#    0 AMB  20-2:1144    37 GLN  HA          5.50    (#   1144:20  Single Ambig)
 &rst
  ixpk= 1144, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 189, 190, 814, 815, 816,
 &end
#
#   12 GLY  HA-          37 GLN  HA          5.50    (#   1145:20  Unique         2.57, 4.10 A)
 &rst
  ixpk= 1145, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#    0 AMB  20-2:1146    37 GLN  HA          5.50    (#   1146:20  Single Ambig)
 &rst
  ixpk= 1146, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 162, 163, 164, 166, 167, 168, 189, 190,
 &end
#
#    0 AMB  20-2:1147    37 GLN  HA          5.50    (#   1147:20  Single Ambig)
 &rst
  ixpk= 1147, nxpk= 20, iat=  -1, 587, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 578, 579,1581,1582,
 &end
#
#   38 GLY  HN           37 GLN  HB-         5.50    (#   1148:20  Unique         2.59, 3.77 A)
 &rst
  ixpk= 1148, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   38 GLY  HN           37 GLN  HB+         5.50    (#   1149:20  Unique         2.59, 3.77 A)
 &rst
  ixpk= 1149, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   37 GLN  HN           37 GLN  HB-         5.50    (#   1150:20  Unique         2.39, 3.49 A)
 &rst
  ixpk= 1150, nxpk= 20, iat= 585,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   37 GLN  HN           37 GLN  HB+         5.50    (#   1151:20  Unique         2.39, 3.49 A)
 &rst
  ixpk= 1151, nxpk= 20, iat= 585,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   37 GLN  HA           37 GLN  HB-         5.50    (#   1154:20  Unique         2.24, 2.75 A)
 &rst
  ixpk= 1154, nxpk= 20, iat= 587,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   37 GLN  HA           37 GLN  HB+         5.50    (#   1155:20  Unique         2.24, 2.75 A)
 &rst
  ixpk= 1155, nxpk= 20, iat= 587,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 589, 590,
 &end
#
#   11 VAL  MGX          38 GLY  HA+         5.50    (#   1158:20  Unique         1.95, 5.75 A)
 &rst
  ixpk= 1158, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 604, 605,
 &end
#
#   11 VAL  MGX          38 GLY  HA-         5.50    (#   1159:20  Unique         1.95, 5.75 A)
 &rst
  ixpk= 1159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 604, 605,
 &end
#
#   53 ALA  MB           38 GLY  HA+         5.50    (#   1160:20  Unique         1.99, 3.00 A)
 &rst
  ixpk= 1160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 814, 815, 816,
 igr2= 604, 605,
 &end
#
#   53 ALA  MB           38 GLY  HA-         5.50    (#   1161:20  Unique         1.99, 3.00 A)
 &rst
  ixpk= 1161, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 814, 815, 816,
 igr2= 604, 605,
 &end
#
#   38 GLY  HN           38 GLY  HA+         5.50    (#   1162:20  Unique         2.36, 2.75 A)
 &rst
  ixpk= 1162, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 604, 605,
 &end
#
#   38 GLY  HN           38 GLY  HA-         5.50    (#   1163:20  Unique         2.36, 2.75 A)
 &rst
  ixpk= 1163, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 604, 605,
 &end
#
#   39 GLY  HN           38 GLY  HA+         4.50    (#   1164:20  Unique         2.29, 3.06 A)
 &rst
  ixpk= 1164, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 604, 605,
 &end
#
#   39 GLY  HN           38 GLY  HA-         4.50    (#   1165:20  Unique         2.29, 3.06 A)
 &rst
  ixpk= 1165, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 604, 605,
 &end
#
#    0 AMB  20-2:1166     0 AMB  20-1:1166   5.50    (#   1166:20  Double Ambig)
 &rst
  ixpk= 1166, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 620,1542,1543,
 igr2= 611, 612, 611, 612,
 &end
#
#    0 AMB  20-2:1167    39 GLY  HA-         5.50    (#   1167:20  Single Ambig)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 620, 742, 743, 744,1542,1543,
 igr2= 611, 612,
 &end
#
#   11 VAL  MGY          39 GLY  HA+         5.50    (#   1168:20  Unique         4.21, 6.38 A)
 &rst
  ixpk= 1168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 611, 612,
 &end
#
#   11 VAL  MGY          39 GLY  HA-         5.50    (#   1169:20  Unique         4.21, 6.38 A)
 &rst
  ixpk= 1169, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 611, 612,
 &end
#
#   10 ASN  HB-          39 GLY  HA+         5.50    (#   1170:20  Unique         2.08, 4.09 A)
 &rst
  ixpk= 1170, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 611, 612,
 &end
#
#   10 ASN  HB-          39 GLY  HA-         5.50    (#   1171:20  Unique         2.08, 4.09 A)
 &rst
  ixpk= 1171, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 611, 612,
 &end
#
#   10 ASN  HA           39 GLY  HA+         5.50    (#   1172:20  Unique         1.96, 2.99 A)
 &rst
  ixpk= 1172, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   10 ASN  HA           39 GLY  HA-         5.50    (#   1173:20  Unique         1.96, 2.99 A)
 &rst
  ixpk= 1173, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   10 ASN  HD2-         39 GLY  HA+         5.50    (#   1174:20  Unique         3.79, 5.85 A)
 &rst
  ixpk= 1174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 611, 612,
 &end
#
#   10 ASN  HD2-         39 GLY  HA-         5.50    (#   1175:20  Unique         3.79, 5.85 A)
 &rst
  ixpk= 1175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 151, 152,
 igr2= 611, 612,
 &end
#
#   40 ILE  HN           39 GLY  HA+         5.50    (#   1176:20  Unique         2.14, 2.77 A)
 &rst
  ixpk= 1176, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   40 ILE  HN           39 GLY  HA-         5.50    (#   1177:20  Unique         2.14, 2.77 A)
 &rst
  ixpk= 1177, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   39 GLY  HN           39 GLY  HA+         5.50    (#   1178:20  Unique         2.30, 2.70 A)
 &rst
  ixpk= 1178, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   39 GLY  HN           39 GLY  HA-         4.50    (#   1179:20  Unique         2.30, 2.70 A)
 &rst
  ixpk= 1179, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 611, 612,
 &end
#
#   11 VAL  HN           39 GLY  HA+         5.50    (#   1180:20  Unique         3.54, 4.55 A)
 &rst
  ixpk= 1180, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#   11 VAL  HN           39 GLY  HA-         5.50    (#   1181:20  Unique         3.54, 4.55 A)
 &rst
  ixpk= 1181, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 611, 612,
 &end
#
#    0 AMB  20-2:1182    40 ILE  HA          4.50    (#   1182:20  Single Ambig)
 &rst
  ixpk= 1182, nxpk= 20, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 622, 623, 624, 162, 163, 164, 166, 167, 168,
 &end
#
#   49 ALA  MB           40 ILE  HA          4.50    (#   1183:20  Unique         1.93, 2.80 A)
 &rst
  ixpk= 1183, nxpk= 20, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 742, 743, 744,
 &end
#
#   41 ASN  HN           40 ILE  HA          4.50    (#   1185:20  Unique         2.14, 2.21 A)
 &rst
  ixpk= 1185, nxpk= 20, iat= 635, 618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 ILE  HG1+         40 ILE  HA          5.50    (#   1186:20  Unique         2.44, 2.80 A)
 &rst
  ixpk= 1186, nxpk= 20, iat=  -1, 618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   40 ILE  HN           40 ILE  HB          5.50    (#   1187:20  Unique         2.32, 2.50 A)
 &rst
  ixpk= 1187, nxpk= 20, iat= 616, 620, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1188    40 ILE  HB          5.50    (#   1188:20  Single Ambig)
 &rst
  ixpk= 1188, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 144, 138,
 &end
#
#   40 ILE  HA           40 ILE  HB          5.50    (#   1189:20  Unique         3.00, 3.02 A)
 &rst
  ixpk= 1189, nxpk= 20, iat= 618, 620, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    9 PRO  HG+          40 ILE  HB          5.50    (#   1190:20  Unique         2.91, 4.08 A)
 &rst
  ixpk= 1190, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 132, 133,
 &end
#
#    9 PRO  HB+          40 ILE  HB          5.50    (#   1191:20  Unique         1.94, 2.93 A)
 &rst
  ixpk= 1191, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 135, 136,
 &end
#
#   40 ILE  QG2          40 ILE  HB          4.50    (#   1193:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1193, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 622, 623, 624,
 &end
#
#   40 ILE  QD1          40 ILE  HB          4.50    (#   1194:20  Unique         2.12, 3.10 A)
 &rst
  ixpk= 1194, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#   40 ILE  HG1+         40 ILE  HB          5.50    (#   1195:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 1195, nxpk= 20, iat=  -1, 620, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#  102 LEU  HN          102 LEU  HG          5.50    (#   1196:20  Unique         2.27, 3.57 A)
 &rst
  ixpk= 1196, nxpk= 20, iat=1679,1686, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HN           40 ILE  HG1+        5.50    (#   1197:20  Unique         1.94, 2.92 A)
 &rst
  ixpk= 1197, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   10 ASN  HA           40 ILE  HG1-        5.50    (#   1198:20  Unique         2.00, 3.30 A)
 &rst
  ixpk= 1198, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   10 ASN  HA           40 ILE  HG1+        5.50    (#   1199:20  Unique         2.00, 3.30 A)
 &rst
  ixpk= 1199, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   40 ILE  HA           40 ILE  HG1+        5.50    (#   1200:20  Unique         2.44, 2.80 A)
 &rst
  ixpk= 1200, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   40 ILE  QD1          40 ILE  HG1+        4.50    (#   1201:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#   40 ILE  QD1          40 ILE  HG1-        4.50    (#   1202:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1202, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 629, 630, 631,
 igr2= 626, 627,
 &end
#
#   10 ASN  HN           40 ILE  QD1         5.50    (#   1203:20  Unique         2.21, 3.67 A)
 &rst
  ixpk= 1203, nxpk= 20, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   11 VAL  HN           40 ILE  QD1         5.50    (#   1204:20  Unique         4.60, 5.74 A)
 &rst
  ixpk= 1204, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   46 ALA  HN           40 ILE  QD1         5.50    (#   1205:20  Unique         4.11, 6.32 A)
 &rst
  ixpk= 1205, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   98 LYS  HN           40 ILE  QD1         5.50    (#   1207:20  Unique         3.82, 5.39 A)
 &rst
  ixpk= 1207, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   74 TRP  HZ2          40 ILE  QD1         5.50    (#   1208:20  Unique         3.80, 5.00 A)
 &rst
  ixpk= 1208, nxpk= 20, iat=1164,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HN           40 ILE  QD1         5.50    (#   1209:20  Unique         3.07, 4.13 A)
 &rst
  ixpk= 1209, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   74 TRP  HH2          40 ILE  QD1         3.50    (#   1211:20  Unique         2.00, 3.04 A)
 &rst
  ixpk= 1211, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 629, 630, 631,
 &end
#
#   11 VAL  HA           40 ILE  QD1         5.50    (#   1212:20  Unique         3.82, 5.30 A)
 &rst
  ixpk= 1212, nxpk= 20, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:1213    40 ILE  QD1         5.50    (#   1213:20  Single Ambig)
 &rst
  ixpk= 1213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 138, 144,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HA           40 ILE  QD1         5.50    (#   1214:20  Unique         2.00, 4.47 A)
 &rst
  ixpk= 1214, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 629, 630, 631,
 &end
#
#   39 GLY  HA+          40 ILE  QD1         5.50    (#   1215:20  Unique         4.72, 6.65 A)
 &rst
  ixpk= 1215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 611, 612,
 igr2= 629, 630, 631,
 &end
#
#   46 ALA  HA           40 ILE  QD1         4.50    (#   1216:20  Unique         2.10, 4.28 A)
 &rst
  ixpk= 1216, nxpk= 20, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 629, 630, 631,
 &end
#
#    9 PRO  HG+          40 ILE  QD1         5.50    (#   1217:20  Unique         4.22, 5.89 A)
 &rst
  ixpk= 1217, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 132, 133,
 igr2= 629, 630, 631,
 &end
#
#    0 AMB  20-2:1218    40 ILE  QD1         4.50    (#   1218:20  Single Ambig)
 &rst
  ixpk= 1218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 135, 136,1568,1569,
 igr2= 629, 630, 631,
 &end
#
#    9 PRO  HB-          40 ILE  QD1         4.50    (#   1219:20  Unique         2.00, 3.91 A)
 &rst
  ixpk= 1219, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 135, 136,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HB           40 ILE  QD1         2.80    (#   1220:20  Unique         2.12, 3.10 A)
 &rst
  ixpk= 1220, nxpk= 20, iat= 620,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 629, 630, 631,
 &end
#
#   40 ILE  HG1+         40 ILE  QD1         4.50    (#   1221:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 626, 627,
 igr2= 629, 630, 631,
 &end
#
#   11 VAL  MGX          40 ILE  QD1         5.50    (#   1222:20  Unique         1.99, 5.21 A)
 &rst
  ixpk= 1222, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 629, 630, 631,
 &end
#
#   98 LYS  HB-          40 ILE  QD1         5.50    (#   1223:20  Unique         3.98, 6.64 A)
 &rst
  ixpk= 1223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1598,1599,
 igr2= 629, 630, 631,
 &end
#
#   41 ASN  HN           40 ILE  QG2         4.50    (#   1224:20  Unique         1.95, 3.13 A)
 &rst
  ixpk= 1224, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 622, 623, 624,
 &end
#
#   45 SER  HN           40 ILE  QG2         5.50    (#   1225:20  Unique         2.65, 5.26 A)
 &rst
  ixpk= 1225, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   49 ALA  HN           40 ILE  QG2         5.50    (#   1226:20  Unique         4.25, 5.72 A)
 &rst
  ixpk= 1226, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   44 GLU  HN           40 ILE  QG2         5.50    (#   1227:20  Unique         3.79, 4.70 A)
 &rst
  ixpk= 1227, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HN           40 ILE  QG2         5.50    (#   1228:20  Unique         4.28, 4.52 A)
 &rst
  ixpk= 1228, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   74 TRP  HH2          40 ILE  QG2         5.50    (#   1229:20  Unique         3.36, 5.18 A)
 &rst
  ixpk= 1229, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1230    40 ILE  QG2         5.50    (#   1230:20  Single Ambig)
 &rst
  ixpk= 1230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 144, 138,
 igr2= 622, 623, 624,
 &end
#
#   41 ASN  HA           40 ILE  QG2         5.50    (#   1231:20  Unique         3.95, 4.98 A)
 &rst
  ixpk= 1231, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   44 GLU  HA           40 ILE  QG2         5.50    (#   1232:20  Unique         4.98, 6.13 A)
 &rst
  ixpk= 1232, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HA           40 ILE  QG2         4.50    (#   1233:20  Unique         2.26, 3.14 A)
 &rst
  ixpk= 1233, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 622, 623, 624,
 &end
#
#   46 ALA  HA           40 ILE  QG2         5.50    (#   1234:20  Unique         2.46, 4.58 A)
 &rst
  ixpk= 1234, nxpk= 20, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 622, 623, 624,
 &end
#
#   44 GLU  HG+          40 ILE  QG2         5.50    (#   1235:20  Unique         2.57, 5.46 A)
 &rst
  ixpk= 1235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 677, 678,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1236    40 ILE  QG2         3.50    (#   1236:20  Single Ambig)
 &rst
  ixpk= 1236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 674, 675, 674, 675, 677, 678,
 igr2= 622, 623, 624,
 &end
#
#    9 PRO  HB+          40 ILE  QG2         4.50    (#   1237:20  Unique         2.47, 4.90 A)
 &rst
  ixpk= 1237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 135, 136,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1239    40 ILE  QG2         2.80    (#   1239:20  Single Ambig)
 &rst
  ixpk= 1239, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 742, 743, 744, 620,
 igr2= 622, 623, 624,
 &end
#
#   40 ILE  HG1+         40 ILE  QG2         4.50    (#   1240:20  Unique         2.17, 3.42 A)
 &rst
  ixpk= 1240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 626, 627,
 igr2= 622, 623, 624,
 &end
#
#    0 AMB  20-2:1241    40 ILE  QG2         5.50    (#   1241:20  Single Ambig)
 &rst
  ixpk= 1241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 162, 163, 164, 166, 167, 168,1565,1566,
 igr2= 622, 623, 624,
 &end
#
#   41 ASN  HN           41 ASN  HB+         5.50    (#   1242:20  Unique         2.08, 2.79 A)
 &rst
  ixpk= 1242, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 639, 640,
 &end
#
#   41 ASN  HN           41 ASN  HB-         5.50    (#   1243:20  Unique         2.08, 2.79 A)
 &rst
  ixpk= 1243, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2+         41 ASN  HB+         5.50    (#   1244:20  Unique         2.12, 3.27 A)
 &rst
  ixpk= 1244, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2+         41 ASN  HB-         5.50    (#   1245:20  Unique         2.12, 3.27 A)
 &rst
  ixpk= 1245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2-         41 ASN  HB-         5.50    (#   1246:20  Unique         2.12, 3.27 A)
 &rst
  ixpk= 1246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HD2-         41 ASN  HB+         5.50    (#   1247:20  Unique         2.12, 3.27 A)
 &rst
  ixpk= 1247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 644, 645,
 igr2= 639, 640,
 &end
#
#   41 ASN  HA           41 ASN  HB+         5.50    (#   1248:20  Unique         2.41, 2.84 A)
 &rst
  ixpk= 1248, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 639, 640,
 &end
#
#   41 ASN  HA           41 ASN  HB-         5.50    (#   1249:20  Unique         2.41, 2.84 A)
 &rst
  ixpk= 1249, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD+          41 ASN  HB+         5.50    (#   1250:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD+          41 ASN  HB-         5.50    (#   1251:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1251, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD-          41 ASN  HB+         5.50    (#   1252:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#   42 PRO  HD-          41 ASN  HB-         5.50    (#   1253:20  Unique         1.97, 3.58 A)
 &rst
  ixpk= 1253, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 639, 640,
 &end
#
#    0 AMB  20-2:1254     0 AMB  20-1:1254   5.50    (#   1254:20  Double Ambig)
 &rst
  ixpk= 1254, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 674, 675, 674, 675,
 igr2= 639, 640, 639, 640,
 &end
#
#    0 AMB  20-2:1255    41 ASN  HB-         5.50    (#   1255:20  Single Ambig)
 &rst
  ixpk= 1255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 674, 675, 674, 675,
 igr2= 639, 640,
 &end
#
#   43 GLY  HN           42 PRO  HA          3.50    (#   1256:20  Unique         2.21, 2.37 A)
 &rst
  ixpk= 1256, nxpk= 20, iat= 663, 659, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 GLU  HN           42 PRO  HA          5.50    (#   1257:20  Unique         3.89, 4.09 A)
 &rst
  ixpk= 1257, nxpk= 20, iat= 670, 659, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 ASN  HA           42 PRO  HA          5.50    (#   1258:20  Unique         4.39, 4.39 A)
 &rst
  ixpk= 1258, nxpk= 20, iat= 637, 659, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 GLY  HA+          42 PRO  HA          5.50    (#   1259:20  Unique         4.31, 4.39 A)
 &rst
  ixpk= 1259, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 665, 666,
 &end
#
#   42 PRO  HD+          42 PRO  HA          5.50    (#   1260:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1260, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   43 GLY  HA-          42 PRO  HA          5.50    (#   1261:20  Unique         4.31, 4.39 A)
 &rst
  ixpk= 1261, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 665, 666,
 &end
#
#   42 PRO  HD-          42 PRO  HA          5.50    (#   1262:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 1262, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   42 PRO  HB+          42 PRO  HA          4.50    (#   1263:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1263, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 656, 657,
 &end
#
#    0 AMB  20-2:1264    42 PRO  HA          5.50    (#   1264:20  Single Ambig)
 &rst
  ixpk= 1264, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 653, 654,   8,   9,   8,   9, 674, 675, 674, 675,
      
 &end
#
#   42 PRO  HB-          42 PRO  HA          4.50    (#   1266:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1266, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 656, 657,
 &end
#
#   40 ILE  QG2          42 PRO  HA          5.50    (#   1267:20  Unique         4.51, 5.56 A)
 &rst
  ixpk= 1267, nxpk= 20, iat=  -1, 659, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#   42 PRO  HG+          42 PRO  HB-         4.50    (#   1268:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 653, 654,
 igr2= 656, 657,
 &end
#
#    0 AMB  20-2:1269     0 AMB  20-1:1269   3.50    (#   1269:20  Double Ambig)
 &rst
  ixpk= 1269, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 653, 654,1705,1706,1705,1706,
 igr2= 656, 657,1702,1703,1702,1703,
 &end
#
#    0 AMB  20-2:1270     0 AMB  20-1:1270   4.50    (#   1270:20  Double Ambig)
 &rst
  ixpk= 1270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 653, 654,  15,  16,  17,
 igr2= 656, 657, 656, 657,
 &end
#
#   42 PRO  HG+          42 PRO  HB+         2.80    (#   1271:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 1271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 653, 654,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD-          42 PRO  HB+         5.50    (#   1272:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD-          42 PRO  HB-         5.50    (#   1273:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1273, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD+          42 PRO  HB+         5.50    (#   1274:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1274, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HD+          42 PRO  HB-         5.50    (#   1275:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 1275, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 656, 657,
 &end
#
#   42 PRO  HA           42 PRO  HB+         4.50    (#   1276:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1276, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 656, 657,
 &end
#
#   42 PRO  HA           42 PRO  HB-         5.50    (#   1277:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1277, nxpk= 20, iat= 659,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 656, 657,
 &end
#
#   41 ASN  HA           42 PRO  HB+         5.50    (#   1278:20  Unique         4.83, 5.25 A)
 &rst
  ixpk= 1278, nxpk= 20, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 656, 657,
 &end
#
#  103 GLN  HA          103 GLN  HB+         5.50    (#   1279:20  Unique         2.45, 2.82 A)
 &rst
  ixpk= 1279, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#   44 GLU  HN           42 PRO  HB+         5.50    (#   1280:20  Unique         4.81, 5.59 A)
 &rst
  ixpk= 1280, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 656, 657,
 &end
#
#   44 GLU  HN           42 PRO  HB-         5.50    (#   1281:20  Unique         4.81, 5.59 A)
 &rst
  ixpk= 1281, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 656, 657,
 &end
#
#   43 GLY  HN           42 PRO  HB+         5.50    (#   1282:20  Unique         3.99, 4.35 A)
 &rst
  ixpk= 1282, nxpk= 20, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 656, 657,
 &end
#
#  104 LEU  HN          103 GLN  HB+         5.50    (#   1283:20  Unique         2.64, 3.82 A)
 &rst
  ixpk= 1283, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#  113 MET  HN            0 AMB  20-1:1284   5.50    (#   1284:20  Single Ambig)
 &rst
  ixpk= 1284, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1862,1863,1862,1863,
 &end
#
#  114 GLN  HN            0 AMB  20-1:1285   4.50    (#   1285:20  Single Ambig)
 &rst
  ixpk= 1285, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1862,1863,1862,1863,
 &end
#
#  160 GLU  HN            0 AMB  20-1:1286   5.50    (#   1286:20  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2629,2630,2629,2630,
 &end
#
#  115 THR  HN            0 AMB  20-1:1287   5.50    (#   1287:20  Single Ambig)
 &rst
  ixpk= 1287, nxpk= 20, iat=1872,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1862,1863,1862,1863,
 &end
#
#    0 AMB  20-2:1288     0 AMB  20-1:1288   3.50    (#   1288:20  Double Ambig)
 &rst
  ixpk= 1288, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.47, r4= 6.97,
 igr1=2622,1867,1868,1867,1868,
 igr2=2629,2630,2629,2630,1862,1863,1862,1863,
 &end
#
#    0 AMB  20-2:1289     0 AMB  20-1:1289   5.50    (#   1289:20  Double Ambig)
 &rst
  ixpk= 1289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2603, 282,
 igr2=2629,2630,2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:1290     0 AMB  20-1:1290   5.50    (#   1290:20  Double Ambig)
 &rst
  ixpk= 1290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2634,2635,2634,2635,
 igr2=2629,2630,2629,2630,
 &end
#
#  114 GLN  HE2-          0 AMB  20-1:1291   5.50    (#   1291:20  Single Ambig)
 &rst
  ixpk= 1291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1867,1868,
 igr2=1862,1863,1862,1863,
 &end
#
#  159 GLN  HE2-          0 AMB  20-1:1292   5.50    (#   1292:20  Single Ambig)
 &rst
  ixpk= 1292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2634,2635,
 igr2=2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:1293     0 AMB  20-1:1293   5.50    (#   1293:20  Double Ambig)
 &rst
  ixpk= 1293, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1932,2080,
 igr2=1862,1863,1862,1863,2629,2630,2629,2630,
 &end
#
#  156 MET  HA            0 AMB  20-1:1294   3.50    (#   1294:20  Single Ambig)
 &rst
  ixpk= 1294, nxpk= 20, iat=2577,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:1295     0 AMB  20-1:1295   5.50    (#   1295:20  Double Ambig)
 &rst
  ixpk= 1295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.56, r4=11.06,
 igr1=1874,1876,1912,2596,2597,
 igr2=1862,1863,1862,1863,1862,1863,1862,1863,2629,2630,
      
 &end
#
#  112 ASN  HB-           0 AMB  20-1:1296   5.50    (#   1296:20  Single Ambig)
 &rst
  ixpk= 1296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1828,1829,
 igr2=1862,1863,1862,1863,
 &end
#
#    0 AMB  20-2:1297     0 AMB  20-1:1297   2.80    (#   1297:20  Double Ambig)
 &rst
  ixpk= 1297, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=2626,2627,2579,2580,2579,2580,
 igr2=2629,2630,2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:1298     0 AMB  20-1:1298   2.80    (#   1298:20  Double Ambig)
 &rst
  ixpk= 1298, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=2626,2627,2626,2627,
 igr2=2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:1299     0 AMB  20-1:1299   5.50    (#   1299:20  Double Ambig)
 &rst
  ixpk= 1299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=1926,1927,2607,2608,
 igr2=1862,1863,1862,1863,2629,2630,2629,2630,
 &end
#
#    2 ILE  QG2          90 PRO  HB+         5.50    (#   1300:20  Unique         3.15, 5.06 A)
 &rst
  ixpk= 1300, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2=1478,1479,
 &end
#
#    0 AMB  20-2:1301     0 AMB  20-1:1301   4.50    (#   1301:20  Double Ambig)
 &rst
  ixpk= 1301, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1512, 663,
 igr2=  78,  79, 665, 666,
 &end
#
#   43 GLY  HN           43 GLY  HA+         4.50    (#   1302:20  Unique         2.35, 2.70 A)
 &rst
  ixpk= 1302, nxpk= 20, iat= 663,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 665, 666,
 &end
#
#   44 GLU  HN           43 GLY  HA-         5.50    (#   1303:20  Unique         2.90, 3.24 A)
 &rst
  ixpk= 1303, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 665, 666,
 &end
#
#   44 GLU  HN           43 GLY  HA+         5.50    (#   1304:20  Unique         2.90, 3.24 A)
 &rst
  ixpk= 1304, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 665, 666,
 &end
#
#   45 SER  HA           43 GLY  HA-         5.50    (#   1306:20  Unique         5.42, 6.33 A)
 &rst
  ixpk= 1306, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 665, 666,
 &end
#
#    0 AMB  20-2:1307     0 AMB  20-1:1307   5.50    (#   1307:20  Double Ambig)
 &rst
  ixpk= 1307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 248, 249,1772,1773,1772,1773,
 igr2=1763,1764,1763,1764,1763,1764,
 &end
#
#    0 AMB  20-2:1308     0 AMB  20-1:1308   5.50    (#   1308:20  Double Ambig)
 &rst
  ixpk= 1308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 674, 675, 674, 675, 653, 654, 677, 678,
 igr2= 665, 666, 665, 666, 665, 666, 665, 666,
 &end
#
#  110 GLU  HB-         107 GLY  HA+         5.50    (#   1309:20  Unique         2.86, 5.65 A)
 &rst
  ixpk= 1309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,
 igr2=1763,1764,
 &end
#
#    0 AMB  20-2:1310     0 AMB  20-1:1310   5.50    (#   1310:20  Double Ambig)
 &rst
  ixpk= 1310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1784,1785,1786, 248, 249, 919,
 igr2=1763,1764,1763,1764,1763,1764,
 &end
#
#  104 LEU  MDY         107 GLY  HA+         5.50    (#   1311:20  Unique         1.98, 3.94 A)
 &rst
  ixpk= 1311, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1763,1764,
 &end
#
#   45 SER  HN           44 GLU  HA          3.50    (#   1312:20  Unique         2.14, 2.64 A)
 &rst
  ixpk= 1312, nxpk= 20, iat= 685, 672, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 GLU  HN           44 GLU  HA          5.50    (#   1313:20  Unique         2.79, 2.86 A)
 &rst
  ixpk= 1313, nxpk= 20, iat= 670, 672, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HB+          44 GLU  HA          3.50    (#   1314:20  Unique         3.27, 4.62 A)
 &rst
  ixpk= 1314, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 725, 726,
 &end
#
#    0 AMB  20-2:1315    44 GLU  HA          4.50    (#   1315:20  Single Ambig)
 &rst
  ixpk= 1315, nxpk= 20, iat=  -1, 672, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 674, 675, 674, 675, 677, 678,
 &end
#
#  104 LEU  HG          104 LEU  HA          5.50    (#   1316:20  Unique         2.24, 2.98 A)
 &rst
  ixpk= 1316, nxpk= 20, iat=1722,1717, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  MDX         104 LEU  HA          5.50    (#   1317:20  Unique         1.96, 3.90 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=  -1,1717, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  20-2:1318   104 LEU  HA          5.50    (#   1318:20  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 20, iat=  -1,1717, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#   49 ALA  MB           44 GLU  HB+         5.50    (#   1319:20  Unique         2.42, 4.59 A)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744,
 igr2= 674, 675,
 &end
#
#   49 ALA  MB            0 AMB  20-1:1320   5.50    (#   1320:20  Single Ambig)
 &rst
  ixpk= 1320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 742, 743, 744,
 igr2= 674, 675, 674, 675,
 &end
#
#   44 GLU  HG+          44 GLU  HB-         5.50    (#   1321:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 1321, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 677, 678,
 igr2= 674, 675,
 &end
#
#   44 GLU  HG+          44 GLU  HB+         4.50    (#   1322:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 1322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 677, 678,
 igr2= 674, 675,
 &end
#
#    0 AMB  20-2:1323     0 AMB  20-1:1323   5.50    (#   1323:20  Double Ambig)
 &rst
  ixpk= 1323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 639, 640, 639, 640,
 igr2= 674, 675, 674, 675,
 &end
#
#    0 AMB  20-2:1324     0 AMB  20-1:1324   5.50    (#   1324:20  Double Ambig)
 &rst
  ixpk= 1324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 639, 640,2302,2303,
 igr2= 674, 675,2351,
 &end
#
#   44 GLU  HA           44 GLU  HB-         5.50    (#   1325:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 1325, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 675,
 &end
#
#   44 GLU  HA           44 GLU  HB+         5.50    (#   1326:20  Unique         2.33, 2.74 A)
 &rst
  ixpk= 1326, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 675,
 &end
#
#   44 GLU  HN           44 GLU  HB+         4.50    (#   1327:20  Unique         2.38, 2.61 A)
 &rst
  ixpk= 1327, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 674, 675,
 &end
#
#   45 SER  HN           44 GLU  HB+         5.50    (#   1329:20  Unique         1.70, 3.78 A)
 &rst
  ixpk= 1329, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 675,
 &end
#
#   45 SER  HN           44 GLU  HB-         5.50    (#   1330:20  Unique         1.70, 3.78 A)
 &rst
  ixpk= 1330, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 675,
 &end
#
#   41 ASN  HN            0 AMB  20-1:1331   5.50    (#   1331:20  Single Ambig)
 &rst
  ixpk= 1331, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 674, 675, 674, 675,
 &end
#
#   41 ASN  HN           44 GLU  HB-         5.50    (#   1332:20  Unique         2.30, 3.32 A)
 &rst
  ixpk= 1332, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 674, 675,
 &end
#
#   41 ASN  HN           44 GLU  HG+         5.50    (#   1333:20  Unique         2.42, 4.20 A)
 &rst
  ixpk= 1333, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   41 ASN  HN           44 GLU  HG-         5.50    (#   1334:20  Unique         2.42, 4.20 A)
 &rst
  ixpk= 1334, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   45 SER  HN           44 GLU  HG+         5.50    (#   1335:20  Unique         2.24, 3.49 A)
 &rst
  ixpk= 1335, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   45 SER  HN           44 GLU  HG-         5.50    (#   1336:20  Unique         2.24, 3.49 A)
 &rst
  ixpk= 1336, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   49 ALA  HN           44 GLU  HG-         5.50    (#   1337:20  Unique         2.37, 3.11 A)
 &rst
  ixpk= 1337, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   49 ALA  HN           44 GLU  HG+         5.50    (#   1338:20  Unique         2.37, 3.11 A)
 &rst
  ixpk= 1338, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   44 GLU  HN           44 GLU  HG+         5.50    (#   1339:20  Unique         2.44, 4.45 A)
 &rst
  ixpk= 1339, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   44 GLU  HN           44 GLU  HG-         5.50    (#   1340:20  Unique         2.44, 4.45 A)
 &rst
  ixpk= 1340, nxpk= 20, iat= 670,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   44 GLU  HA           44 GLU  HG+         5.50    (#   1341:20  Unique         2.57, 3.27 A)
 &rst
  ixpk= 1341, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   44 GLU  HA           44 GLU  HG-         5.50    (#   1342:20  Unique         2.57, 3.27 A)
 &rst
  ixpk= 1342, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   40 ILE  HA           44 GLU  HG+         5.50    (#   1343:20  Unique         4.04, 5.41 A)
 &rst
  ixpk= 1343, nxpk= 20, iat= 618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   49 ALA  HA           44 GLU  HG-         5.50    (#   1344:20  Unique         2.44, 3.51 A)
 &rst
  ixpk= 1344, nxpk= 20, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 677, 678,
 &end
#
#   41 ASN  HB+          44 GLU  HG-         5.50    (#   1345:20  Unique         2.72, 4.26 A)
 &rst
  ixpk= 1345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 639, 640,
 igr2= 677, 678,
 &end
#
#   52 ARG  HB+          44 GLU  HG+         5.50    (#   1346:20  Unique         3.93, 6.02 A)
 &rst
  ixpk= 1346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791,
 igr2= 677, 678,
 &end
#
#   49 ALA  MB           44 GLU  HG-         5.50    (#   1347:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 1347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744,
 igr2= 677, 678,
 &end
#
#   49 ALA  MB           44 GLU  HG+         5.50    (#   1348:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 1348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744,
 igr2= 677, 678,
 &end
#
#   40 ILE  QG2          44 GLU  HG+         5.50    (#   1349:20  Unique         2.57, 5.46 A)
 &rst
  ixpk= 1349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 622, 623, 624,
 igr2= 677, 678,
 &end
#
#   40 ILE  QG2          44 GLU  HG-         5.50    (#   1350:20  Unique         2.57, 5.46 A)
 &rst
  ixpk= 1350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 622, 623, 624,
 igr2= 677, 678,
 &end
#
#   46 ALA  HN           45 SER  HA          5.50    (#   1351:20  Unique         2.37, 2.60 A)
 &rst
  ixpk= 1351, nxpk= 20, iat= 696, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 SER  HN           45 SER  HA          5.50    (#   1352:20  Unique         2.29, 2.68 A)
 &rst
  ixpk= 1352, nxpk= 20, iat= 685, 687, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 SER  HB-          45 SER  HA          5.50    (#   1354:20  Unique         2.36, 2.82 A)
 &rst
  ixpk= 1354, nxpk= 20, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 689, 690,
 &end
#
#    0 AMB  20-2:1355    45 SER  HB-         5.50    (#   1355:20  Single Ambig)
 &rst
  ixpk= 1355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 700, 701, 702, 742, 743, 744,
 igr2= 689, 690,
 &end
#
#    0 AMB  20-2:1356     0 AMB  20-1:1356   5.50    (#   1356:20  Double Ambig)
 &rst
  ixpk= 1356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 700, 701, 702, 742, 743, 744,
 igr2= 689, 690, 689, 690,
 &end
#
#    0 AMB  20-2:1357     0 AMB  20-1:1357   5.50    (#   1357:20  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 677, 678, 710, 711,
 igr2= 689, 690, 689, 690,
 &end
#
#    0 AMB  20-2:1358    45 SER  HB-         5.50    (#   1358:20  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 677, 678, 710, 711,
 igr2= 689, 690,
 &end
#
#    0 AMB  20-2:1359    45 SER  HB-         5.50    (#   1359:20  Single Ambig)
 &rst
  ixpk= 1359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 728, 729, 728, 729,
 igr2= 689, 690,
 &end
#
#   45 SER  HA           45 SER  HB+         4.50    (#   1360:20  Unique         2.36, 2.82 A)
 &rst
  ixpk= 1360, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 689, 690,
 &end
#
#   45 SER  HA           45 SER  HB-         4.50    (#   1361:20  Unique         2.36, 2.82 A)
 &rst
  ixpk= 1361, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 689, 690,
 &end
#
#   48 GLN  HN           45 SER  HB-         5.50    (#   1362:20  Unique         2.61, 3.53 A)
 &rst
  ixpk= 1362, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 689, 690,
 &end
#
#   48 GLN  HN           45 SER  HB+         5.50    (#   1363:20  Unique         2.61, 3.53 A)
 &rst
  ixpk= 1363, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 689, 690,
 &end
#
#    0 AMB  20-2:1364    45 SER  HB-         5.50    (#   1364:20  Single Ambig)
 &rst
  ixpk= 1364, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 685, 706,
 igr2= 689, 690,
 &end
#
#    0 AMB  20-2:1365     0 AMB  20-1:1365   5.50    (#   1365:20  Double Ambig)
 &rst
  ixpk= 1365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 685, 706,
 igr2= 689, 690, 689, 690,
 &end
#
#   46 ALA  HN           45 SER  HB+         5.50    (#   1366:20  Unique         2.12, 3.22 A)
 &rst
  ixpk= 1366, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 689, 690,
 &end
#
#   46 ALA  HN           45 SER  HB-         5.50    (#   1367:20  Unique         2.12, 3.22 A)
 &rst
  ixpk= 1367, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 689, 690,
 &end
#
#   46 ALA  HN           46 ALA  HA          5.50    (#   1368:20  Unique         2.80, 2.87 A)
 &rst
  ixpk= 1368, nxpk= 20, iat= 696, 698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1369    46 ALA  HA          5.50    (#   1369:20  Single Ambig)
 &rst
  ixpk= 1369, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 706, 685,
 &end
#
#   49 ALA  HN           46 ALA  HA          5.50    (#   1370:20  Unique         3.18, 3.77 A)
 &rst
  ixpk= 1370, nxpk= 20, iat= 738, 698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HN           46 ALA  HA          5.50    (#   1371:20  Unique         3.69, 4.93 A)
 &rst
  ixpk= 1371, nxpk= 20, iat= 721, 698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HH2          46 ALA  HA          5.50    (#   1372:20  Unique         2.26, 2.89 A)
 &rst
  ixpk= 1372, nxpk= 20, iat=1166, 698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1373    46 ALA  HA          5.50    (#   1373:20  Single Ambig)
 &rst
  ixpk= 1373, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 677, 678, 710, 711, 674, 675, 674, 675, 713, 714,
      
 &end
#
#    0 AMB  20-2:1374    46 ALA  HA          2.80    (#   1374:20  Single Ambig)
 &rst
  ixpk= 1374, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 742, 743, 744, 700, 701, 702,
 &end
#
#   11 VAL  MGY          46 ALA  HA          3.50    (#   1375:20  Unique         2.97, 4.93 A)
 &rst
  ixpk= 1375, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:1376    46 ALA  HA          5.50    (#   1376:20  Single Ambig)
 &rst
  ixpk= 1376, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 626, 627,1604,1605,
 &end
#
#   11 VAL  MGX          46 ALA  HA          5.50    (#   1377:20  Unique         2.97, 4.93 A)
 &rst
  ixpk= 1377, nxpk= 20, iat=  -1, 698, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          46 ALA  MB          5.50    (#   1378:20  Unique         2.81, 4.94 A)
 &rst
  ixpk= 1378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1598,1599,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HG-          46 ALA  MB          5.50    (#   1379:20  Unique         2.63, 4.96 A)
 &rst
  ixpk= 1379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1601,1602,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1380    46 ALA  MB          5.50    (#   1380:20  Single Ambig)
 &rst
  ixpk= 1380, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1601,1602, 162, 163, 164, 166, 167, 168,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HD-          46 ALA  MB          5.50    (#   1381:20  Unique         1.97, 3.47 A)
 &rst
  ixpk= 1381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1604,1605,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HD+          46 ALA  MB          5.50    (#   1382:20  Unique         1.97, 3.47 A)
 &rst
  ixpk= 1382, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1604,1605,
 igr2= 700, 701, 702,
 &end
#
#   11 VAL  MGY          46 ALA  MB          3.50    (#   1383:20  Unique         3.00, 6.38 A)
 &rst
  ixpk= 1383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HG-          46 ALA  MB          5.50    (#   1384:20  Unique         3.75, 7.11 A)
 &rst
  ixpk= 1384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 713, 714,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1385    46 ALA  MB          5.50    (#   1385:20  Single Ambig)
 &rst
  ixpk= 1385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 713, 714, 710, 711,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HA           46 ALA  MB          5.50    (#   1386:20  Unique         3.83, 4.85 A)
 &rst
  ixpk= 1386, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#   46 ALA  HA           46 ALA  MB          3.50    (#   1387:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 1387, nxpk= 20, iat= 698,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 700, 701, 702,
 &end
#
#   45 SER  HB+          46 ALA  MB          5.50    (#   1388:20  Unique         4.41, 5.91 A)
 &rst
  ixpk= 1388, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 689, 690,
 igr2= 700, 701, 702,
 &end
#
#   45 SER  HA           46 ALA  MB          5.50    (#   1389:20  Unique         4.32, 5.16 A)
 &rst
  ixpk= 1389, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#   11 VAL  HA           46 ALA  MB          5.50    (#   1390:20  Unique         5.19, 6.76 A)
 &rst
  ixpk= 1390, nxpk= 20, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#   48 GLN  HE2-         46 ALA  MB          4.50    (#   1391:20  Unique         5.85, 7.36 A)
 &rst
  ixpk= 1391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 733, 734,
 igr2= 700, 701, 702,
 &end
#
#   74 TRP  HH2          46 ALA  MB          3.50    (#   1392:20  Unique         1.96, 2.86 A)
 &rst
  ixpk= 1392, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 700, 701, 702,
 &end
#
#   74 TRP  HZ2          46 ALA  MB          5.50    (#   1393:20  Unique         1.98, 2.89 A)
 &rst
  ixpk= 1393, nxpk= 20, iat=1164,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#    0 AMB  20-2:1394    46 ALA  MB          5.50    (#   1394:20  Single Ambig)
 &rst
  ixpk= 1394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 721, 172,
 igr2= 700, 701, 702,
 &end
#
#   98 LYS  HN           46 ALA  MB          5.50    (#   1395:20  Unique         4.46, 6.05 A)
 &rst
  ixpk= 1395, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HN           46 ALA  MB          4.50    (#   1396:20  Unique         2.42, 3.60 A)
 &rst
  ixpk= 1396, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 700, 701, 702,
 &end
#
#   49 ALA  HN           46 ALA  MB          5.50    (#   1397:20  Unique         5.22, 5.81 A)
 &rst
  ixpk= 1397, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 700, 701, 702,
 &end
#
#   46 ALA  HN           46 ALA  MB          3.50    (#   1398:20  Unique         2.15, 2.93 A)
 &rst
  ixpk= 1398, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 700, 701, 702,
 &end
#
#   47 GLU  HN           47 GLU  HA          5.50    (#   1399:20  Unique         2.75, 2.83 A)
 &rst
  ixpk= 1399, nxpk= 20, iat= 706, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HN           47 GLU  HA          5.50    (#   1400:20  Unique         3.23, 3.52 A)
 &rst
  ixpk= 1400, nxpk= 20, iat= 748, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1401    47 GLU  HA          5.50    (#   1401:20  Single Ambig)
 &rst
  ixpk= 1401, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 765, 786,
 &end
#
#   48 GLN  HN           47 GLU  HA          5.50    (#   1402:20  Unique         3.43, 3.55 A)
 &rst
  ixpk= 1402, nxpk= 20, iat= 721, 708, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HD           47 GLU  HA          5.50    (#   1403:20  Unique         4.17, 6.14 A)
 &rst
  ixpk= 1403, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 773, 782,
 &end
#
#   51 TYR  HE           47 GLU  HA          5.50    (#   1405:20  Unique         3.01, 5.25 A)
 &rst
  ixpk= 1405, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#    0 AMB  20-2:1406    47 GLU  HA          5.50    (#   1406:20  Single Ambig)
 &rst
  ixpk= 1406, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 723, 689, 690,
 &end
#
#    0 AMB  20-2:1407    47 GLU  HA          5.50    (#   1407:20  Single Ambig)
 &rst
  ixpk= 1407, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 750,1092,1093,
 &end
#
#    0 AMB  20-2:1408    47 GLU  HA          5.50    (#   1408:20  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 952, 953, 952, 953, 769, 770,
 &end
#
#    0 AMB  20-2:1409    47 GLU  HA          4.50    (#   1409:20  Single Ambig)
 &rst
  ixpk= 1409, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 713, 714, 710, 711,
 &end
#
#   47 GLU  HB-          47 GLU  HA          5.50    (#   1410:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 1410, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 710, 711,
 &end
#
#   47 GLU  HG-          47 GLU  HA          4.50    (#   1411:20  Unique         2.17, 2.92 A)
 &rst
  ixpk= 1411, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 713, 714,
 &end
#
#    0 AMB  20-2:1412    47 GLU  HA          4.50    (#   1412:20  Single Ambig)
 &rst
  ixpk= 1412, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 755, 756, 700, 701, 702,
 &end
#
#   50 MET  HG+          47 GLU  HA          4.50    (#   1413:20  Unique         3.80, 4.97 A)
 &rst
  ixpk= 1413, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 755, 756,
 &end
#
#   50 MET  HB-          47 GLU  HA          5.50    (#   1414:20  Unique         2.40, 3.06 A)
 &rst
  ixpk= 1414, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          47 GLU  HA          5.50    (#   1415:20  Unique         4.72, 6.94 A)
 &rst
  ixpk= 1415, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:1416    47 GLU  HA          5.50    (#   1416:20  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1053,1054,1055,1688,1689,1690,1692,1693,1694,
 &end
#
#   50 MET  ME           47 GLU  HA          5.50    (#   1417:20  Unique         1.85, 3.61 A)
 &rst
  ixpk= 1417, nxpk= 20, iat=  -1, 708, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 759, 760, 761,
 &end
#
#   47 GLU  HN           47 GLU  HB+         4.50    (#   1418:20  Unique         2.08, 2.60 A)
 &rst
  ixpk= 1418, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 710, 711,
 &end
#
#   47 GLU  HN           47 GLU  HB-         5.50    (#   1419:20  Unique         2.08, 2.60 A)
 &rst
  ixpk= 1419, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#   48 GLN  HN           47 GLU  HB+         5.50    (#   1420:20  Unique         1.99, 2.98 A)
 &rst
  ixpk= 1420, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#   48 GLN  HN           47 GLU  HB-         5.50    (#   1421:20  Unique         1.99, 2.98 A)
 &rst
  ixpk= 1421, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#   56 GLU  HA           56 GLU  HB+         5.50    (#   1422:20  Unique         2.27, 2.72 A)
 &rst
  ixpk= 1422, nxpk= 20, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 864,
 &end
#
#   47 GLU  HA           47 GLU  HB+         5.50    (#   1423:20  Unique         2.34, 2.72 A)
 &rst
  ixpk= 1423, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#    0 AMB  20-2:1424     0 AMB  20-1:1424   5.50    (#   1424:20  Double Ambig)
 &rst
  ixpk= 1424, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2321,2322, 708,
 igr2=2315,2316, 710, 711,
 &end
#
#   56 GLU  HG+          56 GLU  HB+         5.50    (#   1425:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1425, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867,
 igr2= 863, 864,
 &end
#
#   50 MET  ME           47 GLU  HB+         5.50    (#   1427:20  Unique         3.65, 5.66 A)
 &rst
  ixpk= 1427, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2= 710, 711,
 &end
#
#    0 AMB  20-2:1428     0 AMB  20-1:1428   5.50    (#   1428:20  Double Ambig)
 &rst
  ixpk= 1428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.08, r4=12.58,
 igr1=1053,1054,1055,1604,1605,1878,1879,1880, 895, 896,
       897, 899, 900, 901,
 igr2= 710, 711, 710, 711, 863, 864, 863, 864,
 &end
#
#    0 AMB  20-2:1429     0 AMB  20-1:1429   5.50    (#   1429:20  Double Ambig)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 759, 760, 761,2296,2297,2296,2297,
 igr2= 710, 711,2315,2316,2315,2316,
 &end
#
#    0 AMB  20-2:1430    47 GLU  HB-         5.50    (#   1430:20  Single Ambig)
 &rst
  ixpk= 1430, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1053,1054,1055,1688,1689,1690,1692,1693,1694,
 igr2= 710, 711,
 &end
#
#   47 GLU  HN           47 GLU  HG+         5.50    (#   1431:20  Unique         3.05, 4.31 A)
 &rst
  ixpk= 1431, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   47 GLU  HN           47 GLU  HG-         5.50    (#   1432:20  Unique         3.05, 4.31 A)
 &rst
  ixpk= 1432, nxpk= 20, iat= 706,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   48 GLN  HN           47 GLU  HG+         5.50    (#   1433:20  Unique         2.54, 3.83 A)
 &rst
  ixpk= 1433, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   48 GLN  HN           47 GLU  HG-         5.50    (#   1434:20  Unique         2.54, 3.83 A)
 &rst
  ixpk= 1434, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   51 TYR  HD           47 GLU  HG+         5.50    (#   1435:20  Unique         3.75, 6.13 A)
 &rst
  ixpk= 1435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 713, 714,
 &end
#
#   51 TYR  HD           47 GLU  HG-         5.50    (#   1436:20  Unique         3.75, 6.13 A)
 &rst
  ixpk= 1436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 713, 714,
 &end
#
#   48 GLN  HE2-         47 GLU  HG+         5.50    (#   1437:20  Unique         3.40, 6.16 A)
 &rst
  ixpk= 1437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 733, 734,
 igr2= 713, 714,
 &end
#
#   51 TYR  HE           47 GLU  HG+         5.50    (#   1438:20  Unique         1.98, 4.67 A)
 &rst
  ixpk= 1438, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 713, 714,
 &end
#
#   51 TYR  HE           47 GLU  HG-         5.50    (#   1439:20  Unique         1.98, 4.67 A)
 &rst
  ixpk= 1439, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 713, 714,
 &end
#
#   47 GLU  HA           47 GLU  HG+         5.50    (#   1440:20  Unique         2.17, 2.92 A)
 &rst
  ixpk= 1440, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   47 GLU  HA           47 GLU  HG-         5.50    (#   1441:20  Unique         2.17, 2.92 A)
 &rst
  ixpk= 1441, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 713, 714,
 &end
#
#   47 GLU  HB-          47 GLU  HG+         3.50    (#   1442:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 1442, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 710, 711,
 igr2= 713, 714,
 &end
#
#   47 GLU  HB-          47 GLU  HG-         4.50    (#   1443:20  Unique         2.23, 2.72 A)
 &rst
  ixpk= 1443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 710, 711,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1444     0 AMB  20-1:1444   5.50    (#   1444:20  Double Ambig)
 &rst
  ixpk= 1444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 700, 701, 702, 755, 756,
 igr2= 713, 714, 713, 714,
 &end
#
#    0 AMB  20-2:1445    47 GLU  HG-         5.50    (#   1445:20  Single Ambig)
 &rst
  ixpk= 1445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 700, 701, 702, 755, 756,
 igr2= 713, 714,
 &end
#
#   67 ILE  QD1          47 GLU  HG+         5.50    (#   1446:20  Unique         2.68, 5.03 A)
 &rst
  ixpk= 1446, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1053,1054,1055,
 igr2= 713, 714,
 &end
#
#   50 MET  ME           47 GLU  HG+         5.50    (#   1447:20  Unique         2.55, 4.64 A)
 &rst
  ixpk= 1447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2= 713, 714,
 &end
#
#   50 MET  ME           47 GLU  HG-         5.50    (#   1448:20  Unique         2.55, 4.64 A)
 &rst
  ixpk= 1448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2= 713, 714,
 &end
#
#    0 AMB  20-2:1449     0 AMB  20-1:1449   4.50    (#   1449:20  Double Ambig)
 &rst
  ixpk= 1449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.49, r4= 8.99,
 igr1=1688,1689,1690,1692,1693,1694,1006,1007,1008,1010,
      1011,1012,1053,1054,1055,
 igr2=1004, 713, 714,
 &end
#
#    0 AMB  20-2:1450    48 GLN  HA          5.50    (#   1450:20  Single Ambig)
 &rst
  ixpk= 1450, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 706, 685,
 &end
#
#   49 ALA  HN           48 GLN  HA          5.50    (#   1451:20  Unique         3.43, 3.51 A)
 &rst
  ixpk= 1451, nxpk= 20, iat= 738, 723, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1452    48 GLN  HA          5.50    (#   1452:20  Single Ambig)
 &rst
  ixpk= 1452, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 765, 786,
 &end
#
#   48 GLN  HN           48 GLN  HA          5.50    (#   1453:20  Unique         2.74, 2.80 A)
 &rst
  ixpk= 1453, nxpk= 20, iat= 721, 723, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HD           48 GLN  HA          5.50    (#   1454:20  Unique         2.20, 4.61 A)
 &rst
  ixpk= 1454, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 773, 782,
 &end
#
#   48 GLN  HE2-         48 GLN  HA          5.50    (#   1455:20  Unique         4.14, 4.87 A)
 &rst
  ixpk= 1455, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   51 TYR  HE           48 GLN  HA          5.50    (#   1456:20  Unique         2.89, 5.21 A)
 &rst
  ixpk= 1456, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   51 TYR  HB+          48 GLN  HA          5.50    (#   1457:20  Unique         3.80, 5.04 A)
 &rst
  ixpk= 1457, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB-          48 GLN  HA          5.50    (#   1458:20  Unique         3.80, 5.04 A)
 &rst
  ixpk= 1458, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 769, 770,
 &end
#
#    0 AMB  20-2:1459    48 GLN  HA          4.50    (#   1459:20  Single Ambig)
 &rst
  ixpk= 1459, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 728, 729, 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HA          4.50    (#   1460:20  Unique         2.41, 2.75 A)
 &rst
  ixpk= 1460, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 725, 726,
 &end
#
#   48 GLN  HB-          48 GLN  HA          3.50    (#   1462:20  Unique         2.41, 2.75 A)
 &rst
  ixpk= 1462, nxpk= 20, iat=  -1, 723, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 725, 726,
 &end
#
#  113 MET  HN          114 GLN  HB+         5.50    (#   1464:20  Unique         3.95, 5.56 A)
 &rst
  ixpk= 1464, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1859,1860,
 &end
#
#    0 AMB  20-2:1465     0 AMB  20-1:1465   5.50    (#   1465:20  Double Ambig)
 &rst
  ixpk= 1465, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 685, 706,
 igr2= 725, 726, 725, 726,
 &end
#
#   49 ALA  HN           48 GLN  HB+         5.50    (#   1466:20  Unique         2.30, 3.20 A)
 &rst
  ixpk= 1466, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 725, 726,
 &end
#
#  114 GLN  HN          114 GLN  HB+         5.50    (#   1467:20  Unique         2.24, 3.21 A)
 &rst
  ixpk= 1467, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1859,1860,
 &end
#
#    0 AMB  20-2:1468     0 AMB  20-1:1468   5.50    (#   1468:20  Double Ambig)
 &rst
  ixpk= 1468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1872,1908,
 igr2=1859,1860,1859,1860,
 &end
#
#   48 GLN  HN           48 GLN  HB+         5.50    (#   1469:20  Unique         2.30, 3.07 A)
 &rst
  ixpk= 1469, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 725, 726,
 &end
#
#  114 GLN  HE2+        114 GLN  HB+         5.50    (#   1470:20  Unique         1.92, 3.74 A)
 &rst
  ixpk= 1470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1867,1868,
 igr2=1859,1860,
 &end
#
#  114 GLN  HA          114 GLN  HB+         4.50    (#   1471:20  Unique         2.23, 2.70 A)
 &rst
  ixpk= 1471, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1859,1860,
 &end
#
#    0 AMB  20-2:1472     0 AMB  20-1:1472   5.50    (#   1472:20  Double Ambig)
 &rst
  ixpk= 1472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 723, 689, 690,
 igr2= 725, 726, 725, 726,
 &end
#
#    0 AMB  20-2:1473     0 AMB  20-1:1473   3.50    (#   1473:20  Double Ambig)
 &rst
  ixpk= 1473, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 728, 729, 728, 729,
 igr2= 725, 726, 725, 726,
 &end
#
#    0 AMB  20-2:1475     0 AMB  20-1:1475   5.50    (#   1475:20  Double Ambig)
 &rst
  ixpk= 1475, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1926,1927, 742, 743, 744,
 igr2=1859,1860, 725, 726,
 &end
#
#    0 AMB  20-2:1476    48 GLN  HB-         5.50    (#   1476:20  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 685, 706,
 igr2= 725, 726,
 &end
#
#   49 ALA  HN           48 GLN  HB-         5.50    (#   1477:20  Unique         2.30, 3.20 A)
 &rst
  ixpk= 1477, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 725, 726,
 &end
#
#   48 GLN  HN           48 GLN  HB-         5.50    (#   1478:20  Unique         2.30, 3.07 A)
 &rst
  ixpk= 1478, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:1479    48 GLN  HB-         5.50    (#   1479:20  Single Ambig)
 &rst
  ixpk= 1479, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 723, 689, 690,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:1480    48 GLN  HB-         3.50    (#   1480:20  Single Ambig)
 &rst
  ixpk= 1480, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 728, 729, 728, 729,
 igr2= 725, 726,
 &end
#
#    0 AMB  20-2:1481     0 AMB  20-1:1481   5.50    (#   1481:20  Double Ambig)
 &rst
  ixpk= 1481, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1=2565,2566,2567,2569,2570,2571, 622, 623, 624,1724,
      1725,1726,1728,1729,1730,
 igr2= 286, 287, 725, 726, 286, 287,
 &end
#
#    0 AMB  20-2:1482     0 AMB  20-1:1482   5.50    (#   1482:20  Double Ambig)
 &rst
  ixpk= 1482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 622, 623, 624, 162, 163, 164, 166, 167, 168,
 igr2= 725, 726, 725, 726,
 &end
#
#    0 AMB  20-2:1483     0 AMB  20-1:1483   5.50    (#   1483:20  Double Ambig)
 &rst
  ixpk= 1483, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 706, 685,
 igr2= 728, 729, 728, 729, 728, 729,
 &end
#
#   49 ALA  HN            0 AMB  20-1:1484   5.50    (#   1484:20  Single Ambig)
 &rst
  ixpk= 1484, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 728, 729, 728, 729,
 &end
#
#   48 GLN  HN            0 AMB  20-1:1485   4.50    (#   1485:20  Single Ambig)
 &rst
  ixpk= 1485, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 728, 729, 728, 729,
 &end
#
#    0 AMB  20-2:1486     0 AMB  20-1:1486   4.50    (#   1486:20  Double Ambig)
 &rst
  ixpk= 1486, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 733, 734, 733, 734,
 igr2= 728, 729, 728, 729,
 &end
#
#   48 GLN  HE2-          0 AMB  20-1:1487   4.50    (#   1487:20  Single Ambig)
 &rst
  ixpk= 1487, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 733, 734,
 igr2= 728, 729, 728, 729,
 &end
#
#   45 SER  HA            0 AMB  20-1:1488   5.50    (#   1488:20  Single Ambig)
 &rst
  ixpk= 1488, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 728, 729, 728, 729,
 &end
#
#   48 GLN  HA            0 AMB  20-1:1489   4.50    (#   1489:20  Single Ambig)
 &rst
  ixpk= 1489, nxpk= 20, iat= 723,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 728, 729, 728, 729,
 &end
#
#   48 GLN  HB-           0 AMB  20-1:1490   3.50    (#   1490:20  Single Ambig)
 &rst
  ixpk= 1490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 725, 726,
 igr2= 728, 729, 728, 729,
 &end
#
#    0 AMB  20-2:1491     0 AMB  20-1:1491   5.50    (#   1491:20  Double Ambig)
 &rst
  ixpk= 1491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1= 742, 743, 744, 700, 701, 702, 755, 756,
 igr2= 728, 729, 728, 729, 728, 729, 728, 729,
 &end
#
#  125 ARG  HN          125 ARG  HA          5.50    (#   1492:20  Unique         2.83, 2.88 A)
 &rst
  ixpk= 1492, nxpk= 20, iat=2014,2016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 ARG  HE           49 ALA  HA          5.50    (#   1493:20  Unique         1.97, 2.39 A)
 &rst
  ixpk= 1493, nxpk= 20, iat= 799, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ALA  HN           49 ALA  HA          5.50    (#   1494:20  Unique         2.75, 2.85 A)
 &rst
  ixpk= 1494, nxpk= 20, iat= 738, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1495     0 AMB  20-1:1495   5.50    (#   1495:20  Double Ambig)
 &rst
  ixpk= 1495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 748,1990,
 igr2= 740,2016,
 &end
#
#  126 TRP  HN          125 ARG  HA          4.50    (#   1496:20  Unique         2.16, 2.30 A)
 &rst
  ixpk= 1496, nxpk= 20, iat=2038,2016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1497    49 ALA  HA          5.50    (#   1497:20  Single Ambig)
 &rst
  ixpk= 1497, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 786, 765,
 &end
#
#    0 AMB  20-2:1498     0 AMB  20-1:1498   5.50    (#   1498:20  Double Ambig)
 &rst
  ixpk= 1498, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 721, 390, 380,
 igr2= 740,2016,
 &end
#
#   50 MET  HA           49 ALA  HA          5.50    (#   1502:20  Unique         4.73, 4.83 A)
 &rst
  ixpk= 1502, nxpk= 20, iat= 750, 740, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 ARG  HD-          49 ALA  HA          5.50    (#   1503:20  Unique         3.01, 4.66 A)
 &rst
  ixpk= 1503, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
#    0 AMB  20-2:1505    49 ALA  HA          5.50    (#   1505:20  Single Ambig)
 &rst
  ixpk= 1505, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 677, 678, 674, 675,
 &end
#
#   52 ARG  HB+          49 ALA  HA          5.50    (#   1506:20  Unique         1.84, 2.83 A)
 &rst
  ixpk= 1506, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 790, 791,
 &end
#
#   49 ALA  MB           49 ALA  HA          3.50    (#   1507:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1507, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 742, 743, 744,
 &end
#
#  125 ARG  HB-         125 ARG  HA          4.50    (#   1508:20  Unique         2.24, 2.64 A)
 &rst
  ixpk= 1508, nxpk= 20, iat=  -1,2016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2018,2019,
 &end
#
#  125 ARG  HB+         125 ARG  HA          4.50    (#   1509:20  Unique         2.24, 2.64 A)
 &rst
  ixpk= 1509, nxpk= 20, iat=  -1,2016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2018,2019,
 &end
#
#  125 ARG  HG-         125 ARG  HA          5.50    (#   1510:20  Unique         2.10, 3.24 A)
 &rst
  ixpk= 1510, nxpk= 20, iat=  -1,2016, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2021,2022,
 &end
#
#    0 AMB  20-2:1511    49 ALA  HA          5.50    (#   1511:20  Single Ambig)
 &rst
  ixpk= 1511, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 162, 163, 164, 166, 167, 168, 622, 623, 624,
 &end
#
#   11 VAL  MGX          49 ALA  HA          5.50    (#   1512:20  Unique         3.87, 5.44 A)
 &rst
  ixpk= 1512, nxpk= 20, iat=  -1, 740, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   41 ASN  HN           49 ALA  MB          5.50    (#   1513:20  Unique         2.12, 3.29 A)
 &rst
  ixpk= 1513, nxpk= 20, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   46 ALA  HN           49 ALA  MB          5.50    (#   1514:20  Unique         4.39, 5.70 A)
 &rst
  ixpk= 1514, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   45 SER  HN           49 ALA  MB          5.50    (#   1516:20  Unique         2.61, 5.32 A)
 &rst
  ixpk= 1516, nxpk= 20, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   50 MET  HN           49 ALA  MB          4.50    (#   1517:20  Unique         2.83, 3.75 A)
 &rst
  ixpk= 1517, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 742, 743, 744,
 &end
#
#   49 ALA  HN           49 ALA  MB          3.50    (#   1518:20  Unique         2.21, 2.91 A)
 &rst
  ixpk= 1518, nxpk= 20, iat= 738,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1519    49 ALA  MB          5.50    (#   1519:20  Single Ambig)
 &rst
  ixpk= 1519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 786, 765,
 igr2= 742, 743, 744,
 &end
#
#   48 GLN  HN           49 ALA  MB          5.50    (#   1520:20  Unique         4.41, 5.44 A)
 &rst
  ixpk= 1520, nxpk= 20, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1521    49 ALA  MB          5.50    (#   1521:20  Single Ambig)
 &rst
  ixpk= 1521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 644, 645, 733, 734,
 igr2= 742, 743, 744,
 &end
#
#   40 ILE  HN           49 ALA  MB          5.50    (#   1522:20  Unique         3.85, 5.23 A)
 &rst
  ixpk= 1522, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   74 TRP  HH2          49 ALA  MB          5.50    (#   1523:20  Unique         4.22, 5.70 A)
 &rst
  ixpk= 1523, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   10 ASN  HA           49 ALA  MB          5.50    (#   1526:20  Unique         4.29, 6.02 A)
 &rst
  ixpk= 1526, nxpk= 20, iat= 144,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   44 GLU  HA           49 ALA  MB          5.50    (#   1527:20  Unique         4.48, 6.17 A)
 &rst
  ixpk= 1527, nxpk= 20, iat= 672,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   49 ALA  HA           49 ALA  MB          2.80    (#   1528:20  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1528, nxpk= 20, iat= 740,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 742, 743, 744,
 &end
#
#   50 MET  HA           49 ALA  MB          5.50    (#   1529:20  Unique         4.01, 4.89 A)
 &rst
  ixpk= 1529, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 742, 743, 744,
 &end
#
#   44 GLU  HG+          49 ALA  MB          5.50    (#   1530:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 1530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 677, 678,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1531    49 ALA  MB          4.50    (#   1531:20  Single Ambig)
 &rst
  ixpk= 1531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 677, 678, 674, 675, 674, 675,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1532    49 ALA  MB          5.50    (#   1532:20  Single Ambig)
 &rst
  ixpk= 1532, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 752, 753, 814, 815, 816,
 igr2= 742, 743, 744,
 &end
#
#    0 AMB  20-2:1533    49 ALA  MB          2.80    (#   1533:20  Single Ambig)
 &rst
  ixpk= 1533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 622, 623, 624, 162, 163, 164, 166, 167, 168,
 igr2= 742, 743, 744,
 &end
#
#   40 ILE  HG1+         49 ALA  MB          4.50    (#   1534:20  Unique         1.98, 3.73 A)
 &rst
  ixpk= 1534, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 626, 627,
 igr2= 742, 743, 744,
 &end
#
#   11 VAL  MGX          49 ALA  MB          4.50    (#   1535:20  Unique         2.02, 4.57 A)
 &rst
  ixpk= 1535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 742, 743, 744,
 &end
#
#   50 MET  HN           50 MET  HA          5.50    (#   1536:20  Unique         2.77, 2.80 A)
 &rst
  ixpk= 1536, nxpk= 20, iat= 748, 750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1537    50 MET  HA          5.50    (#   1537:20  Single Ambig)
 &rst
  ixpk= 1537, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 765, 786,
 &end
#
#   51 TYR  HD           50 MET  HA          5.50    (#   1538:20  Unique         4.47, 6.07 A)
 &rst
  ixpk= 1538, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 773, 782,
 &end
#
#   11 VAL  HB           50 MET  HA          5.50    (#   1539:20  Unique         1.93, 2.09 A)
 &rst
  ixpk= 1539, nxpk= 20, iat= 160, 750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1540    50 MET  HA          4.50    (#   1540:20  Single Ambig)
 &rst
  ixpk= 1540, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 755, 756, 752, 753,
 &end
#
#   50 MET  HG-          50 MET  HA          4.50    (#   1541:20  Unique         2.06, 2.87 A)
 &rst
  ixpk= 1541, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 755, 756,
 &end
#
#   50 MET  HB-          50 MET  HA          4.50    (#   1542:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1542, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          50 MET  HA          5.50    (#   1543:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 1543, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          50 MET  HA          3.50    (#   1544:20  Unique         1.96, 3.17 A)
 &rst
  ixpk= 1544, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  20-2:1545    50 MET  HA          5.50    (#   1545:20  Single Ambig)
 &rst
  ixpk= 1545, nxpk= 20, iat=  -1, 750, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1604,1605, 829, 830, 831, 833, 834, 835, 185, 186,
       187,
 &end
#
#   47 GLU  HA           50 MET  HA          5.50    (#   1546:20  Unique         4.86, 5.21 A)
 &rst
  ixpk= 1546, nxpk= 20, iat= 708, 750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HN           50 MET  HB-         5.50    (#   1547:20  Unique         2.09, 2.55 A)
 &rst
  ixpk= 1547, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 752, 753,
 &end
#
#   50 MET  HN           50 MET  HB+         5.50    (#   1548:20  Unique         2.09, 2.55 A)
 &rst
  ixpk= 1548, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 752, 753,
 &end
#
#   50 MET  HA           50 MET  HB-         5.50    (#   1550:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 1550, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 752, 753,
 &end
#
#   50 MET  ME           50 MET  HB+         5.50    (#   1551:20  Unique         1.89, 3.38 A)
 &rst
  ixpk= 1551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2= 752, 753,
 &end
#
#    0 AMB  20-2:1552    50 MET  HB-         4.50    (#   1552:20  Single Ambig)
 &rst
  ixpk= 1552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 162, 163, 164, 166, 167, 168, 192, 193, 194,
 igr2= 752, 753,
 &end
#
#   50 MET  HN           50 MET  HG-         5.50    (#   1553:20  Unique         3.06, 4.43 A)
 &rst
  ixpk= 1553, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 755, 756,
 &end
#
#   50 MET  HN           50 MET  HG+         5.50    (#   1554:20  Unique         3.06, 4.43 A)
 &rst
  ixpk= 1554, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 755, 756,
 &end
#
#   51 TYR  HD           50 MET  HG+         5.50    (#   1555:20  Unique         4.14, 5.98 A)
 &rst
  ixpk= 1555, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 755, 756,
 &end
#
#   51 TYR  HD           50 MET  HG-         5.50    (#   1556:20  Unique         4.14, 5.98 A)
 &rst
  ixpk= 1556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 755, 756,
 &end
#
#   50 MET  HA           50 MET  HG+         5.50    (#   1557:20  Unique         2.06, 2.87 A)
 &rst
  ixpk= 1557, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 755, 756,
 &end
#
#   50 MET  HA           50 MET  HG-         5.50    (#   1558:20  Unique         2.06, 2.87 A)
 &rst
  ixpk= 1558, nxpk= 20, iat= 750,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1559     0 AMB  20-1:1559   5.50    (#   1559:20  Double Ambig)
 &rst
  ixpk= 1559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 752, 753, 189, 190,
 igr2= 755, 756, 755, 756,
 &end
#
#    0 AMB  20-2:1560    50 MET  HG-         5.50    (#   1560:20  Single Ambig)
 &rst
  ixpk= 1560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 752, 753, 189, 190,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1561     0 AMB  20-1:1561   4.50    (#   1561:20  Double Ambig)
 &rst
  ixpk= 1561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1= 829, 830, 831, 833, 834, 835,1604,1605,
 igr2= 755, 756, 755, 756,
 &end
#
#    0 AMB  20-2:1562    50 MET  HG-         5.50    (#   1562:20  Single Ambig)
 &rst
  ixpk= 1562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 185, 186, 187,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1563     0 AMB  20-1:1563   4.50    (#   1563:20  Double Ambig)
 &rst
  ixpk= 1563, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 192, 193, 194, 162, 163, 164, 166, 167, 168,
 igr2= 755, 756, 755, 756,
 &end
#
#    0 AMB  20-2:1564    50 MET  HG-         4.50    (#   1564:20  Single Ambig)
 &rst
  ixpk= 1564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 192, 193, 194, 759, 760, 761, 162, 163, 164, 166,
       167, 168,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1565    50 MET  HG-         5.50    (#   1565:20  Single Ambig)
 &rst
  ixpk= 1565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1644,1645,1644,1645,
 igr2= 755, 756,
 &end
#
#    0 AMB  20-2:1566     0 AMB  20-1:1566   5.50    (#   1566:20  Double Ambig)
 &rst
  ixpk= 1566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1644,1645,1644,1645,
 igr2= 755, 756, 755, 756,
 &end
#
#   50 MET  HN           50 MET  ME          4.50    (#   1568:20  Unique         3.77, 5.32 A)
 &rst
  ixpk= 1568, nxpk= 20, iat= 748,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HN           50 MET  ME          4.50    (#   1569:20  Unique         3.88, 5.59 A)
 &rst
  ixpk= 1569, nxpk= 20, iat= 765,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HD           50 MET  ME          4.50    (#   1570:20  Unique         3.69, 5.72 A)
 &rst
  ixpk= 1570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 773, 782,
 igr2= 759, 760, 761,
 &end
#
#   51 TYR  HE           50 MET  ME          4.50    (#   1571:20  Unique         2.50, 4.48 A)
 &rst
  ixpk= 1571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 775, 780,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1574    50 MET  ME          5.50    (#   1574:20  Single Ambig)
 &rst
  ixpk= 1574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1042, 767,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1575    50 MET  ME          5.50    (#   1575:20  Single Ambig)
 &rst
  ixpk= 1575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1092,1093, 750,
 igr2= 759, 760, 761,
 &end
#
#   47 GLU  HA           50 MET  ME          4.50    (#   1576:20  Unique         1.85, 3.61 A)
 &rst
  ixpk= 1576, nxpk= 20, iat= 708,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1578    50 MET  ME          4.50    (#   1578:20  Single Ambig)
 &rst
  ixpk= 1578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1644,1645,1644,1645,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1579    50 MET  ME          4.50    (#   1579:20  Single Ambig)
 &rst
  ixpk= 1579, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 713, 714, 710, 711,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1580    50 MET  ME          4.50    (#   1580:20  Single Ambig)
 &rst
  ixpk= 1580, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 713, 714,1607,1608,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1581    50 MET  ME          4.50    (#   1581:20  Single Ambig)
 &rst
  ixpk= 1581, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 710, 711,1044,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1582    50 MET  ME          2.80    (#   1582:20  Single Ambig)
 &rst
  ixpk= 1582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 752, 753,1050,1051,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1583    50 MET  ME          5.50    (#   1583:20  Single Ambig)
 &rst
  ixpk= 1583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 824, 825,1023,1024, 183,
 igr2= 759, 760, 761,
 &end
#
#   50 MET  HB-          50 MET  ME          3.50    (#   1585:20  Unique         1.89, 3.38 A)
 &rst
  ixpk= 1585, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 752, 753,
 igr2= 759, 760, 761,
 &end
#
#   67 ILE  QG2          50 MET  ME          3.50    (#   1586:20  Unique         2.59, 4.83 A)
 &rst
  ixpk= 1586, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1046,1047,1048,
 igr2= 759, 760, 761,
 &end
#
#    0 AMB  20-2:1589    67 ILE  HA          5.50    (#   1589:20  Single Ambig)
 &rst
  ixpk= 1589, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1040,1698,
 &end
#
#   68 LEU  HN           67 ILE  HA          4.50    (#   1590:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1590, nxpk= 20, iat=1059,1042, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 LEU  HN           51 TYR  HA          5.50    (#   1591:20  Unique         2.64, 2.74 A)
 &rst
  ixpk= 1591, nxpk= 20, iat= 820, 767, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1592    51 TYR  HA          5.50    (#   1592:20  Single Ambig)
 &rst
  ixpk= 1592, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 765, 786,
 &end
#
#   55 PHE  HN           51 TYR  HA          5.50    (#   1593:20  Unique         3.83, 4.48 A)
 &rst
  ixpk= 1593, nxpk= 20, iat= 839, 767, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1594     0 AMB  20-1:1594   4.50    (#   1594:20  Double Ambig)
 &rst
  ixpk= 1594, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 773, 782,1029,
 igr2= 767,1042,
 &end
#
#   51 TYR  HE            0 AMB  20-1:1595   5.50    (#   1595:20  Single Ambig)
 &rst
  ixpk= 1595, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 767,1042,
 &end
#
#  102 LEU  HA           67 ILE  HA          5.50    (#   1596:20  Unique         2.48, 2.75 A)
 &rst
  ixpk= 1596, nxpk= 20, iat=1681,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HB-          51 TYR  HA          5.50    (#   1597:20  Unique         2.36, 2.70 A)
 &rst
  ixpk= 1597, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB+          51 TYR  HA          5.50    (#   1598:20  Unique         2.36, 2.70 A)
 &rst
  ixpk= 1598, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 769, 770,
 &end
#
#   54 LEU  HB+          51 TYR  HA          5.50    (#   1599:20  Unique         1.69, 2.42 A)
 &rst
  ixpk= 1599, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 825,
 &end
#
#   54 LEU  HB-          51 TYR  HA          4.50    (#   1600:20  Unique         1.69, 2.42 A)
 &rst
  ixpk= 1600, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#    0 AMB  20-2:1601     0 AMB  20-1:1601   5.50    (#   1601:20  Double Ambig)
 &rst
  ixpk= 1601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=1063,1064, 946, 947,1082,1083,1084,
 igr2=1042, 767,
 &end
#
#    0 AMB  20-2:1602     0 AMB  20-1:1602   5.50    (#   1602:20  Double Ambig)
 &rst
  ixpk= 1602, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1683,1684, 189, 190, 752, 753, 949, 950,
 igr2=1042, 767,
 &end
#
#   67 ILE  HB           67 ILE  HA          5.50    (#   1603:20  Unique         2.95, 3.01 A)
 &rst
  ixpk= 1603, nxpk= 20, iat=1044,1042, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1604     0 AMB  20-1:1604   3.50    (#   1604:20  Double Ambig)
 &rst
  ixpk= 1604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1688,1689,1690,1692,1693,1694, 829, 830, 831, 833,
       834, 835,
 igr2=1042, 767,
 &end
#
#   67 ILE  QG2          67 ILE  HA          4.50    (#   1605:20  Unique         2.10, 2.98 A)
 &rst
  ixpk= 1605, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1046,1047,1048,
 &end
#
#   13 ILE  QD1          51 TYR  HA          4.50    (#   1606:20  Unique         2.32, 3.77 A)
 &rst
  ixpk= 1606, nxpk= 20, iat=  -1, 767, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 192, 193, 194,
 &end
#
#    0 AMB  20-2:1607     0 AMB  20-1:1607   5.50    (#   1607:20  Double Ambig)
 &rst
  ixpk= 1607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 765, 786,
 igr2= 769, 770, 769, 770,
 &end
#
#    0 AMB  20-2:1608    51 TYR  HB-         5.50    (#   1608:20  Single Ambig)
 &rst
  ixpk= 1608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 765, 786,
 igr2= 769, 770,
 &end
#
#    0 AMB  20-2:1609     0 AMB  20-1:1609   5.50    (#   1609:20  Double Ambig)
 &rst
  ixpk= 1609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 773, 782, 847, 855,
 igr2= 769, 770, 769, 770,
 &end
#
#    0 AMB  20-2:1610    51 TYR  HB-         5.50    (#   1610:20  Single Ambig)
 &rst
  ixpk= 1610, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 773, 782, 847, 855,
 igr2= 769, 770,
 &end
#
#   51 TYR  HE           51 TYR  HB+         5.50    (#   1611:20  Unique         4.61, 5.05 A)
 &rst
  ixpk= 1611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 769, 770,
 &end
#
#   51 TYR  HE           51 TYR  HB-         5.50    (#   1612:20  Unique         4.61, 5.05 A)
 &rst
  ixpk= 1612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 769, 770,
 &end
#
#   51 TYR  HA           51 TYR  HB+         5.50    (#   1613:20  Unique         2.36, 2.70 A)
 &rst
  ixpk= 1613, nxpk= 20, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 769, 770,
 &end
#
#   51 TYR  HA           51 TYR  HB-         5.50    (#   1614:20  Unique         2.36, 2.70 A)
 &rst
  ixpk= 1614, nxpk= 20, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 769, 770,
 &end
#
#   84 VAL  MGX          93 ILE  HA          5.50    (#   1615:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 1615, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:1616    93 ILE  HA          5.50    (#   1616:20  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1522,1523,1525,1526,1527,
 &end
#
#   84 VAL  MGY          93 ILE  HA          4.50    (#   1617:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 1617, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   93 ILE  QG2          93 ILE  HA          3.50    (#   1618:20  Unique         2.19, 3.12 A)
 &rst
  ixpk= 1618, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1518,1519,1520,
 &end
#
#    0 AMB  20-2:1619     0 AMB  20-1:1619   5.50    (#   1619:20  Double Ambig)
 &rst
  ixpk= 1619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1491,1492,1493,1495,1496,1497,1914,1915,1916,
 igr2=1514,1899,
 &end
#
#   79 LEU  HB+          93 ILE  HA          5.50    (#   1620:20  Unique         2.66, 5.40 A)
 &rst
  ixpk= 1620, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   52 ARG  HG-          52 ARG  HA          4.50    (#   1621:20  Unique         2.27, 3.24 A)
 &rst
  ixpk= 1621, nxpk= 20, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 793, 794,
 &end
#
#   93 ILE  HB           93 ILE  HA          3.50    (#   1622:20  Unique         2.30, 2.42 A)
 &rst
  ixpk= 1622, nxpk= 20, iat=1516,1514, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   52 ARG  HB+          52 ARG  HA          4.50    (#   1623:20  Unique         2.56, 2.81 A)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 790, 791,
 &end
#
#    0 AMB  20-2:1624     0 AMB  20-1:1624   5.50    (#   1624:20  Double Ambig)
 &rst
  ixpk= 1624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 769, 770,1505,1506, 866, 867, 952, 953,
 igr2= 788,1514,
 &end
#
#  119 PRO  HD-         117 SER  HA          5.50    (#   1625:20  Unique         3.61, 4.44 A)
 &rst
  ixpk= 1625, nxpk= 20, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#   52 ARG  HD-          52 ARG  HA          5.50    (#   1626:20  Unique         1.96, 2.96 A)
 &rst
  ixpk= 1626, nxpk= 20, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
#  119 PRO  HD+         117 SER  HA          5.50    (#   1627:20  Unique         3.61, 4.44 A)
 &rst
  ixpk= 1627, nxpk= 20, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#   52 ARG  HD+          52 ARG  HA          5.50    (#   1628:20  Unique         1.96, 2.96 A)
 &rst
  ixpk= 1628, nxpk= 20, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
#    0 AMB  20-2:1629     0 AMB  20-1:1629   5.50    (#   1629:20  Double Ambig)
 &rst
  ixpk= 1629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1857,1241,
 igr2=1899,1514,
 &end
#
#   55 PHE  HD           52 ARG  HA          5.50    (#   1630:20  Unique         2.98, 5.11 A)
 &rst
  ixpk= 1630, nxpk= 20, iat=  -1, 788, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   94 GLY  HN           93 ILE  HA          5.50    (#   1631:20  Unique         2.91, 3.18 A)
 &rst
  ixpk= 1631, nxpk= 20, iat=1531,1514, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 ARG  HN           52 ARG  HA          5.50    (#   1632:20  Unique         2.70, 2.74 A)
 &rst
  ixpk= 1632, nxpk= 20, iat= 786, 788, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  118 THR  HN          117 SER  HA          5.50    (#   1633:20  Unique         3.57, 3.57 A)
 &rst
  ixpk= 1633, nxpk= 20, iat=1908,1899, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 ALA  HN           52 ARG  HA          5.50    (#   1634:20  Unique         3.48, 3.52 A)
 &rst
  ixpk= 1634, nxpk= 20, iat= 810, 788, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 SER  HN          117 SER  HA          4.50    (#   1635:20  Unique         2.29, 2.29 A)
 &rst
  ixpk= 1635, nxpk= 20, iat=1897,1899, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   93 ILE  HN           93 ILE  HA          5.50    (#   1636:20  Unique         2.81, 2.91 A)
 &rst
  ixpk= 1636, nxpk= 20, iat=1512,1514, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1637     0 AMB  20-1:1637   4.50    (#   1637:20  Double Ambig)
 &rst
  ixpk= 1637, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 786,2639,
 igr2= 790, 791,2626,2627,
 &end
#
#    0 AMB  20-2:1638     0 AMB  20-1:1638   4.50    (#   1638:20  Double Ambig)
 &rst
  ixpk= 1638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 786, 258,
 igr2= 790, 791, 262, 263,
 &end
#
#   52 ARG  HN           52 ARG  HG+         5.50    (#   1639:20  Unique         4.31, 4.54 A)
 &rst
  ixpk= 1639, nxpk= 20, iat= 786,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 793, 794,
 &end
#
#  116 SER  HN          119 PRO  HG-         5.50    (#   1640:20  Unique         2.54, 4.10 A)
 &rst
  ixpk= 1640, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1926,1927,
 &end
#
#   52 ARG  HA           52 ARG  HG+         5.50    (#   1641:20  Unique         2.27, 3.24 A)
 &rst
  ixpk= 1641, nxpk= 20, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 793, 794,
 &end
#
#   52 ARG  HA           52 ARG  HG-         5.50    (#   1642:20  Unique         2.27, 3.24 A)
 &rst
  ixpk= 1642, nxpk= 20, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 793, 794,
 &end
#
#   52 ARG  HD+          52 ARG  HG-         5.50    (#   1643:20  Unique         2.30, 2.56 A)
 &rst
  ixpk= 1643, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 796, 797,
 igr2= 793, 794,
 &end
#
#    0 AMB  20-2:1644     0 AMB  20-1:1644   5.50    (#   1644:20  Double Ambig)
 &rst
  ixpk= 1644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.64, r4=12.14,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,  34,  35,  36,
 igr2=1323,1324,1323,1324, 111, 112,
 &end
#
#   79 LEU  MDX           8 ARG  HG-         5.50    (#   1645:20  Unique         4.33, 8.06 A)
 &rst
  ixpk= 1645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2= 111, 112,
 &end
#
#   52 ARG  HE           52 ARG  HD+         5.50    (#   1646:20  Unique         2.30, 2.78 A)
 &rst
  ixpk= 1646, nxpk= 20, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 796, 797,
 &end
#
#   52 ARG  HE           52 ARG  HD-         5.50    (#   1647:20  Unique         2.30, 2.78 A)
 &rst
  ixpk= 1647, nxpk= 20, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 796, 797,
 &end
#
#   62 ARG  HE           52 ARG  HD-         5.50    (#   1649:20  Unique         6.01, 7.30 A)
 &rst
  ixpk= 1649, nxpk= 20, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 796, 797,
 &end
#
#   52 ARG  HA           52 ARG  HD+         5.50    (#   1650:20  Unique         1.96, 2.96 A)
 &rst
  ixpk= 1650, nxpk= 20, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 796, 797,
 &end
#
#   52 ARG  HA           52 ARG  HD-         5.50    (#   1651:20  Unique         1.96, 2.96 A)
 &rst
  ixpk= 1651, nxpk= 20, iat= 788,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 796, 797,
 &end
#
#   52 ARG  HB+          52 ARG  HD+         5.50    (#   1652:20  Unique         2.47, 3.70 A)
 &rst
  ixpk= 1652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791,
 igr2= 796, 797,
 &end
#
#   52 ARG  HB+          52 ARG  HD-         5.50    (#   1653:20  Unique         2.47, 3.70 A)
 &rst
  ixpk= 1653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791,
 igr2= 796, 797,
 &end
#
#   52 ARG  HB-          52 ARG  HD+         5.50    (#   1654:20  Unique         2.47, 3.70 A)
 &rst
  ixpk= 1654, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791,
 igr2= 796, 797,
 &end
#
#   52 ARG  HG-          52 ARG  HD+         5.50    (#   1655:20  Unique         2.30, 2.56 A)
 &rst
  ixpk= 1655, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 793, 794,
 igr2= 796, 797,
 &end
#
#    0 AMB  20-2:1656     0 AMB  20-1:1656   5.50    (#   1656:20  Double Ambig)
 &rst
  ixpk= 1656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 418, 419,1943,1944,
 igr2= 424, 425, 424, 425,
 &end
#
#   54 LEU  HN           53 ALA  HA          5.50    (#   1658:20  Unique         3.32, 3.39 A)
 &rst
  ixpk= 1658, nxpk= 20, iat= 820, 812, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   53 ALA  HN           53 ALA  HA          5.50    (#   1659:20  Unique         2.85, 2.92 A)
 &rst
  ixpk= 1659, nxpk= 20, iat= 810, 812, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 GLU  HG+          53 ALA  HA          5.50    (#   1661:20  Unique         1.97, 3.48 A)
 &rst
  ixpk= 1661, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 866, 867,
 &end
#
#   57 GLU  HG+          53 ALA  HA          5.50    (#   1662:20  Unique         3.78, 4.85 A)
 &rst
  ixpk= 1662, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   56 GLU  HG-          53 ALA  HA          5.50    (#   1663:20  Unique         1.97, 3.48 A)
 &rst
  ixpk= 1663, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 866, 867,
 &end
#
#   56 GLU  HB-          53 ALA  HA          5.50    (#   1664:20  Unique         2.03, 3.40 A)
 &rst
  ixpk= 1664, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 863, 864,
 &end
#
#   53 ALA  MB           53 ALA  HA          3.50    (#   1666:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1666, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1667    53 ALA  HA          5.50    (#   1667:20  Single Ambig)
 &rst
  ixpk= 1667, nxpk= 20, iat=  -1, 812, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 189, 190, 192, 193, 194, 162, 163, 164, 166, 167,
       168,
 &end
#
#   11 VAL  HN           53 ALA  MB          5.50    (#   1668:20  Unique         4.64, 5.86 A)
 &rst
  ixpk= 1668, nxpk= 20, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 814, 815, 816,
 &end
#
#   38 GLY  HN           53 ALA  MB          5.50    (#   1669:20  Unique         3.68, 4.69 A)
 &rst
  ixpk= 1669, nxpk= 20, iat= 602,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 814, 815, 816,
 &end
#
#   54 LEU  HN           53 ALA  MB          4.50    (#   1670:20  Unique         3.14, 3.87 A)
 &rst
  ixpk= 1670, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 814, 815, 816,
 &end
#
#   57 GLU  HN           53 ALA  MB          5.50    (#   1671:20  Unique         4.33, 5.49 A)
 &rst
  ixpk= 1671, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 814, 815, 816,
 &end
#
#   39 GLY  HN           53 ALA  MB          5.50    (#   1672:20  Unique         3.80, 5.21 A)
 &rst
  ixpk= 1672, nxpk= 20, iat= 609,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 814, 815, 816,
 &end
#
#   53 ALA  HN           53 ALA  MB          3.50    (#   1673:20  Unique         2.08, 2.99 A)
 &rst
  ixpk= 1673, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1674    53 ALA  MB          5.50    (#   1674:20  Single Ambig)
 &rst
  ixpk= 1674, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 786, 765,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1675    53 ALA  MB          5.50    (#   1675:20  Single Ambig)
 &rst
  ixpk= 1675, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 179, 839,
 igr2= 814, 815, 816,
 &end
#
#   38 GLY  HA+          53 ALA  MB          5.50    (#   1676:20  Unique         1.99, 3.00 A)
 &rst
  ixpk= 1676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 604, 605,
 igr2= 814, 815, 816,
 &end
#
#   53 ALA  HA           53 ALA  MB          3.50    (#   1677:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1677, nxpk= 20, iat= 812,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 814, 815, 816,
 &end
#
#   38 GLY  HA-          53 ALA  MB          4.50    (#   1678:20  Unique         1.99, 3.00 A)
 &rst
  ixpk= 1678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 604, 605,
 igr2= 814, 815, 816,
 &end
#
#   54 LEU  HA           53 ALA  MB          5.50    (#   1679:20  Unique         3.93, 4.95 A)
 &rst
  ixpk= 1679, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1680    53 ALA  MB          5.50    (#   1680:20  Single Ambig)
 &rst
  ixpk= 1680, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 750, 843, 844,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1681    53 ALA  MB          5.50    (#   1681:20  Single Ambig)
 &rst
  ixpk= 1681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 863, 864, 878, 879,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1682    53 ALA  MB          5.50    (#   1682:20  Single Ambig)
 &rst
  ixpk= 1682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 863, 864, 790, 791,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1683    53 ALA  MB          4.50    (#   1683:20  Single Ambig)
 &rst
  ixpk= 1683, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1943,1944, 793, 794, 755, 756,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1684    53 ALA  MB          3.50    (#   1684:20  Single Ambig)
 &rst
  ixpk= 1684, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 189, 190, 162, 163, 164, 166, 167, 168,
 igr2= 814, 815, 816,
 &end
#
#    0 AMB  20-2:1685    53 ALA  MB          5.50    (#   1685:20  Single Ambig)
 &rst
  ixpk= 1685, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.85, r4=10.35,
 igr1= 185, 186, 187, 829, 830, 831, 833, 834, 835, 174,
       175,
 igr2= 814, 815, 816,
 &end
#
#   54 LEU  HN           54 LEU  HA          5.50    (#   1686:20  Unique         2.72, 2.77 A)
 &rst
  ixpk= 1686, nxpk= 20, iat= 820, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HN           54 LEU  HA          5.50    (#   1687:20  Unique         3.16, 3.51 A)
 &rst
  ixpk= 1687, nxpk= 20, iat= 874, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HN           54 LEU  HA          5.50    (#   1688:20  Unique         3.47, 3.54 A)
 &rst
  ixpk= 1688, nxpk= 20, iat= 839, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 VAL  HN           54 LEU  HA          5.50    (#   1689:20  Unique         3.39, 3.79 A)
 &rst
  ixpk= 1689, nxpk= 20, iat= 889, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HA           54 LEU  HA          5.50    (#   1690:20  Unique         4.00, 4.17 A)
 &rst
  ixpk= 1690, nxpk= 20, iat= 767, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HB+          54 LEU  HA          5.50    (#   1691:20  Unique         1.96, 3.42 A)
 &rst
  ixpk= 1691, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 878, 879,
 &end
#
#   54 LEU  HB+          54 LEU  HA          5.50    (#   1692:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1692, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 825,
 &end
#
#    0 AMB  20-2:1693    54 LEU  HA          5.50    (#   1693:20  Single Ambig)
 &rst
  ixpk= 1693, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 827, 224, 225,
 &end
#
#   54 LEU  HB-          54 LEU  HA          5.50    (#   1694:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1694, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 825,
 &end
#
#   13 ILE  HG1-         54 LEU  HA          5.50    (#   1695:20  Unique         2.05, 3.70 A)
 &rst
  ixpk= 1695, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 189, 190,
 &end
#
#    0 AMB  20-2:1696    54 LEU  HA          3.50    (#   1696:20  Single Ambig)
 &rst
  ixpk= 1696, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 185, 186, 187,
 &end
#
#    0 AMB  20-2:1697    54 LEU  HA          5.50    (#   1697:20  Single Ambig)
 &rst
  ixpk= 1697, nxpk= 20, iat=  -1, 822, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 189, 190, 192, 193, 194,
 &end
#
#   54 LEU  HN           54 LEU  HB+         5.50    (#   1698:20  Unique         2.04, 2.55 A)
 &rst
  ixpk= 1698, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   54 LEU  HN           54 LEU  HB-         5.50    (#   1699:20  Unique         2.04, 2.55 A)
 &rst
  ixpk= 1699, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   55 PHE  HN           54 LEU  HB+         5.50    (#   1700:20  Unique         1.96, 3.00 A)
 &rst
  ixpk= 1700, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   55 PHE  HN           54 LEU  HB-         5.50    (#   1701:20  Unique         1.96, 3.00 A)
 &rst
  ixpk= 1701, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   51 TYR  HA           54 LEU  HB+         5.50    (#   1702:20  Unique         1.69, 2.42 A)
 &rst
  ixpk= 1702, nxpk= 20, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   51 TYR  HA           54 LEU  HB-         5.50    (#   1703:20  Unique         1.69, 2.42 A)
 &rst
  ixpk= 1703, nxpk= 20, iat= 767,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   54 LEU  HA           54 LEU  HB+         5.50    (#   1704:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1704, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   54 LEU  HA           54 LEU  HB-         5.50    (#   1705:20  Unique         2.26, 2.77 A)
 &rst
  ixpk= 1705, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#   54 LEU  HG           54 LEU  HB+         5.50    (#   1706:20  Unique         2.27, 2.55 A)
 &rst
  ixpk= 1706, nxpk= 20, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 824, 825,
 &end
#
#    0 AMB  20-2:1707     0 AMB  20-1:1707   4.50    (#   1707:20  Double Ambig)
 &rst
  ixpk= 1707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 829, 830, 831, 833, 834, 835, 185, 186, 187,
 igr2= 824, 825, 824, 825,
 &end
#
#    0 AMB  20-2:1708    54 LEU  HB-         3.50    (#   1708:20  Single Ambig)
 &rst
  ixpk= 1708, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 185, 186, 187,
 igr2= 824, 825,
 &end
#
#    0 AMB  20-2:1709     0 AMB  20-1:1709   5.50    (#   1709:20  Double Ambig)
 &rst
  ixpk= 1709, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 192, 193, 194, 189, 190,
 igr2= 824, 825, 824, 825,
 &end
#
#    0 AMB  20-2:1710    54 LEU  HB-         4.50    (#   1710:20  Single Ambig)
 &rst
  ixpk= 1710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 192, 193, 194, 189, 190,
 igr2= 824, 825,
 &end
#
#   54 LEU  HN           54 LEU  HG          5.50    (#   1711:20  Unique         4.13, 4.51 A)
 &rst
  ixpk= 1711, nxpk= 20, iat= 820, 827, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1712    54 LEU  HG          4.50    (#   1712:20  Single Ambig)
 &rst
  ixpk= 1712, nxpk= 20, iat=  -1, 827, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835,
 &end
#
#   54 LEU  HN           54 LEU  MDX         5.50    (#   1713:20  Unique         3.02, 4.88 A)
 &rst
  ixpk= 1713, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   55 PHE  HN           54 LEU  MDX         5.50    (#   1714:20  Unique         2.09, 5.19 A)
 &rst
  ixpk= 1714, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   51 TYR  HD           54 LEU  MDX         5.50    (#   1715:20  Unique         1.98, 5.94 A)
 &rst
  ixpk= 1715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 773, 782,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   51 TYR  HE           54 LEU  MDX         5.50    (#   1716:20  Unique         3.40, 7.19 A)
 &rst
  ixpk= 1716, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 775, 780,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   60 LEU  HN           54 LEU  MDX         5.50    (#   1717:20  Unique         1.83, 4.89 A)
 &rst
  ixpk= 1717, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1718     0 AMB  20-1:1718   5.50    (#   1718:20  Double Ambig)
 &rst
  ixpk= 1718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1241, 914, 181,
 igr2=1522,1523, 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1719     0 AMB  20-1:1719   5.50    (#   1719:20  Double Ambig)
 &rst
  ixpk= 1719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=  78,  79, 767,
 igr2=1522,1523, 829, 830, 831, 833, 834, 835,
 &end
#
#   54 LEU  HA           54 LEU  MDX         5.50    (#   1720:20  Unique         1.98, 3.40 A)
 &rst
  ixpk= 1720, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1721     0 AMB  20-1:1721   5.50    (#   1721:20  Double Ambig)
 &rst
  ixpk= 1721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1= 769, 770,  68,  69,
 igr2= 829, 830, 831, 833, 834, 835,1522,1523,
 &end
#
#    0 AMB  20-2:1722    54 LEU  MDX         5.50    (#   1722:20  Single Ambig)
 &rst
  ixpk= 1722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 824, 825,1004,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1723    54 LEU  MDX         3.50    (#   1723:20  Single Ambig)
 &rst
  ixpk= 1723, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 827, 224, 225,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1724    54 LEU  MDX         3.50    (#   1724:20  Single Ambig)
 &rst
  ixpk= 1724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1686, 824, 825,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   60 LEU  HB-          54 LEU  MDX         5.50    (#   1725:20  Unique         1.98, 4.60 A)
 &rst
  ixpk= 1725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 916, 917,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   13 ILE  HG1-         54 LEU  MDX         5.50    (#   1726:20  Unique         2.24, 5.50 A)
 &rst
  ixpk= 1726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 189, 190,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   54 LEU  HN           54 LEU  MDY         5.50    (#   1727:20  Unique         3.02, 4.88 A)
 &rst
  ixpk= 1727, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   55 PHE  HN           54 LEU  MDY         5.50    (#   1728:20  Unique         2.09, 5.19 A)
 &rst
  ixpk= 1728, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   60 LEU  HN           54 LEU  MDY         5.50    (#   1729:20  Unique         1.83, 4.89 A)
 &rst
  ixpk= 1729, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   54 LEU  HA           54 LEU  MDY         4.50    (#   1730:20  Unique         1.98, 3.40 A)
 &rst
  ixpk= 1730, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1731    54 LEU  MDY         5.50    (#   1731:20  Single Ambig)
 &rst
  ixpk= 1731, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 878, 879, 893,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1732    54 LEU  MDY         5.50    (#   1732:20  Single Ambig)
 &rst
  ixpk= 1732, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 824, 825,1004,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1733    54 LEU  MDY         5.50    (#   1733:20  Single Ambig)
 &rst
  ixpk= 1733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 160,1849,1850,1851,1794,1795,1702,1703,1842,1843,
      1842,1843,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1734    54 LEU  MDY         3.50    (#   1734:20  Single Ambig)
 &rst
  ixpk= 1734, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1686, 824, 825,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1735    54 LEU  MDY         3.50    (#   1735:20  Single Ambig)
 &rst
  ixpk= 1735, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 827, 224, 225,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1736    54 LEU  MDY         3.50    (#   1736:20  Single Ambig)
 &rst
  ixpk= 1736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.57, r4= 8.07,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927, 192, 193, 194, 189, 190,
 igr2= 829, 830, 831, 833, 834, 835,
 &end
#
#   56 GLU  HN           55 PHE  HA          5.50    (#   1737:20  Unique         3.35, 3.45 A)
 &rst
  ixpk= 1737, nxpk= 20, iat= 859, 841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HN           55 PHE  HA          5.50    (#   1738:20  Unique         2.77, 2.83 A)
 &rst
  ixpk= 1738, nxpk= 20, iat= 839, 841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HN           55 PHE  HA          5.50    (#   1739:20  Unique         2.00, 2.62 A)
 &rst
  ixpk= 1739, nxpk= 20, iat= 905, 841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HD           55 PHE  HA          5.50    (#   1741:20  Unique         2.48, 3.94 A)
 &rst
  ixpk= 1741, nxpk= 20, iat=  -1, 841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   60 LEU  HN           55 PHE  HA          5.50    (#   1742:20  Unique         1.97, 2.51 A)
 &rst
  ixpk= 1742, nxpk= 20, iat= 912, 841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HA-          55 PHE  HA          5.50    (#   1743:20  Unique         1.99, 3.02 A)
 &rst
  ixpk= 1743, nxpk= 20, iat=  -1, 841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#   55 PHE  HB+          55 PHE  HA          5.50    (#   1744:20  Unique         2.23, 2.55 A)
 &rst
  ixpk= 1744, nxpk= 20, iat=  -1, 841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 843, 844,
 &end
#
#   55 PHE  HB-          55 PHE  HA          5.50    (#   1745:20  Unique         2.23, 2.55 A)
 &rst
  ixpk= 1745, nxpk= 20, iat=  -1, 841, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 843, 844,
 &end
#
#   60 LEU  HG           55 PHE  HA          5.50    (#   1746:20  Unique         3.80, 5.02 A)
 &rst
  ixpk= 1746, nxpk= 20, iat= 919, 841, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1747    55 PHE  HA          5.50    (#   1747:20  Single Ambig)
 &rst
  ixpk= 1747, nxpk= 20, iat=  -1, 841, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901,
 &end
#
#   55 PHE  HA           55 PHE  HB-         5.50    (#   1748:20  Unique         2.23, 2.55 A)
 &rst
  ixpk= 1748, nxpk= 20, iat= 841,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   55 PHE  HA           55 PHE  HB+         5.50    (#   1749:20  Unique         2.23, 2.55 A)
 &rst
  ixpk= 1749, nxpk= 20, iat= 841,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   55 PHE  HD           55 PHE  HB+         5.50    (#   1750:20  Unique         2.29, 3.04 A)
 &rst
  ixpk= 1750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 843, 844,
 &end
#
#   55 PHE  HD           55 PHE  HB-         5.50    (#   1751:20  Unique         2.29, 3.04 A)
 &rst
  ixpk= 1751, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 843, 844,
 &end
#
#   55 PHE  HN           55 PHE  HB-         5.50    (#   1752:20  Unique         2.07, 3.09 A)
 &rst
  ixpk= 1752, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   55 PHE  HN           55 PHE  HB+         5.50    (#   1753:20  Unique         2.07, 3.09 A)
 &rst
  ixpk= 1753, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   56 GLU  HN           55 PHE  HB-         5.50    (#   1754:20  Unique         2.41, 3.78 A)
 &rst
  ixpk= 1754, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   56 GLU  HN           55 PHE  HB+         5.50    (#   1755:20  Unique         2.41, 3.78 A)
 &rst
  ixpk= 1755, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 843, 844,
 &end
#
#   56 GLU  HN           56 GLU  HA          4.50    (#   1756:20  Unique         2.85, 2.90 A)
 &rst
  ixpk= 1756, nxpk= 20, iat= 859, 861, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1757     0 AMB  20-1:1757   5.50    (#   1757:20  Double Ambig)
 &rst
  ixpk= 1757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 839, 390,
 igr2= 861, 440,
 &end
#
#   55 PHE  HD           56 GLU  HA          5.50    (#   1758:20  Unique         2.99, 5.48 A)
 &rst
  ixpk= 1758, nxpk= 20, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   56 GLU  HG+          56 GLU  HA          5.50    (#   1759:20  Unique         2.22, 3.18 A)
 &rst
  ixpk= 1759, nxpk= 20, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 866, 867,
 &end
#
#   56 GLU  HG-          56 GLU  HA          4.50    (#   1760:20  Unique         2.22, 3.18 A)
 &rst
  ixpk= 1760, nxpk= 20, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 866, 867,
 &end
#
#   56 GLU  HB+          56 GLU  HA          5.50    (#   1761:20  Unique         2.27, 2.72 A)
 &rst
  ixpk= 1761, nxpk= 20, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 863, 864,
 &end
#
#   56 GLU  HB-          56 GLU  HA          4.50    (#   1762:20  Unique         2.27, 2.72 A)
 &rst
  ixpk= 1762, nxpk= 20, iat=  -1, 861, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 863, 864,
 &end
#
#   46 ALA  HN           47 GLU  HB+         5.50    (#   1764:20  Unique         4.22, 4.76 A)
 &rst
  ixpk= 1764, nxpk= 20, iat= 696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 710, 711,
 &end
#
#   56 GLU  HN           56 GLU  HB+         5.50    (#   1765:20  Unique         2.20, 3.09 A)
 &rst
  ixpk= 1765, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 864,
 &end
#
#   56 GLU  HN           56 GLU  HB-         5.50    (#   1766:20  Unique         2.20, 3.09 A)
 &rst
  ixpk= 1766, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 864,
 &end
#
#   56 GLU  HA           56 GLU  HB-         5.50    (#   1767:20  Unique         2.27, 2.72 A)
 &rst
  ixpk= 1767, nxpk= 20, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 864,
 &end
#
#   56 GLU  HG+          56 GLU  HB-         5.50    (#   1768:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867,
 igr2= 863, 864,
 &end
#
#   56 GLU  HG-          56 GLU  HB+         4.50    (#   1769:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 866, 867,
 igr2= 863, 864,
 &end
#
#   56 GLU  HG-          56 GLU  HB-         5.50    (#   1770:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1770, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867,
 igr2= 863, 864,
 &end
#
#   56 GLU  HN           56 GLU  HG+         4.50    (#   1771:20  Unique         1.96, 2.98 A)
 &rst
  ixpk= 1771, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 866, 867,
 &end
#
#   56 GLU  HN           56 GLU  HG-         5.50    (#   1772:20  Unique         1.96, 2.98 A)
 &rst
  ixpk= 1772, nxpk= 20, iat= 859,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   55 PHE  HN           56 GLU  HG+         5.50    (#   1773:20  Unique         3.47, 4.82 A)
 &rst
  ixpk= 1773, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   55 PHE  HN           56 GLU  HG-         5.50    (#   1774:20  Unique         3.47, 4.82 A)
 &rst
  ixpk= 1774, nxpk= 20, iat= 839,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   55 PHE  HD           56 GLU  HG+         5.50    (#   1775:20  Unique         1.98, 4.84 A)
 &rst
  ixpk= 1775, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 866, 867,
 &end
#
#   55 PHE  HD           56 GLU  HG-         5.50    (#   1776:20  Unique         1.98, 4.84 A)
 &rst
  ixpk= 1776, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 866, 867,
 &end
#
#    0 AMB  20-2:1777     0 AMB  20-1:1777   5.50    (#   1777:20  Double Ambig)
 &rst
  ixpk= 1777, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 788, 841,
 igr2= 866, 867, 866, 867,
 &end
#
#   53 ALA  HA           56 GLU  HG+         5.50    (#   1778:20  Unique         1.97, 3.48 A)
 &rst
  ixpk= 1778, nxpk= 20, iat= 812,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   53 ALA  HA           56 GLU  HG-         5.50    (#   1779:20  Unique         1.97, 3.48 A)
 &rst
  ixpk= 1779, nxpk= 20, iat= 812,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   56 GLU  HA           56 GLU  HG+         5.50    (#   1780:20  Unique         2.22, 3.18 A)
 &rst
  ixpk= 1780, nxpk= 20, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 866, 867,
 &end
#
#   56 GLU  HA           56 GLU  HG-         4.50    (#   1781:20  Unique         2.22, 3.18 A)
 &rst
  ixpk= 1781, nxpk= 20, iat= 861,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 866, 867,
 &end
#
#   52 ARG  HD+          56 GLU  HG+         5.50    (#   1782:20  Unique         4.40, 6.84 A)
 &rst
  ixpk= 1782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 796, 797,
 igr2= 866, 867,
 &end
#
#   55 PHE  HB-          56 GLU  HG+         5.50    (#   1783:20  Unique         2.78, 5.01 A)
 &rst
  ixpk= 1783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 843, 844,
 igr2= 866, 867,
 &end
#
#   56 GLU  HB+          56 GLU  HG+         5.50    (#   1784:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864,
 igr2= 866, 867,
 &end
#
#   56 GLU  HB-          56 GLU  HG+         5.50    (#   1785:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864,
 igr2= 866, 867,
 &end
#
#   56 GLU  HB-          56 GLU  HG-         4.50    (#   1786:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 863, 864,
 igr2= 866, 867,
 &end
#
#   56 GLU  HB+          56 GLU  HG-         2.80    (#   1787:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 863, 864,
 igr2= 866, 867,
 &end
#
#    0 AMB  20-2:1788     0 AMB  20-1:1788   5.50    (#   1788:20  Double Ambig)
 &rst
  ixpk= 1788, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 793, 794,1926,1927,
 igr2= 866, 867, 866, 867,
 &end
#
#    0 AMB  20-2:1789    56 GLU  HG-         5.50    (#   1789:20  Single Ambig)
 &rst
  ixpk= 1789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1943,1944, 793, 794,1926,1927,
 igr2= 866, 867,
 &end
#
#   57 GLU  HN           57 GLU  HA          5.50    (#   1790:20  Unique         2.87, 2.93 A)
 &rst
  ixpk= 1790, nxpk= 20, iat= 874, 876, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HG+          57 GLU  HA          5.50    (#   1791:20  Unique         2.13, 3.03 A)
 &rst
  ixpk= 1791, nxpk= 20, iat=  -1, 876, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   58 VAL  HN           57 GLU  HB+         5.50    (#   1793:20  Unique         2.39, 2.95 A)
 &rst
  ixpk= 1793, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 878, 879,
 &end
#
#    0 AMB  20-2:1794     0 AMB  20-1:1794   5.50    (#   1794:20  Double Ambig)
 &rst
  ixpk= 1794, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 847, 855, 773, 782, 446, 454,
 igr2= 878, 879, 878, 879, 878, 879,
 &end
#
#   57 GLU  HA           57 GLU  HB+         5.50    (#   1795:20  Unique         2.39, 2.77 A)
 &rst
  ixpk= 1795, nxpk= 20, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 878, 879,
 &end
#
#   57 GLU  HG+          57 GLU  HB+         5.50    (#   1796:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 881, 882,
 igr2= 878, 879,
 &end
#
#    0 AMB  20-2:1797     0 AMB  20-1:1797   5.50    (#   1797:20  Double Ambig)
 &rst
  ixpk= 1797, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901, 829, 830, 831, 833, 834, 835,
 igr2= 878, 879, 878, 879, 878, 879,
 &end
#
#   57 GLU  HN           57 GLU  HG-         5.50    (#   1798:20  Unique         1.97, 3.53 A)
 &rst
  ixpk= 1798, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 881, 882,
 &end
#
#   57 GLU  HA           57 GLU  HG-         5.50    (#   1799:20  Unique         2.13, 3.03 A)
 &rst
  ixpk= 1799, nxpk= 20, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 881, 882,
 &end
#
#  120 GLU  HB-          57 GLU  HG-         5.50    (#   1801:20  Unique         3.50, 6.38 A)
 &rst
  ixpk= 1801, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1940,1941,
 igr2= 881, 882,
 &end
#
#   57 GLU  HN           57 GLU  HG+         5.50    (#   1802:20  Unique         1.97, 3.53 A)
 &rst
  ixpk= 1802, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 881, 882,
 &end
#
#   57 GLU  HA           57 GLU  HG+         5.50    (#   1803:20  Unique         2.13, 3.03 A)
 &rst
  ixpk= 1803, nxpk= 20, iat= 876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 881, 882,
 &end
#
#   57 GLU  HB+          57 GLU  HG+         5.50    (#   1804:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 878, 879,
 igr2= 881, 882,
 &end
#
#   57 GLU  HB+          57 GLU  HG-         5.50    (#   1805:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 878, 879,
 igr2= 881, 882,
 &end
#
#   58 VAL  HN           58 VAL  HA          5.50    (#   1806:20  Unique         2.92, 2.94 A)
 &rst
  ixpk= 1806, nxpk= 20, iat= 889, 891, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HN           58 VAL  HA          5.50    (#   1807:20  Unique         3.00, 3.32 A)
 &rst
  ixpk= 1807, nxpk= 20, iat= 905, 891, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HA-          58 VAL  HA          5.50    (#   1808:20  Unique         4.40, 4.78 A)
 &rst
  ixpk= 1808, nxpk= 20, iat=  -1, 891, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#  113 MET  HG+          58 VAL  HA          5.50    (#   1809:20  Unique         1.95, 3.05 A)
 &rst
  ixpk= 1809, nxpk= 20, iat=  -1, 891, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1845,1846,
 &end
#
#   58 VAL  HB           58 VAL  HA          4.50    (#   1810:20  Unique         2.42, 2.55 A)
 &rst
  ixpk= 1810, nxpk= 20, iat= 893, 891, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:1811    58 VAL  HA          4.50    (#   1811:20  Single Ambig)
 &rst
  ixpk= 1811, nxpk= 20, iat=  -1, 891, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 &end
#
#    0 AMB  20-2:1812    58 VAL  HA          3.50    (#   1812:20  Single Ambig)
 &rst
  ixpk= 1812, nxpk= 20, iat=  -1, 891, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#  111 ILE  QG2          58 VAL  HA          5.50    (#   1813:20  Unique         2.19, 4.28 A)
 &rst
  ixpk= 1813, nxpk= 20, iat=  -1, 891, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#    0 AMB  20-2:1814    58 VAL  HB          5.50    (#   1814:20  Single Ambig)
 &rst
  ixpk= 1814, nxpk= 20, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1815,1816, 350, 351, 352,
 &end
#
#    0 AMB  20-2:1815     0 AMB  20-1:1815   4.50    (#   1815:20  Double Ambig)
 &rst
  ixpk= 1815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 418, 419,1542,1543,
 igr2= 472, 473, 472, 473,1545,1546,
 &end
#
#    0 AMB  20-2:1816     0 AMB  20-1:1816   5.50    (#   1816:20  Double Ambig)
 &rst
  ixpk= 1816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 151, 152,1550,1551,
 igr2=1581,1582,1545,1546,
 &end
#
#   54 LEU  HN           58 VAL  MGX         5.50    (#   1817:20  Unique         5.84, 8.16 A)
 &rst
  ixpk= 1817, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   57 GLU  HN           58 VAL  MGX         5.50    (#   1818:20  Unique         3.72, 5.63 A)
 &rst
  ixpk= 1818, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1819     0 AMB  20-1:1819   5.50    (#   1819:20  Double Ambig)
 &rst
  ixpk= 1819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 299,1824,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#    0 AMB  20-2:1820     0 AMB  20-1:1820   4.50    (#   1820:20  Double Ambig)
 &rst
  ixpk= 1820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2559, 905,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#   58 VAL  HN           58 VAL  MGX         4.50    (#   1821:20  Unique         1.95, 3.62 A)
 &rst
  ixpk= 1821, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  103 GLN  HE2+        155 VAL  MGX         5.50    (#   1822:20  Unique         1.92, 4.93 A)
 &rst
  ixpk= 1822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#   60 LEU  HN           58 VAL  MGX         5.50    (#   1823:20  Unique         1.92, 4.36 A)
 &rst
  ixpk= 1823, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1824   155 VAL  MGX         5.50    (#   1824:20  Single Ambig)
 &rst
  ixpk= 1824, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2099,2104,2097,2106,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#   60 LEU  HA           58 VAL  MGX         5.50    (#   1825:20  Unique         3.93, 6.35 A)
 &rst
  ixpk= 1825, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   58 VAL  HA           58 VAL  MGX         4.50    (#   1826:20  Unique         2.04, 3.42 A)
 &rst
  ixpk= 1826, nxpk= 20, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   20 GLY  HA+         155 VAL  MGX         5.50    (#   1827:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 1827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 301, 302,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#   54 LEU  HA           58 VAL  MGX         5.50    (#   1828:20  Unique         3.31, 5.58 A)
 &rst
  ixpk= 1828, nxpk= 20, iat= 822,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   20 GLY  HA-         155 VAL  MGX         5.50    (#   1829:20  Unique         1.98, 5.26 A)
 &rst
  ixpk= 1829, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 301, 302,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:1830     0 AMB  20-1:1830   4.50    (#   1830:20  Double Ambig)
 &rst
  ixpk= 1830, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2561,1807,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#   16 CYS  HB+         155 VAL  MGX         5.50    (#   1831:20  Unique         1.96, 4.18 A)
 &rst
  ixpk= 1831, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 237, 238,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:1832     0 AMB  20-1:1832   5.50    (#   1832:20  Double Ambig)
 &rst
  ixpk= 1832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 237, 238,1845,1846,2582,2583,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#  156 MET  HG-         155 VAL  MGX         5.50    (#   1833:20  Unique         2.57, 6.19 A)
 &rst
  ixpk= 1833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2582,2583,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#   58 VAL  HB           58 VAL  MGX         3.50    (#   1834:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1834, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1835     0 AMB  20-1:1835   5.50    (#   1835:20  Double Ambig)
 &rst
  ixpk= 1835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 313, 314, 824, 825,2626,2627,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#  113 MET  ME           58 VAL  MGX         4.50    (#   1836:20  Unique         1.99, 5.49 A)
 &rst
  ixpk= 1836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1849,1850,1851,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1837     0 AMB  20-1:1837   3.50    (#   1837:20  Double Ambig)
 &rst
  ixpk= 1837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 224, 225,2563, 827,
 igr2= 895, 896, 897, 899, 900, 901,2565,2566,2567,2569,
      2570,2571,
 &end
#
#    0 AMB  20-2:1838    68 LEU  MDY         4.50    (#   1838:20  Single Ambig)
 &rst
  ixpk= 1838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
 igr1=2549,2550,2551,2553,2554,2555,1667,1664,1665,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#    0 AMB  20-2:1839     0 AMB  20-1:1839   4.50    (#   1839:20  Double Ambig)
 &rst
  ixpk= 1839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.02, r4=11.52,
 igr1=1669,1670,1671,1673,1674,1675, 921, 922, 923, 925,
       926, 927, 921, 922, 923, 925, 926, 927,
 igr2=2565,2566,2567,2569,2570,2571, 895, 896, 897, 899,
       900, 901,
 &end
#
#  111 ILE  QD1          58 VAL  MGY         5.50    (#   1840:20  Unique         1.98, 4.77 A)
 &rst
  ixpk= 1840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1818,1819,1820,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  111 ILE  QG2          58 VAL  MGY         4.50    (#   1841:20  Unique         1.96, 5.48 A)
 &rst
  ixpk= 1841, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1811,1812,1813,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  111 ILE  HG1+         58 VAL  MGY         5.50    (#   1842:20  Unique         1.97, 4.53 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1815,1816,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1843    58 VAL  MGY         3.50    (#   1843:20  Single Ambig)
 &rst
  ixpk= 1843, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816, 350, 351, 352,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  20-2:1844    58 VAL  MGY         2.80    (#   1844:20  Single Ambig)
 &rst
  ixpk= 1844, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 224, 225, 827,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  113 MET  ME           58 VAL  MGY         3.50    (#   1845:20  Unique         1.99, 5.49 A)
 &rst
  ixpk= 1845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1849,1850,1851,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   58 VAL  HB           58 VAL  MGY         3.50    (#   1846:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1846, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  113 MET  HG+          58 VAL  MGY         5.50    (#   1847:20  Unique         2.07, 5.52 A)
 &rst
  ixpk= 1847, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1845,1846,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   58 VAL  HA           58 VAL  MGY         3.50    (#   1848:20  Unique         2.04, 3.42 A)
 &rst
  ixpk= 1848, nxpk= 20, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   58 VAL  HN           58 VAL  MGY         5.50    (#   1850:20  Unique         1.95, 3.62 A)
 &rst
  ixpk= 1850, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#  112 ASN  HN           58 VAL  MGY         5.50    (#   1851:20  Unique         2.49, 5.26 A)
 &rst
  ixpk= 1851, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   57 GLU  HN           58 VAL  MGY         5.50    (#   1852:20  Unique         3.72, 5.63 A)
 &rst
  ixpk= 1852, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   57 GLU  HN           59 GLY  HA+         5.50    (#   1853:20  Unique         4.42, 5.14 A)
 &rst
  ixpk= 1853, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   57 GLU  HN           59 GLY  HA-         5.50    (#   1854:20  Unique         4.42, 5.14 A)
 &rst
  ixpk= 1854, nxpk= 20, iat= 874,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#  112 ASN  HN           59 GLY  HA+         5.50    (#   1855:20  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1855, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#  112 ASN  HN           59 GLY  HA-         5.50    (#   1856:20  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1856, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   59 GLY  HN           59 GLY  HA+         5.50    (#   1857:20  Unique         2.29, 2.61 A)
 &rst
  ixpk= 1857, nxpk= 20, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   59 GLY  HN           59 GLY  HA-         5.50    (#   1858:20  Unique         2.29, 2.61 A)
 &rst
  ixpk= 1858, nxpk= 20, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   58 VAL  HN           59 GLY  HA-         5.50    (#   1859:20  Unique         4.00, 4.36 A)
 &rst
  ixpk= 1859, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   58 VAL  HN           59 GLY  HA+         5.50    (#   1860:20  Unique         4.00, 4.36 A)
 &rst
  ixpk= 1860, nxpk= 20, iat= 889,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   60 LEU  HN           59 GLY  HA+         5.50    (#   1861:20  Unique         2.52, 3.22 A)
 &rst
  ixpk= 1861, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   60 LEU  HN           59 GLY  HA-         5.50    (#   1862:20  Unique         2.52, 3.22 A)
 &rst
  ixpk= 1862, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   60 LEU  HA           59 GLY  HA+         5.50    (#   1863:20  Unique         4.35, 4.51 A)
 &rst
  ixpk= 1863, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   55 PHE  HA           59 GLY  HA+         5.50    (#   1865:20  Unique         1.99, 3.02 A)
 &rst
  ixpk= 1865, nxpk= 20, iat= 841,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   55 PHE  HA           59 GLY  HA-         5.50    (#   1866:20  Unique         1.99, 3.02 A)
 &rst
  ixpk= 1866, nxpk= 20, iat= 841,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:1867     0 AMB  20-1:1867   5.50    (#   1867:20  Double Ambig)
 &rst
  ixpk= 1867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1828,1829,1828,1829,
 igr2= 907, 908, 907, 908,
 &end
#
#    0 AMB  20-2:1868    59 GLY  HA-         5.50    (#   1868:20  Single Ambig)
 &rst
  ixpk= 1868, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1828,1829,1828,1829,
 igr2= 907, 908,
 &end
#
#    0 AMB  20-2:1869     0 AMB  20-1:1869   5.50    (#   1869:20  Double Ambig)
 &rst
  ixpk= 1869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 907, 908, 907, 908,
 &end
#
#    0 AMB  20-2:1870    59 GLY  HA-         5.50    (#   1870:20  Single Ambig)
 &rst
  ixpk= 1870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 907, 908,
 &end
#
#  115 THR  MG2          59 GLY  HA-         5.50    (#   1871:20  Unique         1.95, 3.46 A)
 &rst
  ixpk= 1871, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2= 907, 908,
 &end
#
#  115 THR  MG2          59 GLY  HA+         5.50    (#   1872:20  Unique         1.95, 3.46 A)
 &rst
  ixpk= 1872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2= 907, 908,
 &end
#
#   60 LEU  HG           59 GLY  HA-         5.50    (#   1873:20  Unique         3.88, 4.64 A)
 &rst
  ixpk= 1873, nxpk= 20, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 907, 908,
 &end
#
#   61 SER  HN           60 LEU  HA          5.50    (#   1874:20  Unique         2.28, 2.97 A)
 &rst
  ixpk= 1874, nxpk= 20, iat= 931, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 LEU  HN           60 LEU  HA          5.50    (#   1875:20  Unique         2.90, 2.93 A)
 &rst
  ixpk= 1875, nxpk= 20, iat= 912, 914, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:1876    60 LEU  HA          4.50    (#   1876:20  Single Ambig)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1, 914, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#   61 SER  HN           60 LEU  HB+         5.50    (#   1877:20  Unique         1.85, 2.75 A)
 &rst
  ixpk= 1877, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#   61 SER  HN           60 LEU  HB-         5.50    (#   1878:20  Unique         1.85, 2.75 A)
 &rst
  ixpk= 1878, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#   60 LEU  HN           60 LEU  HB+         5.50    (#   1879:20  Unique         2.30, 3.19 A)
 &rst
  ixpk= 1879, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#   60 LEU  HN           60 LEU  HB-         5.50    (#   1880:20  Unique         2.30, 3.19 A)
 &rst
  ixpk= 1880, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#   60 LEU  HA           60 LEU  HB+         5.50    (#   1881:20  Unique         2.28, 2.70 A)
 &rst
  ixpk= 1881, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#   60 LEU  HA           60 LEU  HB-         5.50    (#   1882:20  Unique         2.28, 2.70 A)
 &rst
  ixpk= 1882, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 916, 917,
 &end
#
#    0 AMB  20-2:1883    60 LEU  HB-         5.50    (#   1883:20  Single Ambig)
 &rst
  ixpk= 1883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 992, 993, 992, 993,
 igr2= 916, 917,
 &end
#
#   54 LEU  MDX          60 LEU  HB+         5.50    (#   1884:20  Unique         1.98, 4.60 A)
 &rst
  ixpk= 1884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 829, 830, 831, 833, 834, 835,
 igr2= 916, 917,
 &end
#
#    0 AMB  20-2:1885     0 AMB  20-1:1885   5.50    (#   1885:20  Double Ambig)
 &rst
  ixpk= 1885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 916, 917, 916, 917,
 &end
#
#    0 AMB  20-2:1886     0 AMB  20-1:1886   4.50    (#   1886:20  Double Ambig)
 &rst
  ixpk= 1886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 829, 830, 831, 833, 834, 835,1068,1069,1070,1072,
      1073,1074,
 igr2= 916, 917,1063,1064,
 &end
#
#    0 AMB  20-2:1887     0 AMB  20-1:1887   4.50    (#   1887:20  Double Ambig)
 &rst
  ixpk= 1887, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.30, r4= 9.80,
 igr1= 921, 922, 923, 925, 926, 927,1669,1670,1671,1673,
      1674,1675,1066,
 igr2= 916, 917,1063,1064,1063,1064,
 &end
#
#    7 TYR  HE           78 LYS  HG-         5.50    (#   1888:20  Unique         3.38, 6.60 A)
 &rst
  ixpk= 1888, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:1890    78 LYS  HG-         5.50    (#   1890:20  Single Ambig)
 &rst
  ixpk= 1890, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1252,1253,1252,1253,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:1891     0 AMB  20-1:1891   5.50    (#   1891:20  Double Ambig)
 &rst
  ixpk= 1891, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1252,1253,1252,1253,
 igr2=1246,1247,1246,1247,
 &end
#
#    0 AMB  20-2:1892    60 LEU  HG          4.50    (#   1892:20  Single Ambig)
 &rst
  ixpk= 1892, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#   93 ILE  QD1          78 LYS  HG+         5.50    (#   1893:20  Unique         2.07, 5.13 A)
 &rst
  ixpk= 1893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1525,1526,1527,
 igr2=1246,1247,
 &end
#
#   61 SER  HN           60 LEU  MDX         5.50    (#   1894:20  Unique         2.88, 5.11 A)
 &rst
  ixpk= 1894, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HN           60 LEU  MDX         5.50    (#   1895:20  Unique         2.38, 4.56 A)
 &rst
  ixpk= 1895, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HA           60 LEU  MDX         5.50    (#   1896:20  Unique         1.99, 3.95 A)
 &rst
  ixpk= 1896, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  HA           60 LEU  MDX         5.50    (#   1897:20  Unique         2.10, 4.48 A)
 &rst
  ixpk= 1897, nxpk= 20, iat=1807,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-2:1898    60 LEU  MDX         5.50    (#   1898:20  Single Ambig)
 &rst
  ixpk= 1898, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 992, 993, 992, 993,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   58 VAL  HB           60 LEU  MDX         5.50    (#   1899:20  Unique         1.99, 4.63 A)
 &rst
  ixpk= 1899, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-2:1900    60 LEU  MDX         3.50    (#   1900:20  Single Ambig)
 &rst
  ixpk= 1900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1809, 976, 977,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  HG1-         60 LEU  MDX         5.50    (#   1901:20  Unique         2.01, 5.05 A)
 &rst
  ixpk= 1901, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1815,1816,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  104 LEU  MDX          60 LEU  MDX         4.50    (#   1902:20  Unique         2.02, 5.98 A)
 &rst
  ixpk= 1902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  QD1          60 LEU  MDX         5.50    (#   1904:20  Unique         2.04, 5.40 A)
 &rst
  ixpk= 1904, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1818,1819,1820,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-2:1905     0 AMB  20-1:1905   5.50    (#   1905:20  Double Ambig)
 &rst
  ixpk= 1905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=1833,1834,2289, 905,
 igr2= 921, 922, 923, 925, 926, 927,2296,2297,
 &end
#
#    0 AMB  20-2:1906     0 AMB  20-1:1906   5.50    (#   1906:20  Double Ambig)
 &rst
  ixpk= 1906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2279,2283,1750,
 igr2=2296,2297, 921, 922, 923, 925, 926, 927,
 &end
#
#   93 ILE  HN           93 ILE  HG1+        5.50    (#   1908:20  Unique         1.90, 2.78 A)
 &rst
  ixpk= 1908, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#    0 AMB  20-2:1909     0 AMB  20-1:1909   5.50    (#   1909:20  Double Ambig)
 &rst
  ixpk= 1909, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1824,1261,
 igr2= 921, 922, 923, 925, 926, 927,1522,1523,
 &end
#
#    6 GLY  HN           93 ILE  HG1+        5.50    (#   1910:20  Unique         3.47, 4.99 A)
 &rst
  ixpk= 1910, nxpk= 20, iat=  76,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#    0 AMB  20-2:1911     0 AMB  20-1:1911   5.50    (#   1911:20  Double Ambig)
 &rst
  ixpk= 1911, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1503, 990,1752,
 igr2=1522,1523, 921, 922, 923, 925, 926, 927,
 &end
#
#   93 ILE  HA           93 ILE  HG1+        5.50    (#   1912:20  Unique         3.51, 3.81 A)
 &rst
  ixpk= 1912, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#    6 GLY  HA-          93 ILE  HG1+        5.50    (#   1913:20  Unique         1.97, 4.09 A)
 &rst
  ixpk= 1913, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  78,  79,
 igr2=1522,1523,
 &end
#
#    0 AMB  20-2:1914     0 AMB  20-1:1914   4.50    (#   1914:20  Double Ambig)
 &rst
  ixpk= 1914, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1516,1722,
 igr2=1522,1523, 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HB-          60 LEU  MDX         5.50    (#   1915:20  Unique         2.01, 3.26 A)
 &rst
  ixpk= 1915, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 916, 917,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-2:1916    60 LEU  MDX         3.50    (#   1916:20  Single Ambig)
 &rst
  ixpk= 1916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 916, 917, 919,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   61 SER  HN           60 LEU  MDY         5.50    (#   1917:20  Unique         2.88, 5.11 A)
 &rst
  ixpk= 1917, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  112 ASN  HN           60 LEU  MDY         5.50    (#   1918:20  Unique         2.90, 5.58 A)
 &rst
  ixpk= 1918, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   64 ASP  HN           60 LEU  MDY         5.50    (#   1919:20  Unique         4.61, 6.50 A)
 &rst
  ixpk= 1919, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  110 GLU  HN           60 LEU  MDY         5.50    (#   1920:20  Unique         4.81, 6.72 A)
 &rst
  ixpk= 1920, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  HN           60 LEU  MDY         5.50    (#   1921:20  Unique         3.64, 5.83 A)
 &rst
  ixpk= 1921, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HN           60 LEU  MDY         5.50    (#   1922:20  Unique         2.38, 4.56 A)
 &rst
  ixpk= 1922, nxpk= 20, iat= 912,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HA           60 LEU  MDY         3.50    (#   1923:20  Unique         1.99, 3.95 A)
 &rst
  ixpk= 1923, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  HA           60 LEU  MDY         4.50    (#   1924:20  Unique         2.10, 4.48 A)
 &rst
  ixpk= 1924, nxpk= 20, iat=1807,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-2:1925    60 LEU  MDY         4.50    (#   1925:20  Single Ambig)
 &rst
  ixpk= 1925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 992, 993, 992, 993,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  110 GLU  HG-          60 LEU  MDY         5.50    (#   1926:20  Unique         2.00, 6.62 A)
 &rst
  ixpk= 1926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1797,1798,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  110 GLU  HG+          60 LEU  MDY         5.50    (#   1927:20  Unique         2.00, 6.62 A)
 &rst
  ixpk= 1927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1797,1798,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  113 MET  HG+          60 LEU  MDY         5.50    (#   1928:20  Unique         4.95, 8.46 A)
 &rst
  ixpk= 1928, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1845,1846,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  110 GLU  HB+          60 LEU  MDY         4.50    (#   1929:20  Unique         1.98, 5.51 A)
 &rst
  ixpk= 1929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1794,1795,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  110 GLU  HB-          60 LEU  MDY         4.50    (#   1930:20  Unique         1.98, 5.51 A)
 &rst
  ixpk= 1930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1794,1795,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HB-          60 LEU  MDY         3.50    (#   1931:20  Unique         2.01, 3.26 A)
 &rst
  ixpk= 1931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 916, 917,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   60 LEU  HG           60 LEU  MDY         2.80    (#   1932:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1932, nxpk= 20, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  HG1-         60 LEU  MDY         4.50    (#   1933:20  Unique         2.01, 5.05 A)
 &rst
  ixpk= 1933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1815,1816,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  104 LEU  MDX          60 LEU  MDY         2.80    (#   1934:20  Unique         2.02, 5.98 A)
 &rst
  ixpk= 1934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#  111 ILE  QD1          60 LEU  MDY         5.50    (#   1935:20  Unique         2.04, 5.40 A)
 &rst
  ixpk= 1935, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1818,1819,1820,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   61 SER  HN           61 SER  HB+         5.50    (#   1936:20  Unique         2.39, 3.44 A)
 &rst
  ixpk= 1936, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   61 SER  HN           61 SER  HB-         5.50    (#   1937:20  Unique         2.39, 3.44 A)
 &rst
  ixpk= 1937, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   62 ARG  HN           61 SER  HB+         4.50    (#   1938:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 1938, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 935, 936,
 &end
#
#   62 ARG  HN           61 SER  HB-         4.50    (#   1939:20  Unique         2.00, 2.99 A)
 &rst
  ixpk= 1939, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 935, 936,
 &end
#
#   63 LYS  HN           61 SER  HB+         5.50    (#   1940:20  Unique         2.13, 3.24 A)
 &rst
  ixpk= 1940, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   63 LYS  HN           61 SER  HB-         5.50    (#   1941:20  Unique         2.13, 3.24 A)
 &rst
  ixpk= 1941, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   55 PHE  HD           61 SER  HB+         5.50    (#   1942:20  Unique         2.01, 5.13 A)
 &rst
  ixpk= 1942, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 935, 936,
 &end
#
#   55 PHE  HD           61 SER  HB-         5.50    (#   1943:20  Unique         2.01, 5.13 A)
 &rst
  ixpk= 1943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855,
 igr2= 935, 936,
 &end
#
#   61 SER  HA           61 SER  HB+         4.50    (#   1944:20  Unique         2.24, 2.70 A)
 &rst
  ixpk= 1944, nxpk= 20, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 935, 936,
 &end
#
#   61 SER  HA           61 SER  HB-         4.50    (#   1945:20  Unique         2.24, 2.70 A)
 &rst
  ixpk= 1945, nxpk= 20, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 935, 936,
 &end
#
#   60 LEU  HA           61 SER  HB+         5.50    (#   1946:20  Unique         3.83, 4.73 A)
 &rst
  ixpk= 1946, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   60 LEU  HA           61 SER  HB-         5.50    (#   1947:20  Unique         3.83, 4.73 A)
 &rst
  ixpk= 1947, nxpk= 20, iat= 914,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   51 TYR  HB+          61 SER  HB+         5.50    (#   1948:20  Unique         2.27, 4.84 A)
 &rst
  ixpk= 1948, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 769, 770,
 igr2= 935, 936,
 &end
#
#   51 TYR  HB+          61 SER  HB-         5.50    (#   1949:20  Unique         2.27, 4.84 A)
 &rst
  ixpk= 1949, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 769, 770,
 igr2= 935, 936,
 &end
#
#   63 LYS  HB+          61 SER  HB+         5.50    (#   1950:20  Unique         2.85, 5.20 A)
 &rst
  ixpk= 1950, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 970, 971,
 igr2= 935, 936,
 &end
#
#   63 LYS  HB+          61 SER  HB-         5.50    (#   1951:20  Unique         2.85, 5.20 A)
 &rst
  ixpk= 1951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 970, 971,
 igr2= 935, 936,
 &end
#
#    0 AMB  20-2:1952     0 AMB  20-1:1952   5.50    (#   1952:20  Double Ambig)
 &rst
  ixpk= 1952, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 946, 947, 916, 917,
 igr2= 935, 936, 935, 936,
 &end
#
#    0 AMB  20-2:1953    61 SER  HB-         5.50    (#   1953:20  Single Ambig)
 &rst
  ixpk= 1953, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 946, 947, 916, 917,
 igr2= 935, 936,
 &end
#
#    0 AMB  20-2:1954     0 AMB  20-1:1954   5.50    (#   1954:20  Double Ambig)
 &rst
  ixpk= 1954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 973, 974, 973, 974,
 igr2= 935, 936, 935, 936,
 &end
#
#    0 AMB  20-2:1955    61 SER  HB-         5.50    (#   1955:20  Single Ambig)
 &rst
  ixpk= 1955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 973, 974, 973, 974,
 igr2= 935, 936,
 &end
#
#   62 ARG  HG-          61 SER  HB+         5.50    (#   1956:20  Unique         2.66, 4.80 A)
 &rst
  ixpk= 1956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 949, 950,
 igr2= 935, 936,
 &end
#
#   62 ARG  HG-          61 SER  HB-         5.50    (#   1957:20  Unique         2.66, 4.80 A)
 &rst
  ixpk= 1957, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 949, 950,
 igr2= 935, 936,
 &end
#
#    0 AMB  20-2:1958    61 SER  HB-         5.50    (#   1958:20  Single Ambig)
 &rst
  ixpk= 1958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927, 192, 193, 194,
 igr2= 935, 936,
 &end
#
#   54 LEU  HG           61 SER  HB-         5.50    (#   1959:20  Unique         3.89, 4.90 A)
 &rst
  ixpk= 1959, nxpk= 20, iat= 827,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 935, 936,
 &end
#
#   63 LYS  HD-          61 SER  HB+         5.50    (#   1960:20  Unique         2.63, 5.33 A)
 &rst
  ixpk= 1960, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 976, 977,
 igr2= 935, 936,
 &end
#
#   54 LEU  MDX          62 ARG  HA          5.50    (#   1961:20  Unique         3.57, 6.17 A)
 &rst
  ixpk= 1961, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  20-2:1962    62 ARG  HA          4.50    (#   1962:20  Single Ambig)
 &rst
  ixpk= 1962, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1006,1007,1008,1010,1011,1012,1006,1007,1008,1010,
      1011,1012,
 &end
#
#   62 ARG  HG+          62 ARG  HA          5.50    (#   1963:20  Unique         2.92, 3.76 A)
 &rst
  ixpk= 1963, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 949, 950,
 &end
#
#   62 ARG  HB+          62 ARG  HA          4.50    (#   1964:20  Unique         2.25, 2.47 A)
 &rst
  ixpk= 1964, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 946, 947,
 &end
#
#    0 AMB  20-2:1965    62 ARG  HA          5.50    (#   1965:20  Single Ambig)
 &rst
  ixpk= 1965, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 952, 953, 952, 953,
 &end
#
#   51 TYR  HE           62 ARG  HA          4.50    (#   1967:20  Unique         2.16, 3.97 A)
 &rst
  ixpk= 1967, nxpk= 20, iat=  -1, 944, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 775, 780,
 &end
#
#   65 VAL  HN           62 ARG  HA          5.50    (#   1969:20  Unique         3.23, 3.81 A)
 &rst
  ixpk= 1969, nxpk= 20, iat=1000, 944, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 LYS  HN           62 ARG  HA          5.50    (#   1970:20  Unique         3.21, 3.33 A)
 &rst
  ixpk= 1970, nxpk= 20, iat= 966, 944, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HN           62 ARG  HA          5.50    (#   1971:20  Unique         2.78, 2.82 A)
 &rst
  ixpk= 1971, nxpk= 20, iat= 942, 944, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HN           62 ARG  HB+         4.50    (#   1972:20  Unique         2.46, 3.15 A)
 &rst
  ixpk= 1972, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 946, 947,
 &end
#
#   62 ARG  HN           62 ARG  HB-         4.50    (#   1973:20  Unique         2.46, 3.15 A)
 &rst
  ixpk= 1973, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 946, 947,
 &end
#
#   63 LYS  HN           62 ARG  HB+         5.50    (#   1974:20  Unique         3.41, 4.20 A)
 &rst
  ixpk= 1974, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 946, 947,
 &end
#
#   63 LYS  HN           62 ARG  HB-         5.50    (#   1975:20  Unique         3.41, 4.20 A)
 &rst
  ixpk= 1975, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 946, 947,
 &end
#
#   51 TYR  HD           62 ARG  HB+         5.50    (#   1976:20  Unique         2.69, 4.25 A)
 &rst
  ixpk= 1976, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 946, 947,
 &end
#
#   51 TYR  HD           62 ARG  HB-         5.50    (#   1977:20  Unique         2.69, 4.25 A)
 &rst
  ixpk= 1977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 946, 947,
 &end
#
#   62 ARG  HE           62 ARG  HB-         5.50    (#   1978:20  Unique         3.22, 4.08 A)
 &rst
  ixpk= 1978, nxpk= 20, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 946, 947,
 &end
#
#   51 TYR  HE           62 ARG  HB-         5.50    (#   1979:20  Unique         2.88, 3.98 A)
 &rst
  ixpk= 1979, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 946, 947,
 &end
#
#   51 TYR  HE           62 ARG  HB+         5.50    (#   1980:20  Unique         2.88, 3.98 A)
 &rst
  ixpk= 1980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 946, 947,
 &end
#
#    0 AMB  20-2:1982    62 ARG  HB-         5.50    (#   1982:20  Single Ambig)
 &rst
  ixpk= 1982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 933,1018,
 igr2= 946, 947,
 &end
#
#   63 LYS  HA           62 ARG  HB+         5.50    (#   1983:20  Unique         4.14, 5.10 A)
 &rst
  ixpk= 1983, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 946, 947,
 &end
#
#   63 LYS  HA           62 ARG  HB-         5.50    (#   1984:20  Unique         4.14, 5.10 A)
 &rst
  ixpk= 1984, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 946, 947,
 &end
#
#   61 SER  HB+          62 ARG  HB-         5.50    (#   1985:20  Unique         4.42, 5.92 A)
 &rst
  ixpk= 1985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 935, 936,
 igr2= 946, 947,
 &end
#
#   62 ARG  HA           62 ARG  HB+         4.50    (#   1986:20  Unique         2.25, 2.47 A)
 &rst
  ixpk= 1986, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 946, 947,
 &end
#
#   62 ARG  HA           62 ARG  HB-         4.50    (#   1987:20  Unique         2.25, 2.47 A)
 &rst
  ixpk= 1987, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 946, 947,
 &end
#
#    0 AMB  20-2:1988    62 ARG  HB-         4.50    (#   1988:20  Single Ambig)
 &rst
  ixpk= 1988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 952, 953, 952, 953,
 igr2= 946, 947,
 &end
#
#    0 AMB  20-2:1989     0 AMB  20-1:1989   4.50    (#   1989:20  Double Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 952, 953, 952, 953,
 igr2= 946, 947, 946, 947,
 &end
#
#   62 ARG  HG+          62 ARG  HB+         3.50    (#   1990:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1990, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 949, 950,
 igr2= 946, 947,
 &end
#
#   62 ARG  HG+          62 ARG  HB-         4.50    (#   1991:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 949, 950,
 igr2= 946, 947,
 &end
#
#   62 ARG  HG-          62 ARG  HB+         4.50    (#   1992:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1992, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 949, 950,
 igr2= 946, 947,
 &end
#
#   62 ARG  HG-          62 ARG  HB-         4.50    (#   1993:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 949, 950,
 igr2= 946, 947,
 &end
#
#   62 ARG  HN           62 ARG  HG+         5.50    (#   1994:20  Unique         1.90, 2.70 A)
 &rst
  ixpk= 1994, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#   62 ARG  HE           62 ARG  HG+         5.50    (#   1995:20  Unique         2.43, 3.40 A)
 &rst
  ixpk= 1995, nxpk= 20, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#   51 TYR  HE           62 ARG  HG+         5.50    (#   1996:20  Unique         3.95, 5.73 A)
 &rst
  ixpk= 1996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 949, 950,
 &end
#
#   62 ARG  HA           62 ARG  HG+         5.50    (#   1997:20  Unique         2.92, 3.76 A)
 &rst
  ixpk= 1997, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#    0 AMB  20-2:1998     0 AMB  20-1:1998   4.50    (#   1998:20  Double Ambig)
 &rst
  ixpk= 1998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 952, 953, 952, 953,
 igr2= 949, 950, 949, 950,
 &end
#
#   62 ARG  HB-          62 ARG  HG+         3.50    (#   1999:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 1999, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 946, 947,
 igr2= 949, 950,
 &end
#
#   62 ARG  HB+          62 ARG  HG+         3.50    (#   2000:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 946, 947,
 igr2= 949, 950,
 &end
#
#   62 ARG  HB-          62 ARG  HG-         4.50    (#   2001:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 946, 947,
 igr2= 949, 950,
 &end
#
#   62 ARG  HB+          62 ARG  HG-         4.50    (#   2002:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 946, 947,
 igr2= 949, 950,
 &end
#
#    0 AMB  20-2:2003    62 ARG  HG-         4.50    (#   2003:20  Single Ambig)
 &rst
  ixpk= 2003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 952, 953, 952, 953, 769, 770,
 igr2= 949, 950,
 &end
#
#   62 ARG  HA           62 ARG  HG-         5.50    (#   2004:20  Unique         2.92, 3.76 A)
 &rst
  ixpk= 2004, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#   51 TYR  HE           62 ARG  HG-         5.50    (#   2005:20  Unique         3.95, 5.73 A)
 &rst
  ixpk= 2005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 775, 780,
 igr2= 949, 950,
 &end
#
#   62 ARG  HE           62 ARG  HG-         5.50    (#   2006:20  Unique         2.43, 3.40 A)
 &rst
  ixpk= 2006, nxpk= 20, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#   51 TYR  HD           62 ARG  HG-         5.50    (#   2007:20  Unique         2.57, 5.21 A)
 &rst
  ixpk= 2007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 949, 950,
 &end
#
#   51 TYR  HD           62 ARG  HG+         5.50    (#   2008:20  Unique         2.57, 5.21 A)
 &rst
  ixpk= 2008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 773, 782,
 igr2= 949, 950,
 &end
#
#   62 ARG  HN           62 ARG  HG-         5.50    (#   2009:20  Unique         1.90, 2.70 A)
 &rst
  ixpk= 2009, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 949, 950,
 &end
#
#   62 ARG  HG-           0 AMB  20-1:2010   3.50    (#   2010:20  Single Ambig)
 &rst
  ixpk= 2010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 949, 950,
 igr2= 952, 953, 952, 953,
 &end
#
#    0 AMB  20-2:2011     0 AMB  20-1:2011   3.50    (#   2011:20  Double Ambig)
 &rst
  ixpk= 2011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 949, 950, 949, 950,
 igr2= 952, 953, 952, 953,
 &end
#
#   62 ARG  HB-           0 AMB  20-1:2012   3.50    (#   2012:20  Single Ambig)
 &rst
  ixpk= 2012, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 946, 947,
 igr2= 952, 953, 952, 953,
 &end
#
#    0 AMB  20-2:2013     0 AMB  20-1:2013   3.50    (#   2013:20  Double Ambig)
 &rst
  ixpk= 2013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 946, 947, 946, 947,
 igr2= 952, 953, 952, 953,
 &end
#
#   62 ARG  HA            0 AMB  20-1:2015   5.50    (#   2015:20  Single Ambig)
 &rst
  ixpk= 2015, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 952, 953, 952, 953,
 &end
#
#   51 TYR  HE            0 AMB  20-1:2018   4.50    (#   2018:20  Single Ambig)
 &rst
  ixpk= 2018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 775, 780,
 igr2= 952, 953, 952, 953,
 &end
#
#   62 ARG  HE            0 AMB  20-1:2019   4.50    (#   2019:20  Single Ambig)
 &rst
  ixpk= 2019, nxpk= 20, iat= 955,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 952, 953, 952, 953,
 &end
#
#    0 AMB  20-2:2020     0 AMB  20-1:2020   5.50    (#   2020:20  Double Ambig)
 &rst
  ixpk= 2020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 966, 721,
 igr2= 952, 953, 952, 953, 952, 953,
 &end
#
#   62 ARG  HN            0 AMB  20-1:2021   5.50    (#   2021:20  Single Ambig)
 &rst
  ixpk= 2021, nxpk= 20, iat= 942,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 952, 953, 952, 953,
 &end
#
#   63 LYS  HN           63 LYS  HA          4.50    (#   2022:20  Unique         2.88, 2.92 A)
 &rst
  ixpk= 2022, nxpk= 20, iat= 966, 968, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HN           63 LYS  HA          5.50    (#   2023:20  Unique         3.91, 4.21 A)
 &rst
  ixpk= 2023, nxpk= 20, iat=1000, 968, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 LYS  HB+          63 LYS  HA          2.80    (#   2025:20  Unique         2.23, 2.48 A)
 &rst
  ixpk= 2025, nxpk= 20, iat=  -1, 968, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 970, 971,
 &end
#
#    0 AMB  20-2:2026     0 AMB  20-1:2026   4.50    (#   2026:20  Double Ambig)
 &rst
  ixpk= 2026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 224, 225, 827,1683,1684,
 igr2= 341, 968,
 &end
#
#   62 ARG  HB+          63 LYS  HA          5.50    (#   2027:20  Unique         4.14, 5.10 A)
 &rst
  ixpk= 2027, nxpk= 20, iat=  -1, 968, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 946, 947,
 &end
#
#    0 AMB  20-2:2028     0 AMB  20-1:2028   5.50    (#   2028:20  Double Ambig)
 &rst
  ixpk= 2028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1= 973, 974, 350, 351, 352, 949, 950,
 igr2= 968, 341,
 &end
#
#    0 AMB  20-2:2029    63 LYS  HA          5.50    (#   2029:20  Single Ambig)
 &rst
  ixpk= 2029, nxpk= 20, iat=  -1, 968, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 973, 974, 973, 974,
 &end
#
#    0 AMB  20-2:2030     0 AMB  20-1:2030   5.50    (#   2030:20  Double Ambig)
 &rst
  ixpk= 2030, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1= 949, 950, 329, 330, 331, 333, 334, 335,1006,1007,
      1008,1010,1011,1012,1006,1007,1008,1010,1011,1012,
      
 igr2= 968, 341,
 &end
#
#    0 AMB  20-2:2031     0 AMB  20-1:2031   5.50    (#   2031:20  Double Ambig)
 &rst
  ixpk= 2031, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 895, 896, 897, 899, 900, 901, 829, 830, 831, 833,
       834, 835,
 igr2= 341, 968,
 &end
#
#   63 LYS  HA           63 LYS  HB+         3.50    (#   2032:20  Unique         2.23, 2.48 A)
 &rst
  ixpk= 2032, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 970, 971,
 &end
#
#   63 LYS  HN           63 LYS  HB+         3.50    (#   2033:20  Unique         2.14, 3.08 A)
 &rst
  ixpk= 2033, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 970, 971,
 &end
#
#    0 AMB  20-2:2034     0 AMB  20-1:2034   5.50    (#   2034:20  Double Ambig)
 &rst
  ixpk= 2034, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 979, 980, 979, 980,
 igr2= 970, 971, 970, 971,
 &end
#
#   63 LYS  HN           63 LYS  HG+         4.50    (#   2035:20  Unique         1.91, 3.19 A)
 &rst
  ixpk= 2035, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 973, 974,
 &end
#
#   63 LYS  HN            0 AMB  20-1:2036   4.50    (#   2036:20  Single Ambig)
 &rst
  ixpk= 2036, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 973, 974, 973, 974,
 &end
#
#   63 LYS  HA           63 LYS  HG-         5.50    (#   2037:20  Unique         3.06, 3.72 A)
 &rst
  ixpk= 2037, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 973, 974,
 &end
#
#   63 LYS  HA           63 LYS  HG+         5.50    (#   2038:20  Unique         3.06, 3.72 A)
 &rst
  ixpk= 2038, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 973, 974,
 &end
#
#    0 AMB  20-2:2039    63 LYS  HG-         5.50    (#   2039:20  Single Ambig)
 &rst
  ixpk= 2039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 979, 980, 979, 980,
 igr2= 973, 974,
 &end
#
#    0 AMB  20-2:2040     0 AMB  20-1:2040   4.50    (#   2040:20  Double Ambig)
 &rst
  ixpk= 2040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 979, 980, 979, 980,
 igr2= 973, 974, 973, 974,
 &end
#
#   63 LYS  HB+          63 LYS  HG+         3.50    (#   2041:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 970, 971,
 igr2= 973, 974,
 &end
#
#   63 LYS  HB+          63 LYS  HG-         4.50    (#   2042:20  Unique         2.21, 2.69 A)
 &rst
  ixpk= 2042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 970, 971,
 igr2= 973, 974,
 &end
#
#   63 LYS  HN           63 LYS  HD-         5.50    (#   2045:20  Unique         1.92, 4.56 A)
 &rst
  ixpk= 2045, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 976, 977,
 &end
#
#   63 LYS  HN           63 LYS  HD+         5.50    (#   2046:20  Unique         1.92, 4.56 A)
 &rst
  ixpk= 2046, nxpk= 20, iat= 966,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 976, 977,
 &end
#
#    0 AMB  20-2:2047     0 AMB  20-1:2047   5.50    (#   2047:20  Double Ambig)
 &rst
  ixpk= 2047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2641, 968,
 igr2=2706,2707,2706,2707, 976, 977,
 &end
#
#   63 LYS  HA           63 LYS  HD-         5.50    (#   2048:20  Unique         2.77, 4.76 A)
 &rst
  ixpk= 2048, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 976, 977,
 &end
#
#    0 AMB  20-2:2049    63 LYS  HD-         4.50    (#   2049:20  Single Ambig)
 &rst
  ixpk= 2049, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 979, 980, 979, 980,
 igr2= 976, 977,
 &end
#
#    0 AMB  20-2:2050     0 AMB  20-1:2050   3.50    (#   2050:20  Double Ambig)
 &rst
  ixpk= 2050, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 973, 974,1456,1457,
 igr2= 976, 977,1459,1460,1459,1460,
 &end
#
#   63 LYS  HG+          63 LYS  HD-         3.50    (#   2051:20  Unique         2.22, 2.65 A)
 &rst
  ixpk= 2051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 973, 974,
 igr2= 976, 977,
 &end
#
#    0 AMB  20-2:2052     0 AMB  20-1:2052   5.50    (#   2052:20  Double Ambig)
 &rst
  ixpk= 2052, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 990,1503,
 igr2= 979, 980, 979, 980,1252,1253,1252,1253,
 &end
#
#   63 LYS  HA            0 AMB  20-1:2053   5.50    (#   2053:20  Single Ambig)
 &rst
  ixpk= 2053, nxpk= 20, iat= 968,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 979, 980, 979, 980,
 &end
#
#    0 AMB  20-2:2054     0 AMB  20-1:2054   5.50    (#   2054:20  Double Ambig)
 &rst
  ixpk= 2054, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 935, 936, 935, 936,
 igr2= 979, 980, 979, 980,
 &end
#
#   62 ARG  HA            0 AMB  20-1:2055   5.50    (#   2055:20  Single Ambig)
 &rst
  ixpk= 2055, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 979, 980, 979, 980,
 &end
#
#   61 SER  HB-           0 AMB  20-1:2056   5.50    (#   2056:20  Single Ambig)
 &rst
  ixpk= 2056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 935, 936,
 igr2= 979, 980, 979, 980,
 &end
#
#    0 AMB  20-2:2059     0 AMB  20-1:2059   5.50    (#   2059:20  Double Ambig)
 &rst
  ixpk= 2059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2= 992, 993, 992, 993, 992, 993,
 &end
#
#    0 AMB  20-2:2060     0 AMB  20-1:2060   5.50    (#   2060:20  Double Ambig)
 &rst
  ixpk= 2060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
 igr1=1740,1741,1742,1744,1745,1746, 829, 830, 831, 833,
       834, 835, 829, 830, 831, 833, 834, 835,
 igr2= 992, 993, 992, 993, 992, 993, 992, 993,
 &end
#
#  104 LEU  MDX           0 AMB  20-1:2061   5.50    (#   2061:20  Single Ambig)
 &rst
  ixpk= 2061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2= 992, 993, 992, 993,
 &end
#
#    0 AMB  20-2:2062     0 AMB  20-1:2062   5.50    (#   2062:20  Double Ambig)
 &rst
  ixpk= 2062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 igr2= 992, 993, 992, 993, 992, 993,
 &end
#
#   64 ASP  HA            0 AMB  20-1:2063   5.50    (#   2063:20  Single Ambig)
 &rst
  ixpk= 2063, nxpk= 20, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 992, 993, 992, 993,
 &end
#
#   65 VAL  HN            0 AMB  20-1:2064   5.50    (#   2064:20  Single Ambig)
 &rst
  ixpk= 2064, nxpk= 20, iat=1000,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 992, 993, 992, 993,
 &end
#
#   64 ASP  HN            0 AMB  20-1:2065   5.50    (#   2065:20  Single Ambig)
 &rst
  ixpk= 2065, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 992, 993, 992, 993,
 &end
#
#   61 SER  HN            0 AMB  20-1:2066   5.50    (#   2066:20  Single Ambig)
 &rst
  ixpk= 2066, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 992, 993, 992, 993,
 &end
#
#    0 AMB  20-2:2067    65 VAL  HA          5.50    (#   2067:20  Single Ambig)
 &rst
  ixpk= 2067, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1698,1040,
 &end
#
#  105 VAL  HN           65 VAL  HA          5.50    (#   2068:20  Unique         2.53, 2.96 A)
 &rst
  ixpk= 2068, nxpk= 20, iat=1734,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HN           65 VAL  HA          4.50    (#   2069:20  Unique         2.41, 2.60 A)
 &rst
  ixpk= 2069, nxpk= 20, iat=1016,1002, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HN           65 VAL  HA          5.50    (#   2070:20  Unique         2.89, 2.92 A)
 &rst
  ixpk= 2070, nxpk= 20, iat=1000,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HN           65 VAL  HA          5.50    (#   2071:20  Unique         4.39, 4.84 A)
 &rst
  ixpk= 2071, nxpk= 20, iat=1750,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HA           65 VAL  HA          5.50    (#   2073:20  Unique         3.43, 3.85 A)
 &rst
  ixpk= 2073, nxpk= 20, iat=1717,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HA           65 VAL  HA          5.50    (#   2074:20  Unique         4.82, 5.23 A)
 &rst
  ixpk= 2074, nxpk= 20, iat=1736,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HB           65 VAL  HA          5.50    (#   2075:20  Unique         3.12, 3.74 A)
 &rst
  ixpk= 2075, nxpk= 20, iat=1738,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 VAL  HB           65 VAL  HA          5.50    (#   2076:20  Unique         2.40, 2.47 A)
 &rst
  ixpk= 2076, nxpk= 20, iat=1004,1002, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2077    65 VAL  HA          5.50    (#   2077:20  Single Ambig)
 &rst
  ixpk= 2077, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1023,1024, 976, 977, 265, 266,
 &end
#
#  102 LEU  HB-          65 VAL  HA          5.50    (#   2078:20  Unique         3.95, 5.18 A)
 &rst
  ixpk= 2078, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#    0 AMB  20-2:2079    65 VAL  HA          3.50    (#   2079:20  Single Ambig)
 &rst
  ixpk= 2079, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1740,1741,1742,1744,1745,1746,1006,1007,1008,1010,
      1011,1012,
 &end
#
#  105 VAL  MGX          65 VAL  HA          4.50    (#   2080:20  Unique         1.93, 4.27 A)
 &rst
  ixpk= 2080, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:2082    65 VAL  HA          5.50    (#   2082:20  Single Ambig)
 &rst
  ixpk= 2082, nxpk= 20, iat=  -1,1002, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1020,1021,1050,1051,
 &end
#
#   66 ARG  HN           65 VAL  HB          5.50    (#   2083:20  Unique         1.86, 2.01 A)
 &rst
  ixpk= 2083, nxpk= 20, iat=1016,1004, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 VAL  HA           65 VAL  HB          5.50    (#   2084:20  Unique         2.40, 2.47 A)
 &rst
  ixpk= 2084, nxpk= 20, iat=1002,1004, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HB-          65 VAL  HB          5.50    (#   2085:20  Unique         1.97, 3.34 A)
 &rst
  ixpk= 2085, nxpk= 20, iat=  -1,1004, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#    0 AMB  20-2:2086    65 VAL  HB          4.50    (#   2086:20  Single Ambig)
 &rst
  ixpk= 2086, nxpk= 20, iat=  -1,1004, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1006,1007,1008,1010,1011,1012,1006,1007,1008,1010,
      1011,1012,
 &end
#
#   60 LEU  MDX          65 VAL  MGX         5.50    (#   2087:20  Unique         2.20, 6.49 A)
 &rst
  ixpk= 2087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 921, 922, 923, 925, 926, 927,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2088    65 VAL  MGX         3.50    (#   2088:20  Single Ambig)
 &rst
  ixpk= 2088, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 227, 228, 229,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2089    65 VAL  MGX         5.50    (#   2089:20  Single Ambig)
 &rst
  ixpk= 2089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1719,1720, 973, 974, 973, 974, 350, 351, 352,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   65 VAL  HB           65 VAL  MGX         3.50    (#   2090:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2090, nxpk= 20, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   62 ARG  HA           65 VAL  MGX         4.50    (#   2091:20  Unique         1.96, 3.60 A)
 &rst
  ixpk= 2091, nxpk= 20, iat= 944,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   65 VAL  HA           65 VAL  MGX         5.50    (#   2092:20  Unique         2.25, 3.47 A)
 &rst
  ixpk= 2092, nxpk= 20, iat=1002,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   51 TYR  HE           65 VAL  MGX         4.50    (#   2093:20  Unique         1.94, 5.73 A)
 &rst
  ixpk= 2093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 775, 780,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   51 TYR  HD           65 VAL  MGX         5.50    (#   2094:20  Unique         2.08, 5.82 A)
 &rst
  ixpk= 2094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 773, 782,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   65 VAL  HN           65 VAL  MGX         3.50    (#   2095:20  Unique         2.03, 3.56 A)
 &rst
  ixpk= 2095, nxpk= 20, iat=1000,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   64 ASP  HN           65 VAL  MGX         5.50    (#   2096:20  Unique         2.55, 4.16 A)
 &rst
  ixpk= 2096, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2097    65 VAL  MGX         5.50    (#   2097:20  Single Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1040,1698,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#  103 GLN  HN            0 AMB  20-1:2098   5.50    (#   2098:20  Single Ambig)
 &rst
  ixpk= 2098, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#  105 VAL  HN          105 VAL  MGY         4.50    (#   2099:20  Unique         1.98, 3.73 A)
 &rst
  ixpk= 2099, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:2100     0 AMB  20-1:2100   5.50    (#   2100:20  Double Ambig)
 &rst
  ixpk= 2100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1715, 874,
 igr2=1740,1741,1742,1744,1745,1746,1878,1879,1880,1006,
      1007,1008,1010,1011,1012,
 &end
#
#   66 ARG  HN            0 AMB  20-1:2101   4.50    (#   2101:20  Single Ambig)
 &rst
  ixpk= 2101, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#    0 AMB  20-2:2102     0 AMB  20-1:2102   4.50    (#   2102:20  Double Ambig)
 &rst
  ixpk= 2102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=1000,1833,1834,
 igr2=1006,1007,1008,1010,1011,1012,1878,1879,1880,
 &end
#
#   51 TYR  HD           65 VAL  MGY         5.50    (#   2103:20  Unique         2.08, 5.82 A)
 &rst
  ixpk= 2103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 773, 782,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#   65 VAL  HA            0 AMB  20-1:2104   4.50    (#   2104:20  Single Ambig)
 &rst
  ixpk= 2104, nxpk= 20, iat=1002,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2=1740,1741,1742,1744,1745,1746,1006,1007,1008,1010,
      1011,1012,
 &end
#
#    0 AMB  20-2:2105     0 AMB  20-1:2105   4.50    (#   2105:20  Double Ambig)
 &rst
  ixpk= 2105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1717,1888, 914,1857,
 igr2=1006,1007,1008,1010,1011,1012,1878,1879,1880,1740,
      1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  HA          105 VAL  MGY         3.50    (#   2106:20  Unique         2.18, 3.17 A)
 &rst
  ixpk= 2106, nxpk= 20, iat=1736,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:2107     0 AMB  20-1:2107   5.50    (#   2107:20  Double Ambig)
 &rst
  ixpk= 2107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1026,1027,1026,1027,1026,1027,
 igr2=1740,1741,1742,1744,1745,1746,1006,1007,1008,1010,
      1011,1012,
 &end
#
#  105 VAL  HB          105 VAL  MGY         2.80    (#   2108:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2108, nxpk= 20, iat=1738,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#   65 VAL  HB           65 VAL  MGY         3.50    (#   2109:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2109, nxpk= 20, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2110     0 AMB  20-1:2110   5.50    (#   2110:20  Double Ambig)
 &rst
  ixpk= 2110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1= 218,1842,1843,1842,1843,1044,
 igr2=1006,1007,1008,1010,1011,1012,1878,1879,1880,
 &end
#
#   66 ARG  HB+         105 VAL  MGY         4.50    (#   2111:20  Unique         2.35, 4.34 A)
 &rst
  ixpk= 2111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1020,1021,
 igr2=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  20-2:2112     0 AMB  20-1:2112   4.50    (#   2112:20  Double Ambig)
 &rst
  ixpk= 2112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 827,1020,1021,1683,1684,
 igr2=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#  102 LEU  HG           65 VAL  MGY         4.50    (#   2113:20  Unique         1.99, 5.07 A)
 &rst
  ixpk= 2113, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2114    65 VAL  MGY         4.50    (#   2114:20  Single Ambig)
 &rst
  ixpk= 2114, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1683,1684, 949, 950,
 igr2=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:2115     0 AMB  20-1:2115   5.50    (#   2115:20  Double Ambig)
 &rst
  ixpk= 2115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1740,1741,1742,1744,1745,1746,1068,1069,1070,1072,
      1073,1074,
 igr2=1020,1021,1020,1021,
 &end
#
#    0 AMB  20-2:2116    66 ARG  HB-         5.50    (#   2116:20  Single Ambig)
 &rst
  ixpk= 2116, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1740,1741,1742,1744,1745,1746,1068,1069,1070,1072,
      1073,1074,
 igr2=1020,1021,
 &end
#
#  105 VAL  MGY          66 ARG  HB+         5.50    (#   2117:20  Unique         2.35, 4.34 A)
 &rst
  ixpk= 2117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1020,1021,
 &end
#
#  105 VAL  MGY          66 ARG  HB-         5.50    (#   2118:20  Unique         2.35, 4.34 A)
 &rst
  ixpk= 2118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1020,1021,
 &end
#
#    0 AMB  20-2:2119     0 AMB  20-1:2119   4.50    (#   2119:20  Double Ambig)
 &rst
  ixpk= 2119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1026,1027,1026,1027,
 igr2=1020,1021,1020,1021,
 &end
#
#    0 AMB  20-2:2120    66 ARG  HB-         5.50    (#   2120:20  Single Ambig)
 &rst
  ixpk= 2120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1026,1027,1026,1027,
 igr2=1020,1021,
 &end
#
#   66 ARG  HA           66 ARG  HB+         5.50    (#   2121:20  Unique         2.32, 2.68 A)
 &rst
  ixpk= 2121, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#  104 LEU  HA           66 ARG  HB+         5.50    (#   2123:20  Unique         5.15, 6.20 A)
 &rst
  ixpk= 2123, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#  104 LEU  HA           66 ARG  HB-         5.50    (#   2124:20  Unique         5.15, 6.20 A)
 &rst
  ixpk= 2124, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#   66 ARG  HE           66 ARG  HB-         5.50    (#   2125:20  Unique         3.98, 4.35 A)
 &rst
  ixpk= 2125, nxpk= 20, iat=1029,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#   66 ARG  HN           66 ARG  HB+         5.50    (#   2127:20  Unique         2.66, 3.18 A)
 &rst
  ixpk= 2127, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#   66 ARG  HN           66 ARG  HB-         5.50    (#   2128:20  Unique         2.66, 3.18 A)
 &rst
  ixpk= 2128, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#    0 AMB  20-2:2129     0 AMB  20-1:2129   5.50    (#   2129:20  Double Ambig)
 &rst
  ixpk= 2129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1040,1698,
 igr2=1023,1024,1023,1024,
 &end
#
#    0 AMB  20-2:2130    66 ARG  HG-         5.50    (#   2130:20  Single Ambig)
 &rst
  ixpk= 2130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1040,1698,
 igr2=1023,1024,
 &end
#
#   66 ARG  HN           66 ARG  HG+         5.50    (#   2131:20  Unique         4.15, 4.63 A)
 &rst
  ixpk= 2131, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#   66 ARG  HN           66 ARG  HG-         5.50    (#   2132:20  Unique         4.15, 4.63 A)
 &rst
  ixpk= 2132, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2133     0 AMB  20-1:2133   5.50    (#   2133:20  Double Ambig)
 &rst
  ixpk= 2133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1029, 446, 454,
 igr2=1023,1024,1926,1927,
 &end
#
#   66 ARG  HE           66 ARG  HG-         5.50    (#   2134:20  Unique         2.09, 2.75 A)
 &rst
  ixpk= 2134, nxpk= 20, iat=1029,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#   66 ARG  HA           66 ARG  HG+         5.50    (#   2135:20  Unique         3.19, 3.57 A)
 &rst
  ixpk= 2135, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#   66 ARG  HA           66 ARG  HG-         5.50    (#   2136:20  Unique         3.19, 3.57 A)
 &rst
  ixpk= 2136, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2137    66 ARG  HG-         3.50    (#   2137:20  Single Ambig)
 &rst
  ixpk= 2137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1026,1027,1026,1027,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2138     0 AMB  20-1:2138   2.80    (#   2138:20  Double Ambig)
 &rst
  ixpk= 2138, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1026,1027,1026,1027,
 igr2=1023,1024,1023,1024,
 &end
#
#   68 LEU  MDY          66 ARG  HG+         3.50    (#   2139:20  Unique         1.86, 4.81 A)
 &rst
  ixpk= 2139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1068,1069,1070,1072,1073,1074,
 igr2=1023,1024,
 &end
#
#   68 LEU  MDY          66 ARG  HG-         4.50    (#   2140:20  Unique         1.86, 4.81 A)
 &rst
  ixpk= 2140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1068,1069,1070,1072,1073,1074,
 igr2=1023,1024,
 &end
#
#    0 AMB  20-2:2141    82 ARG  HG-         3.50    (#   2141:20  Single Ambig)
 &rst
  ixpk= 2141, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 igr2=1323,1324,
 &end
#
#  105 VAL  MGY          66 ARG  HG-         3.50    (#   2142:20  Unique         3.99, 6.24 A)
 &rst
  ixpk= 2142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1023,1024,
 &end
#
#   67 ILE  HN            0 AMB  20-1:2143   5.50    (#   2143:20  Single Ambig)
 &rst
  ixpk= 2143, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1026,1027,1026,1027,
 &end
#
#    0 AMB  20-2:2144     0 AMB  20-1:2144   4.50    (#   2144:20  Double Ambig)
 &rst
  ixpk= 2144, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 495,2311,
 igr2= 400, 401, 400, 401,2321,2322,
 &end
#
#   66 ARG  HE            0 AMB  20-1:2145   3.50    (#   2145:20  Single Ambig)
 &rst
  ixpk= 2145, nxpk= 20, iat=1029,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1026,1027,1026,1027,
 &end
#
#  159 GLN  HE2-          0 AMB  20-1:2146   4.50    (#   2146:20  Single Ambig)
 &rst
  ixpk= 2146, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2634,2635,
 igr2= 268, 269, 268, 269,
 &end
#
#   66 ARG  HG-           0 AMB  20-1:2147   4.50    (#   2147:20  Single Ambig)
 &rst
  ixpk= 2147, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1023,1024,
 igr2=1026,1027,1026,1027,
 &end
#
#   67 ILE  QG2          67 ILE  HA          4.50    (#   2148:20  Unique         2.10, 2.98 A)
 &rst
  ixpk= 2148, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1046,1047,1048,
 &end
#
#  102 LEU  MDY          67 ILE  HA          4.50    (#   2149:20  Unique         1.94, 4.16 A)
 &rst
  ixpk= 2149, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1688,1689,1690,1692,1693,1694,
 &end
#
#   67 ILE  HG1+         67 ILE  HA          4.50    (#   2150:20  Unique         2.52, 2.96 A)
 &rst
  ixpk= 2150, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1050,1051,
 &end
#
#   67 ILE  HG1-         67 ILE  HA          5.50    (#   2151:20  Unique         2.52, 2.96 A)
 &rst
  ixpk= 2151, nxpk= 20, iat=  -1,1042, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1050,1051,
 &end
#
#    0 AMB  20-2:2152     0 AMB  20-1:2152   5.50    (#   2152:20  Double Ambig)
 &rst
  ixpk= 2152, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 933,1018,
 igr2= 767,1042,
 &end
#
#   68 LEU  HN           67 ILE  HB          5.50    (#   2153:20  Unique         4.13, 4.26 A)
 &rst
  ixpk= 2153, nxpk= 20, iat=1059,1044, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HN           67 ILE  HB          4.50    (#   2154:20  Unique         2.58, 2.71 A)
 &rst
  ixpk= 2154, nxpk= 20, iat=1040,1044, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 ILE  HA           67 ILE  HB          5.50    (#   2156:20  Unique         2.95, 3.01 A)
 &rst
  ixpk= 2156, nxpk= 20, iat=1042,1044, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HG1-         67 ILE  HB          5.50    (#   2157:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 2157, nxpk= 20, iat=  -1,1044, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1050,1051,
 &end
#
#   67 ILE  QG2          67 ILE  HB          3.50    (#   2158:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2158, nxpk= 20, iat=  -1,1044, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1046,1047,1048,
 &end
#
#   67 ILE  QD1          67 ILE  HB          4.50    (#   2159:20  Unique         2.03, 3.03 A)
 &rst
  ixpk= 2159, nxpk= 20, iat=  -1,1044, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1053,1054,1055,
 &end
#
#   67 ILE  HG1+         67 ILE  HB          4.50    (#   2160:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 2160, nxpk= 20, iat=  -1,1044, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1050,1051,
 &end
#
#    0 AMB  20-2:2162    67 ILE  HG1-        4.50    (#   2162:20  Single Ambig)
 &rst
  ixpk= 2162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1688,1689,1690,1692,1693,1694,1053,1054,1055,
 igr2=1050,1051,
 &end
#
#    0 AMB  20-2:2163     0 AMB  20-1:2163   3.50    (#   2163:20  Double Ambig)
 &rst
  ixpk= 2163, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2321,2322,2394,2395,2394,2395, 460, 461,
 igr2=2192,2193,2391,2392, 421, 422,
 &end
#
#    0 AMB  20-2:2164     0 AMB  20-1:2164   4.50    (#   2164:20  Double Ambig)
 &rst
  ixpk= 2164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2187,1042,
 igr2=2192,2193,1050,1051,
 &end
#
#   67 ILE  HN           67 ILE  HG1-        5.50    (#   2165:20  Unique         1.83, 2.71 A)
 &rst
  ixpk= 2165, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1050,1051,
 &end
#
#   67 ILE  HN           67 ILE  QD1         4.50    (#   2166:20  Unique         2.45, 3.94 A)
 &rst
  ixpk= 2166, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1053,1054,1055,
 &end
#
#    0 AMB  20-2:2167    67 ILE  QD1         4.50    (#   2167:20  Single Ambig)
 &rst
  ixpk= 2167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1029, 773, 782,
 igr2=1053,1054,1055,
 &end
#
#   51 TYR  HE           67 ILE  QD1         5.50    (#   2168:20  Unique         3.53, 4.85 A)
 &rst
  ixpk= 2168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 775, 780,
 igr2=1053,1054,1055,
 &end
#
#   67 ILE  HA           67 ILE  QD1         5.50    (#   2170:20  Unique         4.31, 4.68 A)
 &rst
  ixpk= 2170, nxpk= 20, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1053,1054,1055,
 &end
#
#   67 ILE  HB           67 ILE  QD1         3.50    (#   2171:20  Unique         2.03, 3.03 A)
 &rst
  ixpk= 2171, nxpk= 20, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1053,1054,1055,
 &end
#
#   67 ILE  HG1-         67 ILE  QD1         2.80    (#   2172:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 2172, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1050,1051,
 igr2=1053,1054,1055,
 &end
#
#   47 GLU  HG+          67 ILE  QD1         5.50    (#   2173:20  Unique         2.68, 5.03 A)
 &rst
  ixpk= 2173, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 713, 714,
 igr2=1053,1054,1055,
 &end
#
#   67 ILE  QG2          67 ILE  QD1         3.50    (#   2175:20  Unique         2.07, 3.91 A)
 &rst
  ixpk= 2175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1046,1047,1048,
 igr2=1053,1054,1055,
 &end
#
#   67 ILE  HG1+         67 ILE  QD1         4.50    (#   2176:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 2176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,
 igr2=1053,1054,1055,
 &end
#
#   50 MET  ME           67 ILE  QD1         3.50    (#   2177:20  Unique         1.98, 4.67 A)
 &rst
  ixpk= 2177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 759, 760, 761,
 igr2=1053,1054,1055,
 &end
#
#   68 LEU  HN           67 ILE  QG2         4.50    (#   2178:20  Unique         2.57, 4.02 A)
 &rst
  ixpk= 2178, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1046,1047,1048,
 &end
#
#    0 AMB  20-2:2179    67 ILE  QG2         4.50    (#   2179:20  Single Ambig)
 &rst
  ixpk= 2179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1040,1698,
 igr2=1046,1047,1048,
 &end
#
#  101 LEU  HN           67 ILE  QG2         5.50    (#   2180:20  Unique         3.84, 5.31 A)
 &rst
  ixpk= 2180, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1046,1047,1048,
 &end
#
#   69 ALA  HN           67 ILE  QG2         4.50    (#   2181:20  Unique         2.31, 4.09 A)
 &rst
  ixpk= 2181, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1046,1047,1048,
 &end
#
#   66 ARG  HE           67 ILE  QG2         4.50    (#   2182:20  Unique         4.69, 5.36 A)
 &rst
  ixpk= 2182, nxpk= 20, iat=1029,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1046,1047,1048,
 &end
#
#  102 LEU  HA           67 ILE  QG2         5.50    (#   2183:20  Unique         4.18, 5.27 A)
 &rst
  ixpk= 2183, nxpk= 20, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1046,1047,1048,
 &end
#
#   69 ALA  HA           67 ILE  QG2         5.50    (#   2185:20  Unique         4.24, 5.35 A)
 &rst
  ixpk= 2185, nxpk= 20, iat=1080,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1046,1047,1048,
 &end
#
#   68 LEU  HA           67 ILE  QG2         5.50    (#   2186:20  Unique         4.15, 5.27 A)
 &rst
  ixpk= 2186, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1046,1047,1048,
 &end
#
#   67 ILE  HA           67 ILE  QG2         4.50    (#   2187:20  Unique         2.10, 2.98 A)
 &rst
  ixpk= 2187, nxpk= 20, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1046,1047,1048,
 &end
#
#   70 SER  HB+          67 ILE  QG2         5.50    (#   2188:20  Unique         3.17, 4.80 A)
 &rst
  ixpk= 2188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1092,1093,
 igr2=1046,1047,1048,
 &end
#
#   70 SER  HB-          67 ILE  QG2         5.50    (#   2189:20  Unique         3.17, 4.80 A)
 &rst
  ixpk= 2189, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1092,1093,
 igr2=1046,1047,1048,
 &end
#
#    0 AMB  20-2:2190    67 ILE  QG2         5.50    (#   2190:20  Single Ambig)
 &rst
  ixpk= 2190, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1644,1645,1644,1645,
 igr2=1046,1047,1048,
 &end
#
#   67 ILE  HB           67 ILE  QG2         3.50    (#   2191:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2191, nxpk= 20, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1046,1047,1048,
 &end
#
#   67 ILE  HG1-         67 ILE  QG2         4.50    (#   2192:20  Unique         1.95, 3.39 A)
 &rst
  ixpk= 2192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1050,1051,
 igr2=1046,1047,1048,
 &end
#
#    0 AMB  20-2:2193    67 ILE  QG2         5.50    (#   2193:20  Single Ambig)
 &rst
  ixpk= 2193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=1063,1064,1082,1083,1084,
 igr2=1046,1047,1048,
 &end
#
#   50 MET  ME           67 ILE  QG2         5.50    (#   2194:20  Unique         2.59, 4.83 A)
 &rst
  ixpk= 2194, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 759, 760, 761,
 igr2=1046,1047,1048,
 &end
#
#    0 AMB  20-2:2195    67 ILE  QG2         3.50    (#   2195:20  Single Ambig)
 &rst
  ixpk= 2195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1050,1051,1688,1689,1690,1692,1693,1694,
 igr2=1046,1047,1048,
 &end
#
#   68 LEU  HN           68 LEU  HB+         5.50    (#   2196:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 2196, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#   68 LEU  HN           68 LEU  HB-         5.50    (#   2197:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 2197, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#   69 ALA  HN           68 LEU  HB+         5.50    (#   2198:20  Unique         2.84, 3.26 A)
 &rst
  ixpk= 2198, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#   69 ALA  HN           68 LEU  HB-         5.50    (#   2199:20  Unique         2.84, 3.26 A)
 &rst
  ixpk= 2199, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#   68 LEU  HA           68 LEU  HB+         5.50    (#   2200:20  Unique         2.29, 2.81 A)
 &rst
  ixpk= 2200, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#   68 LEU  HA           68 LEU  HB-         5.50    (#   2201:20  Unique         2.29, 2.81 A)
 &rst
  ixpk= 2201, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1063,1064,
 &end
#
#    0 AMB  20-2:2202    60 LEU  HB-         5.50    (#   2202:20  Single Ambig)
 &rst
  ixpk= 2202, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 824, 825,1686,
 igr2= 916, 917,
 &end
#
#   66 ARG  HG+          68 LEU  HB-         5.50    (#   2203:20  Unique         3.32, 5.09 A)
 &rst
  ixpk= 2203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1023,1024,
 igr2=1063,1064,
 &end
#
#    0 AMB  20-2:2204     0 AMB  20-1:2204   5.50    (#   2204:20  Double Ambig)
 &rst
  ixpk= 2204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=2549,2550,2551,2553,2554,2555,1667,1664,1665,
 igr2=1063,1064,1063,1064,1063,1064,
 &end
#
#    0 AMB  20-2:2205    68 LEU  HB-         5.50    (#   2205:20  Single Ambig)
 &rst
  ixpk= 2205, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2549,2550,2551,2553,2554,2555,1667,1664,1665,
 igr2=1063,1064,
 &end
#
#    0 AMB  20-2:2206     0 AMB  20-1:2206   4.50    (#   2206:20  Double Ambig)
 &rst
  ixpk= 2206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 829, 830, 831, 833, 834, 835,1068,1069,1070,1072,
      1073,1074,
 igr2= 916, 917,1063,1064,
 &end
#
#   68 LEU  MDY          68 LEU  HB-         4.50    (#   2207:20  Unique         2.16, 3.35 A)
 &rst
  ixpk= 2207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1068,1069,1070,1072,1073,1074,
 igr2=1063,1064,
 &end
#
#   68 LEU  HG           68 LEU  HB-         4.50    (#   2208:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 2208, nxpk= 20, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1063,1064,
 &end
#
#  101 LEU  MDY          68 LEU  HB+         5.50    (#   2209:20  Unique         2.17, 5.33 A)
 &rst
  ixpk= 2209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1063,1064,
 &end
#
#  101 LEU  MDY          68 LEU  HB-         5.50    (#   2210:20  Unique         2.17, 5.33 A)
 &rst
  ixpk= 2210, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1063,1064,
 &end
#
#    0 AMB  20-2:2211     0 AMB  20-1:2211   4.50    (#   2211:20  Double Ambig)
 &rst
  ixpk= 2211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=1669,1670,1671,1673,1674,1675,1066,
 igr2=1063,1064,1063,1064,
 &end
#
#  101 LEU  MDY          68 LEU  HG          5.50    (#   2213:20  Unique         4.12, 6.99 A)
 &rst
  ixpk= 2213, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:2214    68 LEU  HG          4.50    (#   2214:20  Single Ambig)
 &rst
  ixpk= 2214, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=2549,2550,2551,2553,2554,2555,1667,2565,2566,2567,
      2569,2570,2571,
 &end
#
#  158 LEU  MDY          68 LEU  HG          3.50    (#   2215:20  Unique         2.31, 5.74 A)
 &rst
  ixpk= 2215, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2612,2613,2614,2616,2617,2618,
 &end
#
#   68 LEU  HB-          68 LEU  HG          4.50    (#   2216:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 2216, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   68 LEU  HB+          68 LEU  HG          4.50    (#   2217:20  Unique         2.24, 2.62 A)
 &rst
  ixpk= 2217, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   66 ARG  HG+          68 LEU  HG          4.50    (#   2218:20  Unique         1.99, 3.35 A)
 &rst
  ixpk= 2218, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#  103 GLN  HB+          68 LEU  HG          4.50    (#   2219:20  Unique         2.63, 3.90 A)
 &rst
  ixpk= 2219, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1702,1703,
 &end
#
#    0 AMB  20-2:2220    68 LEU  HG          5.50    (#   2220:20  Single Ambig)
 &rst
  ixpk= 2220, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1705,1706,1705,1706,
 &end
#
#    0 AMB  20-2:2221    68 LEU  HG          5.50    (#   2221:20  Single Ambig)
 &rst
  ixpk= 2221, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1026,1027,1026,1027,
 &end
#
#   68 LEU  HA           68 LEU  HG          5.50    (#   2223:20  Unique         2.71, 3.09 A)
 &rst
  ixpk= 2223, nxpk= 20, iat=1061,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HA           68 LEU  HG          5.50    (#   2224:20  Unique         4.90, 5.38 A)
 &rst
  ixpk= 2224, nxpk= 20, iat=1700,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2-         68 LEU  HG          5.50    (#   2225:20  Unique         3.28, 5.05 A)
 &rst
  ixpk= 2225, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   69 ALA  HN           68 LEU  HG          5.50    (#   2226:20  Unique         4.46, 5.09 A)
 &rst
  ixpk= 2226, nxpk= 20, iat=1078,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2227    68 LEU  HG          5.50    (#   2227:20  Single Ambig)
 &rst
  ixpk= 2227, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1698,1040,
 &end
#
#   68 LEU  HN           68 LEU  HG          5.50    (#   2228:20  Unique         3.34, 3.86 A)
 &rst
  ixpk= 2228, nxpk= 20, iat=1059,1066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2229    75 LEU  MDY         5.50    (#   2229:20  Single Ambig)
 &rst
  ixpk= 2229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1137,1151,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  147 VAL  HN           75 LEU  MDY         5.50    (#   2230:20  Unique         3.10, 6.54 A)
 &rst
  ixpk= 2230, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2231    75 LEU  MDY         5.50    (#   2231:20  Single Ambig)
 &rst
  ixpk= 2231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1146,1147,2408,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2232     0 AMB  20-1:2232   5.50    (#   2232:20  Double Ambig)
 &rst
  ixpk= 2232, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1624,1710,1711,
 igr2=1184,1185,1186,1188,1189,1190,1068,1069,1070,1072,
      1073,1074,
 &end
#
#    0 AMB  20-2:2233     0 AMB  20-1:2233   5.50    (#   2233:20  Double Ambig)
 &rst
  ixpk= 2233, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1=1029,1710,1711,1226,1235,
 igr2=1068,1069,1070,1072,1073,1074,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:2234    75 LEU  MDY         5.50    (#   2234:20  Single Ambig)
 &rst
  ixpk= 2234, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1103,1153,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  143 VAL  HA           75 LEU  MDY         5.50    (#   2235:20  Unique         3.15, 5.90 A)
 &rst
  ixpk= 2235, nxpk= 20, iat=2349,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2236    75 LEU  MDY         5.50    (#   2236:20  Single Ambig)
 &rst
  ixpk= 2236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1141,1142,2434,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2237    75 LEU  MDY         5.50    (#   2237:20  Single Ambig)
 &rst
  ixpk= 2237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2351,2469,2470,2455,2456,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  150 GLU  HG+          75 LEU  MDY         5.50    (#   2238:20  Unique         3.49, 6.32 A)
 &rst
  ixpk= 2238, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2494,2495,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2239    68 LEU  MDX         5.50    (#   2239:20  Single Ambig)
 &rst
  ixpk= 2239, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1082,1083,1084,1063,1064,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#  147 VAL  MGY          75 LEU  MDY         4.50    (#   2240:20  Unique         2.71, 7.24 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   84 VAL  MGX          79 LEU  MDX         5.50    (#   2243:20  Unique         1.97, 5.69 A)
 &rst
  ixpk= 2243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   68 LEU  HN           68 LEU  MDY         5.50    (#   2244:20  Unique         1.79, 4.93 A)
 &rst
  ixpk= 2244, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#  103 GLN  HN           68 LEU  MDY         5.50    (#   2245:20  Unique         1.99, 6.18 A)
 &rst
  ixpk= 2245, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   69 ALA  HN           68 LEU  MDY         5.50    (#   2247:20  Unique         1.99, 5.59 A)
 &rst
  ixpk= 2247, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   68 LEU  HA           68 LEU  MDY         2.80    (#   2248:20  Unique         1.99, 3.52 A)
 &rst
  ixpk= 2248, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   67 ILE  HA           68 LEU  MDY         5.50    (#   2249:20  Unique         3.17, 6.59 A)
 &rst
  ixpk= 2249, nxpk= 20, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#    0 AMB  20-2:2250    68 LEU  MDY         4.50    (#   2250:20  Single Ambig)
 &rst
  ixpk= 2250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1026,1027,1026,1027,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   68 LEU  HB-          68 LEU  MDY         4.50    (#   2252:20  Unique         2.16, 3.35 A)
 &rst
  ixpk= 2252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1063,1064,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#    0 AMB  20-2:2253    68 LEU  MDY         4.50    (#   2253:20  Single Ambig)
 &rst
  ixpk= 2253, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1082,1083,1084,1063,1064,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   66 ARG  HG+          68 LEU  MDY         2.80    (#   2254:20  Unique         1.86, 4.81 A)
 &rst
  ixpk= 2254, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1023,1024,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   66 ARG  HB+          68 LEU  MDY         3.50    (#   2255:20  Unique         3.33, 6.70 A)
 &rst
  ixpk= 2255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1020,1021,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#    0 AMB  20-2:2256    68 LEU  MDY         5.50    (#   2256:20  Single Ambig)
 &rst
  ixpk= 2256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1705,1706,1705,1706,
 igr2=1068,1069,1070,1072,1073,1074,
 &end
#
#   70 SER  HN           69 ALA  HA          3.50    (#   2257:20  Unique         2.24, 2.43 A)
 &rst
  ixpk= 2257, nxpk= 20, iat=1088,1080, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 ALA  HN           69 ALA  HA          5.50    (#   2258:20  Unique         2.88, 2.92 A)
 &rst
  ixpk= 2258, nxpk= 20, iat=1078,1080, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  MB           69 ALA  HA          3.50    (#   2260:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2260, nxpk= 20, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1082,1083,1084,
 &end
#
#    0 AMB  20-2:2261    69 ALA  HA          5.50    (#   2261:20  Single Ambig)
 &rst
  ixpk= 2261, nxpk= 20, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1664,1665,1068,1069,1070,1072,1073,1074,
 &end
#
#  154 VAL  MGY          69 ALA  HA          5.50    (#   2262:20  Unique         3.34, 5.36 A)
 &rst
  ixpk= 2262, nxpk= 20, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#   68 LEU  MDY          69 ALA  HA          5.50    (#   2263:20  Unique         3.83, 6.72 A)
 &rst
  ixpk= 2263, nxpk= 20, iat=  -1,1080, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#  101 LEU  HB-          69 ALA  MB          5.50    (#   2264:20  Unique         1.98, 3.06 A)
 &rst
  ixpk= 2264, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1664,1665,
 igr2=1082,1083,1084,
 &end
#
#  101 LEU  MDY          69 ALA  MB          3.50    (#   2266:20  Unique         1.99, 4.99 A)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1082,1083,1084,
 &end
#
#  101 LEU  MDX          69 ALA  MB          4.50    (#   2267:20  Unique         1.99, 4.99 A)
 &rst
  ixpk= 2267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1082,1083,1084,
 &end
#
#  154 VAL  MGY          69 ALA  MB          3.50    (#   2268:20  Unique         1.98, 4.10 A)
 &rst
  ixpk= 2268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2549,2550,2551,2553,2554,2555,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-2:2269    69 ALA  MB          2.80    (#   2269:20  Single Ambig)
 &rst
  ixpk= 2269, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1=1664,1665,2549,2550,2551,2553,2554,2555,1667,
 igr2=1082,1083,1084,
 &end
#
#  154 VAL  HB           69 ALA  MB          5.50    (#   2270:20  Unique         3.17, 4.22 A)
 &rst
  ixpk= 2270, nxpk= 20, iat=2547,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-2:2271    69 ALA  MB          5.50    (#   2271:20  Single Ambig)
 &rst
  ixpk= 2271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1092,1093,1620,1621,
 igr2=1082,1083,1084,
 &end
#
#  151 PHE  HB+          69 ALA  MB          5.50    (#   2272:20  Unique         2.19, 3.78 A)
 &rst
  ixpk= 2272, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2506,2507,
 igr2=1082,1083,1084,
 &end
#
#  154 VAL  HA           69 ALA  MB          5.50    (#   2273:20  Unique         4.99, 6.16 A)
 &rst
  ixpk= 2273, nxpk= 20, iat=2545,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   68 LEU  HA           69 ALA  MB          5.50    (#   2274:20  Unique         4.80, 5.70 A)
 &rst
  ixpk= 2274, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   69 ALA  HA           69 ALA  MB          2.80    (#   2275:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2275, nxpk= 20, iat=1080,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1082,1083,1084,
 &end
#
#  101 LEU  HA           69 ALA  MB          5.50    (#   2277:20  Unique         4.49, 5.46 A)
 &rst
  ixpk= 2277, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   70 SER  HA           69 ALA  MB          5.50    (#   2278:20  Unique         3.92, 4.83 A)
 &rst
  ixpk= 2278, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#  103 GLN  HE2-         69 ALA  MB          5.50    (#   2279:20  Unique         4.52, 7.22 A)
 &rst
  ixpk= 2279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1710,1711,
 igr2=1082,1083,1084,
 &end
#
#  154 VAL  HN           69 ALA  MB          5.50    (#   2280:20  Unique         5.61, 6.27 A)
 &rst
  ixpk= 2280, nxpk= 20, iat=2543,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   69 ALA  HN           69 ALA  MB          4.50    (#   2281:20  Unique         2.56, 3.34 A)
 &rst
  ixpk= 2281, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1082,1083,1084,
 &end
#
#   70 SER  HN           69 ALA  MB          3.50    (#   2282:20  Unique         1.95, 3.24 A)
 &rst
  ixpk= 2282, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1082,1083,1084,
 &end
#
#  101 LEU  HN           69 ALA  MB          5.50    (#   2283:20  Unique         2.52, 4.17 A)
 &rst
  ixpk= 2283, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   71 THR  HN           69 ALA  MB          5.50    (#   2284:20  Unique         5.03, 6.36 A)
 &rst
  ixpk= 2284, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   68 LEU  HN           69 ALA  MB          5.50    (#   2285:20  Unique         4.23, 5.21 A)
 &rst
  ixpk= 2285, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   71 THR  HN           70 SER  HA          4.50    (#   2287:20  Unique         2.15, 2.23 A)
 &rst
  ixpk= 2287, nxpk= 20, iat=1099,1090, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  101 LEU  HN           70 SER  HA          5.50    (#   2288:20  Unique         2.05, 2.86 A)
 &rst
  ixpk= 2288, nxpk= 20, iat=1660,1090, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HN           70 SER  HA          5.50    (#   2289:20  Unique         2.88, 2.89 A)
 &rst
  ixpk= 2289, nxpk= 20, iat=1088,1090, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HB+          70 SER  HA          5.50    (#   2293:20  Unique         2.25, 2.49 A)
 &rst
  ixpk= 2293, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#   70 SER  HB-          70 SER  HA          5.50    (#   2294:20  Unique         2.25, 2.49 A)
 &rst
  ixpk= 2294, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#    0 AMB  20-2:2295    70 SER  HA          5.50    (#   2295:20  Single Ambig)
 &rst
  ixpk= 2295, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1644,1645,1644,1645,
 &end
#
#   69 ALA  MB           70 SER  HA          5.50    (#   2296:20  Unique         3.92, 4.83 A)
 &rst
  ixpk= 2296, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1082,1083,1084,
 &end
#
#   71 THR  MG2          70 SER  HA          5.50    (#   2297:20  Unique         3.79, 5.59 A)
 &rst
  ixpk= 2297, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1105,1106,1107,
 &end
#
#  101 LEU  HB+          70 SER  HA          5.50    (#   2298:20  Unique         3.42, 4.75 A)
 &rst
  ixpk= 2298, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1664,1665,
 &end
#
#   71 THR  HN           70 SER  HB+         5.50    (#   2299:20  Unique         2.30, 3.48 A)
 &rst
  ixpk= 2299, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   71 THR  HN           70 SER  HB-         5.50    (#   2300:20  Unique         2.30, 3.48 A)
 &rst
  ixpk= 2300, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#  101 LEU  HN           70 SER  HB+         5.50    (#   2301:20  Unique         3.55, 4.90 A)
 &rst
  ixpk= 2301, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#  101 LEU  HN           70 SER  HB-         5.50    (#   2302:20  Unique         3.55, 4.90 A)
 &rst
  ixpk= 2302, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   70 SER  HN           70 SER  HB+         5.50    (#   2303:20  Unique         2.98, 3.67 A)
 &rst
  ixpk= 2303, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   70 SER  HN           70 SER  HB-         5.50    (#   2304:20  Unique         2.98, 3.67 A)
 &rst
  ixpk= 2304, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   70 SER  HA           70 SER  HB+         5.50    (#   2309:20  Unique         2.25, 2.49 A)
 &rst
  ixpk= 2309, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   70 SER  HA           70 SER  HB-         5.50    (#   2310:20  Unique         2.25, 2.49 A)
 &rst
  ixpk= 2310, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1092,1093,
 &end
#
#   98 LYS  HE-          70 SER  HB-         5.50    (#   2313:20  Unique         3.65, 6.34 A)
 &rst
  ixpk= 2313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1092,1093,
 &end
#
#   98 LYS  HE-          70 SER  HB+         5.50    (#   2314:20  Unique         3.65, 6.34 A)
 &rst
  ixpk= 2314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1092,1093,
 &end
#
#   69 ALA  MB           70 SER  HB-         5.50    (#   2315:20  Unique         5.03, 6.28 A)
 &rst
  ixpk= 2315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1082,1083,1084,
 igr2=1092,1093,
 &end
#
#   69 ALA  MB           70 SER  HB+         5.50    (#   2316:20  Unique         5.03, 6.28 A)
 &rst
  ixpk= 2316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1082,1083,1084,
 igr2=1092,1093,
 &end
#
#   71 THR  MG2          70 SER  HB-         5.50    (#   2317:20  Unique         3.83, 6.66 A)
 &rst
  ixpk= 2317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=1092,1093,
 &end
#
#   67 ILE  QG2          70 SER  HB-         5.50    (#   2318:20  Unique         3.17, 4.80 A)
 &rst
  ixpk= 2318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1046,1047,1048,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-2:2319    70 SER  HB-         5.50    (#   2319:20  Single Ambig)
 &rst
  ixpk= 2319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1=1604,1605,1688,1689,1690,1692,1693,1694,1053,1054,
      1055,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-2:2320     0 AMB  20-1:2320   5.50    (#   2320:20  Double Ambig)
 &rst
  ixpk= 2320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1046,1047,1048,1604,1605,
 igr2=1092,1093,1092,1093,
 &end
#
#   71 THR  MG2          70 SER  HB+         5.50    (#   2321:20  Unique         3.83, 6.66 A)
 &rst
  ixpk= 2321, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=1092,1093,
 &end
#
#   50 MET  ME           70 SER  HB-         5.50    (#   2322:20  Unique         3.91, 6.34 A)
 &rst
  ixpk= 2322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-2:2323     0 AMB  20-1:2323   5.50    (#   2323:20  Double Ambig)
 &rst
  ixpk= 2323, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.06, r4=11.56,
 igr1=1604,1605,1688,1689,1690,1692,1693,1694,1053,1054,
      1055,
 igr2=1092,1093,1092,1093,1092,1093,
 &end
#
#   72 ARG  HN           71 THR  HA          3.50    (#   2324:20  Unique         2.15, 2.30 A)
 &rst
  ixpk= 2324, nxpk= 20, iat=1113,1101, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 THR  HN           71 THR  HA          5.50    (#   2325:20  Unique         2.74, 2.78 A)
 &rst
  ixpk= 2325, nxpk= 20, iat=1099,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2326     0 AMB  20-1:2326   5.50    (#   2326:20  Double Ambig)
 &rst
  ixpk= 2326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1137, 510,1151,
 igr2=1101,2228,
 &end
#
#  158 LEU  HN          157 SER  HA          5.50    (#   2327:20  Unique         3.35, 3.46 A)
 &rst
  ixpk= 2327, nxpk= 20, iat=2603,2594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HH2         136 VAL  HA          5.50    (#   2328:20  Unique         3.22, 4.47 A)
 &rst
  ixpk= 2328, nxpk= 20, iat= 371,2228, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HB           71 THR  HA          5.50    (#   2329:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 2329, nxpk= 20, iat=1103,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2330   157 SER  HA          2.80    (#   2330:20  Single Ambig)
 &rst
  ixpk= 2330, nxpk= 20, iat=  -1,2594, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2596,2597,2596,2597,
 &end
#
#   71 THR  MG2          71 THR  HA          4.50    (#   2331:20  Unique         1.99, 3.16 A)
 &rst
  ixpk= 2331, nxpk= 20, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2332    71 THR  HA          4.50    (#   2332:20  Single Ambig)
 &rst
  ixpk= 2332, nxpk= 20, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1117,1118,1117,1118,
 &end
#
#  160 GLU  HB-         157 SER  HA          4.50    (#   2333:20  Unique         2.00, 3.13 A)
 &rst
  ixpk= 2333, nxpk= 20, iat=  -1,2594, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2643,2644,
 &end
#
#    0 AMB  20-2:2334   157 SER  HA          5.50    (#   2334:20  Single Ambig)
 &rst
  ixpk= 2334, nxpk= 20, iat=  -1,2594, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2646,2647,2629,2630,2629,2630,
 &end
#
#    0 AMB  20-2:2335    71 THR  HB          5.50    (#   2335:20  Single Ambig)
 &rst
  ixpk= 2335, nxpk= 20, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   71 THR  MG2          71 THR  HB          4.50    (#   2336:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2336, nxpk= 20, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2337    71 THR  HB          5.50    (#   2337:20  Single Ambig)
 &rst
  ixpk= 2337, nxpk= 20, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1117,1118,1117,1118,
 &end
#
#   71 THR  HA           71 THR  HB          5.50    (#   2338:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 2338, nxpk= 20, iat=1101,1103, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2340    71 THR  HB          5.50    (#   2340:20  Single Ambig)
 &rst
  ixpk= 2340, nxpk= 20, iat=  -1,1103, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1137,1151,
 &end
#
#   71 THR  HN           71 THR  HB          5.50    (#   2341:20  Unique         2.43, 3.11 A)
 &rst
  ixpk= 2341, nxpk= 20, iat=1099,1103, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ARG  HN           71 THR  HB          5.50    (#   2342:20  Unique         2.27, 3.32 A)
 &rst
  ixpk= 2342, nxpk= 20, iat=1113,1103, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ARG  HN           71 THR  MG2         5.50    (#   2343:20  Unique         2.00, 4.04 A)
 &rst
  ixpk= 2343, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1105,1106,1107,
 &end
#
#   71 THR  HN           71 THR  MG2         4.50    (#   2344:20  Unique         1.94, 3.64 A)
 &rst
  ixpk= 2344, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2345    71 THR  MG2         5.50    (#   2345:20  Single Ambig)
 &rst
  ixpk= 2345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1137,1151,
 igr2=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2346     0 AMB  20-1:2346   5.50    (#   2346:20  Double Ambig)
 &rst
  ixpk= 2346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2448,2432,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#   99 TRP  HN           71 THR  MG2         5.50    (#   2347:20  Unique         1.94, 3.43 A)
 &rst
  ixpk= 2347, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1105,1106,1107,
 &end
#
#  144 TYR  HD          133 VAL  MGY         4.50    (#   2348:20  Unique         3.70, 7.10 A)
 &rst
  ixpk= 2348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2371,2380,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:2349    71 THR  MG2         5.50    (#   2349:20  Single Ambig)
 &rst
  ixpk= 2349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1090,1618,
 igr2=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2350    71 THR  MG2         4.50    (#   2350:20  Single Ambig)
 &rst
  ixpk= 2350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1103,1153,
 igr2=1105,1106,1107,
 &end
#
#   71 THR  HA           71 THR  MG2         4.50    (#   2351:20  Unique         1.99, 3.16 A)
 &rst
  ixpk= 2351, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1105,1106,1107,
 &end
#
#  145 ARG  HA          133 VAL  MGY         5.50    (#   2352:20  Unique         1.98, 3.58 A)
 &rst
  ixpk= 2352, nxpk= 20, iat=2386,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#   99 TRP  HB+          71 THR  MG2         5.50    (#   2353:20  Unique         1.99, 4.24 A)
 &rst
  ixpk= 2353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1620,1621,
 igr2=1105,1106,1107,
 &end
#
#   99 TRP  HB-          71 THR  MG2         5.50    (#   2354:20  Unique         1.99, 4.24 A)
 &rst
  ixpk= 2354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1620,1621,
 igr2=1105,1106,1107,
 &end
#
#    0 AMB  20-2:2355     0 AMB  20-1:2355   5.50    (#   2355:20  Double Ambig)
 &rst
  ixpk= 2355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=2189,2190,2315,2316,1117,1118,1117,1118,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#  147 VAL  MGX           0 AMB  20-1:2356   5.50    (#   2356:20  Single Ambig)
 &rst
  ixpk= 2356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1105,1106,1107,2175,2176,2177,2179,2180,2181,
 &end
#
#  147 VAL  MGY           0 AMB  20-1:2357   5.50    (#   2357:20  Single Ambig)
 &rst
  ixpk= 2357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1105,1106,1107,2175,2176,2177,2179,2180,2181,
 &end
#
#   72 ARG  HN           72 ARG  HA          4.50    (#   2358:20  Unique         2.74, 2.80 A)
 &rst
  ixpk= 2358, nxpk= 20, iat=1113,1115, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:2359    72 ARG  HA          4.50    (#   2359:20  Single Ambig)
 &rst
  ixpk= 2359, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1137,1151,
 &end
#
#   73 ASN  HA           72 ARG  HA          5.50    (#   2360:20  Unique         4.54, 4.59 A)
 &rst
  ixpk= 2360, nxpk= 20, iat=1139,1115, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HA           72 ARG  HA          5.50    (#   2361:20  Unique         4.29, 4.33 A)
 &rst
  ixpk= 2361, nxpk= 20, iat=1101,1115, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2362    72 ARG  HA          5.50    (#   2362:20  Single Ambig)
 &rst
  ixpk= 2362, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1123,1124,1123,1124,
 &end
#
#    0 AMB  20-2:2363    72 ARG  HA          2.80    (#   2363:20  Single Ambig)
 &rst
  ixpk= 2363, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1117,1118,1117,1118,
 &end
#
#   72 ARG  HG+          72 ARG  HA          3.50    (#   2364:20  Unique         2.12, 2.82 A)
 &rst
  ixpk= 2364, nxpk= 20, iat=  -1,1115, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1120,1121,
 &end
#
#   72 ARG  HN            0 AMB  20-1:2365   3.50    (#   2365:20  Single Ambig)
 &rst
  ixpk= 2365, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1117,1118,1117,1118,
 &end
#
#   73 ASN  HN            0 AMB  20-1:2366   3.50    (#   2366:20  Single Ambig)
 &rst
  ixpk= 2366, nxpk= 20, iat=1137,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1117,1118,1117,1118,
 &end
#
#    0 AMB  20-2:2367     0 AMB  20-1:2367   5.50    (#   2367:20  Double Ambig)
 &rst
  ixpk= 2367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1146,1147,1146,1147,
 igr2=1117,1118,1117,1118,
 &end
#
#    0 AMB  20-2:2368     0 AMB  20-1:2368   5.50    (#   2368:20  Double Ambig)
 &rst
  ixpk= 2368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2226,2311,
 igr2=2189,2190,2189,2190,
 &end
#
#  134 ARG  HN          134 ARG  HB+         5.50    (#   2369:20  Unique         2.46, 3.24 A)
 &rst
  ixpk= 2369, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2189,2190,
 &end
#
#    0 AMB  20-2:2370     0 AMB  20-1:2370   5.50    (#   2370:20  Double Ambig)
 &rst
  ixpk= 2370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1146,1147,2198,
 igr2=1117,1118,1117,1118,2189,2190,
 &end
#
#   71 THR  HA            0 AMB  20-1:2371   5.50    (#   2371:20  Single Ambig)
 &rst
  ixpk= 2371, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1117,1118,1117,1118,
 &end
#
#  134 ARG  HA          134 ARG  HB+         4.50    (#   2372:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 2372, nxpk= 20, iat=2187,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2189,2190,
 &end
#
#   72 ARG  HA            0 AMB  20-1:2373   3.50    (#   2373:20  Single Ambig)
 &rst
  ixpk= 2373, nxpk= 20, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1117,1118,1117,1118,
 &end
#
#    0 AMB  20-2:2374     0 AMB  20-1:2374   5.50    (#   2374:20  Double Ambig)
 &rst
  ixpk= 2374, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2195,2196,2195,2196,
 igr2=2189,2190,2189,2190,
 &end
#
#   72 ARG  HN           72 ARG  HG+         5.50    (#   2375:20  Unique         1.92, 3.35 A)
 &rst
  ixpk= 2375, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1120,1121,
 &end
#
#   72 ARG  HN           72 ARG  HG-         5.50    (#   2376:20  Unique         1.92, 3.35 A)
 &rst
  ixpk= 2376, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1120,1121,
 &end
#
#    0 AMB  20-2:2377     0 AMB  20-1:2377   5.50    (#   2377:20  Double Ambig)
 &rst
  ixpk= 2377, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2335,1137,
 igr2=2318,2319,1120,1121,
 &end
#
#   73 ASN  HN           72 ARG  HG-         5.50    (#   2378:20  Unique         2.28, 4.78 A)
 &rst
  ixpk= 2378, nxpk= 20, iat=1137,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1120,1121,
 &end
#
#   72 ARG  HA           72 ARG  HG+         5.50    (#   2379:20  Unique         2.12, 2.82 A)
 &rst
  ixpk= 2379, nxpk= 20, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1120,1121,
 &end
#
#   72 ARG  HA           72 ARG  HG-         4.50    (#   2380:20  Unique         2.12, 2.82 A)
 &rst
  ixpk= 2380, nxpk= 20, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1120,1121,
 &end
#
#    0 AMB  20-2:2381     0 AMB  20-1:2381   2.80    (#   2381:20  Double Ambig)
 &rst
  ixpk= 2381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1123,1124,1123,1124,
 igr2=1120,1121,1120,1121,
 &end
#
#    0 AMB  20-2:2382     0 AMB  20-1:2382   2.80    (#   2382:20  Double Ambig)
 &rst
  ixpk= 2382, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1123,1124,1123,1124, 114, 115,
 igr2=1120,1121, 111, 112,
 &end
#
#    0 AMB  20-2:2383     0 AMB  20-1:2383   4.50    (#   2383:20  Double Ambig)
 &rst
  ixpk= 2383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 394, 395, 394, 395,1724,1725,1726,1728,1729,1730,
      
 igr2=1955,1956, 268, 269, 268, 269,
 &end
#
#    0 AMB  20-2:2385     8 ARG  HD-         4.50    (#   2385:20  Single Ambig)
 &rst
  ixpk= 2385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 129, 130, 129, 130,
 igr2= 114, 115,
 &end
#
#   72 ARG  HN            0 AMB  20-1:2387   5.50    (#   2387:20  Single Ambig)
 &rst
  ixpk= 2387, nxpk= 20, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1123,1124,1123,1124,
 &end
#
#    0 AMB  20-2:2388    73 ASN  HA          3.50    (#   2388:20  Single Ambig)
 &rst
  ixpk= 2388, nxpk= 20, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1151,1137,
 &end
#
#   73 ASN  HD2+         73 ASN  HA          5.50    (#   2389:20  Unique         3.80, 4.46 A)
 &rst
  ixpk= 2389, nxpk= 20, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HD2-         73 ASN  HA          5.50    (#   2390:20  Unique         3.80, 4.46 A)
 &rst
  ixpk= 2390, nxpk= 20, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HB+          73 ASN  HA          4.50    (#   2391:20  Unique         2.28, 2.51 A)
 &rst
  ixpk= 2391, nxpk= 20, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1141,1142,
 &end
#
#   73 ASN  HB-          73 ASN  HA          5.50    (#   2392:20  Unique         2.28, 2.51 A)
 &rst
  ixpk= 2392, nxpk= 20, iat=  -1,1139, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1141,1142,
 &end
#
#    0 AMB  20-2:2393    73 ASN  HB-         5.50    (#   2393:20  Single Ambig)
 &rst
  ixpk= 2393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1141,1142,
 &end
#
#    0 AMB  20-2:2394     0 AMB  20-1:2394   5.50    (#   2394:20  Double Ambig)
 &rst
  ixpk= 2394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1141,1142,1141,1142,
 &end
#
#    0 AMB  20-2:2395    73 ASN  HB-         5.50    (#   2395:20  Single Ambig)
 &rst
  ixpk= 2395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1117,1118,1117,1118,
 igr2=1141,1142,
 &end
#
#    0 AMB  20-2:2396     0 AMB  20-1:2396   5.50    (#   2396:20  Double Ambig)
 &rst
  ixpk= 2396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1117,1118,1117,1118,
 igr2=1141,1142,1141,1142,
 &end
#
#   73 ASN  HA           73 ASN  HB+         4.50    (#   2397:20  Unique         2.28, 2.51 A)
 &rst
  ixpk= 2397, nxpk= 20, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1141,1142,
 &end
#
#   73 ASN  HA           73 ASN  HB-         4.50    (#   2398:20  Unique         2.28, 2.51 A)
 &rst
  ixpk= 2398, nxpk= 20, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1141,1142,
 &end
#
#   73 ASN  HD2-         73 ASN  HB+         5.50    (#   2399:20  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1146,1147,
 igr2=1141,1142,
 &end
#
#   73 ASN  HD2-         73 ASN  HB-         5.50    (#   2400:20  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2400, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1146,1147,
 igr2=1141,1142,
 &end
#
#   73 ASN  HD2+         73 ASN  HB+         5.50    (#   2401:20  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1146,1147,
 igr2=1141,1142,
 &end
#
#   73 ASN  HD2+         73 ASN  HB-         5.50    (#   2402:20  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2402, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1146,1147,
 igr2=1141,1142,
 &end
#
#   74 TRP  HN           73 ASN  HB+         4.50    (#   2403:20  Unique         1.95, 2.91 A)
 &rst
  ixpk= 2403, nxpk= 20, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1141,1142,
 &end
#
#   74 TRP  HN           73 ASN  HB-         3.50    (#   2404:20  Unique         1.95, 2.91 A)
 &rst
  ixpk= 2404, nxpk= 20, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1141,1142,
 &end
#
#   97 GLN  HN           74 TRP  HA          5.50    (#   2405:20  Unique         3.94, 4.34 A)
 &rst
  ixpk= 2405, nxpk= 20, iat=1577,1153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 LEU  HN           74 TRP  HA          4.50    (#   2406:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 2406, nxpk= 20, iat=1175,1153, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 TRP  HN           74 TRP  HA          5.50    (#   2407:20  Unique         2.27, 2.79 A)
 &rst
  ixpk= 2407, nxpk= 20, iat=1151,1153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HD1          74 TRP  HA          5.50    (#   2409:20  Unique         3.88, 4.12 A)
 &rst
  ixpk= 2409, nxpk= 20, iat=1159,1153, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HB-          74 TRP  HA          5.50    (#   2410:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 2410, nxpk= 20, iat=  -1,1153, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#   74 TRP  HB+          74 TRP  HA          5.50    (#   2411:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 2411, nxpk= 20, iat=  -1,1153, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#    0 AMB  20-2:2412    74 TRP  HA          5.50    (#   2412:20  Single Ambig)
 &rst
  ixpk= 2412, nxpk= 20, iat=  -1,1153, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:2413     0 AMB  20-1:2413   5.50    (#   2413:20  Double Ambig)
 &rst
  ixpk= 2413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1565,1566,1201,1202,
 igr2=1155,1156,1155,1156,
 &end
#
#    0 AMB  20-2:2414    74 TRP  HB-         5.50    (#   2414:20  Single Ambig)
 &rst
  ixpk= 2414, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1198,1199,1559,1560,
 igr2=1155,1156,
 &end
#
#   74 TRP  HA           74 TRP  HB+         5.50    (#   2415:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 2415, nxpk= 20, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   74 TRP  HA           74 TRP  HB-         5.50    (#   2416:20  Unique         2.43, 2.75 A)
 &rst
  ixpk= 2416, nxpk= 20, iat=1153,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   75 LEU  HN           74 TRP  HB+         5.50    (#   2417:20  Unique         2.37, 3.74 A)
 &rst
  ixpk= 2417, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   75 LEU  HN           74 TRP  HB-         5.50    (#   2418:20  Unique         2.37, 3.74 A)
 &rst
  ixpk= 2418, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   74 TRP  HN           74 TRP  HB+         5.50    (#   2419:20  Unique         2.40, 3.14 A)
 &rst
  ixpk= 2419, nxpk= 20, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   74 TRP  HN           74 TRP  HB-         5.50    (#   2420:20  Unique         2.40, 3.14 A)
 &rst
  ixpk= 2420, nxpk= 20, iat=1151,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   74 TRP  HD1          74 TRP  HB+         5.50    (#   2421:20  Unique         2.61, 3.26 A)
 &rst
  ixpk= 2421, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   74 TRP  HD1          74 TRP  HB-         5.50    (#   2422:20  Unique         2.61, 3.26 A)
 &rst
  ixpk= 2422, nxpk= 20, iat=1159,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1155,1156,
 &end
#
#   97 GLN  HN           75 LEU  HB+         5.50    (#   2425:20  Unique         3.74, 4.66 A)
 &rst
  ixpk= 2425, nxpk= 20, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   97 GLN  HN           75 LEU  HB-         5.50    (#   2426:20  Unique         3.74, 4.66 A)
 &rst
  ixpk= 2426, nxpk= 20, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   75 LEU  HN           75 LEU  HB+         5.50    (#   2427:20  Unique         2.06, 2.86 A)
 &rst
  ixpk= 2427, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   75 LEU  HN           75 LEU  HB-         5.50    (#   2428:20  Unique         2.06, 2.86 A)
 &rst
  ixpk= 2428, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   76 ARG  HN           75 LEU  HB-         5.50    (#   2430:20  Unique         2.71, 3.79 A)
 &rst
  ixpk= 2430, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   75 LEU  HA           75 LEU  HB+         5.50    (#   2431:20  Unique         2.36, 2.80 A)
 &rst
  ixpk= 2431, nxpk= 20, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#   75 LEU  HA           75 LEU  HB-         5.50    (#   2432:20  Unique         2.36, 2.80 A)
 &rst
  ixpk= 2432, nxpk= 20, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1179,1180,
 &end
#
#    0 AMB  20-2:2433     0 AMB  20-1:2433   5.50    (#   2433:20  Double Ambig)
 &rst
  ixpk= 2433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1179,1180,1179,1180,
 &end
#
#    0 AMB  20-2:2434    75 LEU  HB-         4.50    (#   2434:20  Single Ambig)
 &rst
  ixpk= 2434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1179,1180,
 &end
#
#    0 AMB  20-2:2435    75 LEU  HB-         5.50    (#   2435:20  Single Ambig)
 &rst
  ixpk= 2435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1179,1180,
 &end
#
#    0 AMB  20-2:2436     0 AMB  20-1:2436   5.50    (#   2436:20  Double Ambig)
 &rst
  ixpk= 2436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1179,1180,1179,1180,
 &end
#
#  147 VAL  MGY          75 LEU  HG          5.50    (#   2437:20  Unique         3.76, 6.72 A)
 &rst
  ixpk= 2437, nxpk= 20, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:2438    75 LEU  HG          3.50    (#   2438:20  Single Ambig)
 &rst
  ixpk= 2438, nxpk= 20, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:2439    75 LEU  HG          3.50    (#   2439:20  Single Ambig)
 &rst
  ixpk= 2439, nxpk= 20, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:2440    75 LEU  HG          5.50    (#   2440:20  Single Ambig)
 &rst
  ixpk= 2440, nxpk= 20, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,1105,1106,1107,
 &end
#
#   85 ARG  HG-          85 ARG  HB+         4.50    (#   2441:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2441, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1382,1383,
 igr2=1379,1380,
 &end
#
#  150 GLU  HG-          75 LEU  HG          5.50    (#   2442:20  Unique         4.34, 6.08 A)
 &rst
  ixpk= 2442, nxpk= 20, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2494,2495,
 &end
#
#    0 AMB  20-2:2443     0 AMB  20-1:2443   5.50    (#   2443:20  Double Ambig)
 &rst
  ixpk= 2443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1385,1386,1385,1386,2418,2419,2418,2419,
 igr2=1379,1380,1379,1380,1182,
 &end
#
#   75 LEU  HA           75 LEU  HG          5.50    (#   2444:20  Unique         2.40, 3.19 A)
 &rst
  ixpk= 2444, nxpk= 20, iat=1177,1182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2445     0 AMB  20-1:2445   5.50    (#   2445:20  Double Ambig)
 &rst
  ixpk= 2445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1423,1194,
 igr2=1379,1380,1182,
 &end
#
#   75 LEU  HN           75 LEU  HG          5.50    (#   2446:20  Unique         2.50, 3.92 A)
 &rst
  ixpk= 2446, nxpk= 20, iat=1175,1182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 LEU  HN           75 LEU  MDX         5.50    (#   2447:20  Unique         2.44, 4.63 A)
 &rst
  ixpk= 2447, nxpk= 20, iat=1175,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   76 ARG  HN           75 LEU  MDX         5.50    (#   2448:20  Unique         2.11, 4.69 A)
 &rst
  ixpk= 2448, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2449    75 LEU  MDX         5.50    (#   2449:20  Single Ambig)
 &rst
  ixpk= 2449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1137,1151,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  147 VAL  HN           75 LEU  MDX         5.50    (#   2450:20  Unique         3.10, 6.54 A)
 &rst
  ixpk= 2450, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   99 TRP  HN           75 LEU  MDX         5.50    (#   2451:20  Unique         3.02, 6.09 A)
 &rst
  ixpk= 2451, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2452    75 LEU  MDX         5.50    (#   2452:20  Single Ambig)
 &rst
  ixpk= 2452, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1146,1147,2408,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   99 TRP  HD1          75 LEU  MDX         5.50    (#   2453:20  Unique         1.99, 4.97 A)
 &rst
  ixpk= 2453, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   77 TYR  HE           75 LEU  MDX         5.50    (#   2454:20  Unique         3.72, 8.93 A)
 &rst
  ixpk= 2454, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1228,1233,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2456    75 LEU  MDX         5.50    (#   2456:20  Single Ambig)
 &rst
  ixpk= 2456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1103,1153,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  143 VAL  HA           75 LEU  MDX         5.50    (#   2457:20  Unique         3.15, 5.90 A)
 &rst
  ixpk= 2457, nxpk= 20, iat=2349,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2458    75 LEU  MDX         5.50    (#   2458:20  Single Ambig)
 &rst
  ixpk= 2458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2418,2419,2418,2419,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  147 VAL  HA           75 LEU  MDX         5.50    (#   2459:20  Unique         3.75, 6.36 A)
 &rst
  ixpk= 2459, nxpk= 20, iat=2434,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2460    75 LEU  MDX         5.50    (#   2460:20  Single Ambig)
 &rst
  ixpk= 2460, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1155,1156,2478,2479,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   76 ARG  HD-          75 LEU  MDX         5.50    (#   2461:20  Unique         3.12, 6.98 A)
 &rst
  ixpk= 2461, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1204,1205,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   75 LEU  HB-          75 LEU  MDX         3.50    (#   2462:20  Unique         2.08, 3.37 A)
 &rst
  ixpk= 2462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1179,1180,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2463    75 LEU  MDX         2.80    (#   2463:20  Single Ambig)
 &rst
  ixpk= 2463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1=2412,2413,2412,2413,2415,2416,1182,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   75 LEU  HB+          75 LEU  MDX         2.80    (#   2464:20  Unique         2.08, 3.37 A)
 &rst
  ixpk= 2464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1179,1180,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2465    75 LEU  MDX         5.50    (#   2465:20  Single Ambig)
 &rst
  ixpk= 2465, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  147 VAL  MGX          75 LEU  MDX         5.50    (#   2466:20  Unique         2.71, 7.24 A)
 &rst
  ixpk= 2466, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#  147 VAL  MGY          75 LEU  MDX         3.50    (#   2467:20  Unique         2.71, 7.24 A)
 &rst
  ixpk= 2467, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2468     0 AMB  20-1:2468   3.50    (#   2468:20  Double Ambig)
 &rst
  ixpk= 2468, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1702,1703,1179,1180,2610,
 igr2=1068,1069,1070,1072,1073,1074,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   75 LEU  HB+          75 LEU  MDY         3.50    (#   2469:20  Unique         2.08, 3.37 A)
 &rst
  ixpk= 2469, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1179,1180,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2470     0 AMB  20-1:2470   2.80    (#   2470:20  Double Ambig)
 &rst
  ixpk= 2470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1=1702,1703,2412,2413,2412,2413,2415,2416,1182,
 igr2=1068,1069,1070,1072,1073,1074,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:2471    75 LEU  MDY         5.50    (#   2471:20  Single Ambig)
 &rst
  ixpk= 2471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1620,1621,1141,1142,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2472    75 LEU  MDY         4.50    (#   2472:20  Single Ambig)
 &rst
  ixpk= 2472, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2418,2419,2418,2419,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   71 THR  HA           75 LEU  MDY         5.50    (#   2473:20  Unique         4.46, 7.04 A)
 &rst
  ixpk= 2473, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   75 LEU  HA           75 LEU  MDY         3.50    (#   2474:20  Unique         2.07, 3.50 A)
 &rst
  ixpk= 2474, nxpk= 20, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#   76 ARG  HN           75 LEU  MDY         5.50    (#   2475:20  Unique         2.11, 4.69 A)
 &rst
  ixpk= 2475, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1184,1185,1186,1188,1189,1190,
 &end
#
#    0 AMB  20-2:2476     0 AMB  20-1:2476   5.50    (#   2476:20  Double Ambig)
 &rst
  ixpk= 2476, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1059,1175,
 igr2=1068,1069,1070,1072,1073,1074,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   76 ARG  HG-          76 ARG  HA          5.50    (#   2477:20  Unique         2.28, 3.70 A)
 &rst
  ixpk= 2477, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1201,1202,
 &end
#
#   76 ARG  HG+          76 ARG  HA          5.50    (#   2478:20  Unique         2.28, 3.70 A)
 &rst
  ixpk= 2478, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1201,1202,
 &end
#
#   76 ARG  HB+          76 ARG  HA          5.50    (#   2479:20  Unique         2.25, 2.52 A)
 &rst
  ixpk= 2479, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1198,1199,
 &end
#
#   76 ARG  HB-          76 ARG  HA          5.50    (#   2480:20  Unique         2.25, 2.52 A)
 &rst
  ixpk= 2480, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1198,1199,
 &end
#
#    0 AMB  20-2:2481    76 ARG  HA          5.50    (#   2481:20  Single Ambig)
 &rst
  ixpk= 2481, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,1179,1180,
 &end
#
#   76 ARG  HD-          76 ARG  HA          5.50    (#   2482:20  Unique         2.87, 4.46 A)
 &rst
  ixpk= 2482, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#   76 ARG  HD+          76 ARG  HA          5.50    (#   2483:20  Unique         2.87, 4.46 A)
 &rst
  ixpk= 2483, nxpk= 20, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#   96 LYS  HA           76 ARG  HA          5.50    (#   2484:20  Unique         3.06, 3.43 A)
 &rst
  ixpk= 2484, nxpk= 20, iat=1557,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HN           76 ARG  HA          4.50    (#   2485:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 2485, nxpk= 20, iat=1194,1196, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 TYR  HN           76 ARG  HA          4.50    (#   2486:20  Unique         2.34, 2.48 A)
 &rst
  ixpk= 2486, nxpk= 20, iat=1218,1196, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   97 GLN  HN           76 ARG  HA          5.50    (#   2487:20  Unique         3.71, 4.21 A)
 &rst
  ixpk= 2487, nxpk= 20, iat=1577,1196, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HN           76 ARG  HB+         5.50    (#   2488:20  Unique         2.44, 3.53 A)
 &rst
  ixpk= 2488, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   76 ARG  HN           76 ARG  HB-         5.50    (#   2489:20  Unique         2.44, 3.53 A)
 &rst
  ixpk= 2489, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   76 ARG  HA           76 ARG  HB+         5.50    (#   2490:20  Unique         2.25, 2.52 A)
 &rst
  ixpk= 2490, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   76 ARG  HA           76 ARG  HB-         5.50    (#   2491:20  Unique         2.25, 2.52 A)
 &rst
  ixpk= 2491, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   75 LEU  HA           76 ARG  HB+         5.50    (#   2492:20  Unique         4.28, 5.15 A)
 &rst
  ixpk= 2492, nxpk= 20, iat=1177,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1198,1199,
 &end
#
#   76 ARG  HD+          76 ARG  HB+         5.50    (#   2494:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2494, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1198,1199,
 &end
#
#   76 ARG  HD+          76 ARG  HB-         5.50    (#   2495:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1198,1199,
 &end
#
#    0 AMB  20-2:2496     0 AMB  20-1:2496   5.50    (#   2496:20  Double Ambig)
 &rst
  ixpk= 2496, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1204,1205,2213,2214,
 igr2=1198,1199,2162,2163,
 &end
#
#   76 ARG  HD-          76 ARG  HB+         5.50    (#   2497:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2497, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1198,1199,
 &end
#
#   76 ARG  HG-          76 ARG  HB+         5.50    (#   2498:20  Unique         2.22, 2.60 A)
 &rst
  ixpk= 2498, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1198,1199,
 &end
#
#   76 ARG  HG-          76 ARG  HB-         5.50    (#   2499:20  Unique         2.22, 2.60 A)
 &rst
  ixpk= 2499, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1198,1199,
 &end
#
#   76 ARG  HD-          76 ARG  HG+         5.50    (#   2500:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2500, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1201,1202,
 &end
#
#   76 ARG  HD-          76 ARG  HG-         5.50    (#   2501:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2501, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1201,1202,
 &end
#
#   76 ARG  HD+          76 ARG  HG+         5.50    (#   2502:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2502, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1201,1202,
 &end
#
#   76 ARG  HD+          76 ARG  HG-         5.50    (#   2503:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2503, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1204,1205,
 igr2=1201,1202,
 &end
#
#   76 ARG  HA           76 ARG  HG+         5.50    (#   2504:20  Unique         2.28, 3.70 A)
 &rst
  ixpk= 2504, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   76 ARG  HA           76 ARG  HG-         5.50    (#   2505:20  Unique         2.28, 3.70 A)
 &rst
  ixpk= 2505, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   76 ARG  HN           76 ARG  HG+         5.50    (#   2506:20  Unique         2.01, 3.45 A)
 &rst
  ixpk= 2506, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1201,1202,
 &end
#
#   76 ARG  HN           76 ARG  HD+         5.50    (#   2508:20  Unique         1.85, 3.15 A)
 &rst
  ixpk= 2508, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1204,1205,
 &end
#
#   76 ARG  HN           76 ARG  HD-         5.50    (#   2509:20  Unique         1.85, 3.15 A)
 &rst
  ixpk= 2509, nxpk= 20, iat=1194,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1204,1205,
 &end
#
#    7 TYR  HD           76 ARG  HD-         5.50    (#   2512:20  Unique         2.60, 6.29 A)
 &rst
  ixpk= 2512, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=1204,1205,
 &end
#
#    7 TYR  HE           76 ARG  HD+         5.50    (#   2513:20  Unique         2.03, 5.36 A)
 &rst
  ixpk= 2513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=1204,1205,
 &end
#
#    7 TYR  HE           76 ARG  HD-         5.50    (#   2514:20  Unique         2.03, 5.36 A)
 &rst
  ixpk= 2514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=1204,1205,
 &end
#
#   97 GLN  HE2-         76 ARG  HD-         5.50    (#   2515:20  Unique         2.98, 7.01 A)
 &rst
  ixpk= 2515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1589,1590,
 igr2=1204,1205,
 &end
#
#   97 GLN  HE2-         76 ARG  HD+         5.50    (#   2516:20  Unique         2.98, 7.01 A)
 &rst
  ixpk= 2516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1589,1590,
 igr2=1204,1205,
 &end
#
#   76 ARG  HA           76 ARG  HD+         5.50    (#   2517:20  Unique         2.87, 4.46 A)
 &rst
  ixpk= 2517, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1204,1205,
 &end
#
#    0 AMB  20-2:2518    76 ARG  HD-         5.50    (#   2518:20  Single Ambig)
 &rst
  ixpk= 2518, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1196,1540,
 igr2=1204,1205,
 &end
#
#   76 ARG  HB+          76 ARG  HD+         5.50    (#   2521:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,
 igr2=1204,1205,
 &end
#
#   76 ARG  HB+          76 ARG  HD-         5.50    (#   2522:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2522, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,
 igr2=1204,1205,
 &end
#
#   76 ARG  HG+          76 ARG  HD-         4.50    (#   2523:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2523, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,
 igr2=1204,1205,
 &end
#
#   76 ARG  HB-          76 ARG  HD-         5.50    (#   2524:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2524, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,
 igr2=1204,1205,
 &end
#
#   76 ARG  HG+          76 ARG  HD+         5.50    (#   2525:20  Unique         2.22, 2.59 A)
 &rst
  ixpk= 2525, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1204,1205,
 &end
#
#   76 ARG  HB-          76 ARG  HD+         5.50    (#   2526:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 2526, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,
 igr2=1204,1205,
 &end
#
#    0 AMB  20-2:2527     0 AMB  20-1:2527   5.50    (#   2527:20  Double Ambig)
 &rst
  ixpk= 2527, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=1201,1202,1184,1185,1186,1188,1189,1190,
 igr2=1204,1205,1204,1205,
 &end
#
#    0 AMB  20-2:2528    76 ARG  HD-         5.50    (#   2528:20  Single Ambig)
 &rst
  ixpk= 2528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1201,1202,1184,1185,1186,1188,1189,1190,
 igr2=1204,1205,
 &end
#
#    0 AMB  20-2:2529    77 TYR  HA          5.50    (#   2529:20  Single Ambig)
 &rst
  ixpk= 2529, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#    0 AMB  20-2:2530    77 TYR  HA          5.50    (#   2530:20  Single Ambig)
 &rst
  ixpk= 2530, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,1246,1247,
 &end
#
#    0 AMB  20-2:2531    77 TYR  HA          5.50    (#   2531:20  Single Ambig)
 &rst
  ixpk= 2531, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1249,1250,1249,1250,
 &end
#
#    0 AMB  20-2:2532    77 TYR  HA          5.50    (#   2532:20  Single Ambig)
 &rst
  ixpk= 2532, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1243,1244,1542,1543,
 &end
#
#   77 TYR  HB-          77 TYR  HA          4.50    (#   2533:20  Unique         2.30, 2.46 A)
 &rst
  ixpk= 2533, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1222,1223,
 &end
#
#   77 TYR  HB+          77 TYR  HA          5.50    (#   2534:20  Unique         2.30, 2.46 A)
 &rst
  ixpk= 2534, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1222,1223,
 &end
#
#   77 TYR  HD           77 TYR  HA          5.50    (#   2535:20  Unique         3.81, 4.17 A)
 &rst
  ixpk= 2535, nxpk= 20, iat=  -1,1220, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1235,
 &end
#
#   77 TYR  HN           77 TYR  HA          5.50    (#   2536:20  Unique         2.85, 2.86 A)
 &rst
  ixpk= 2536, nxpk= 20, iat=1218,1220, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 LYS  HN           77 TYR  HA          3.50    (#   2537:20  Unique         2.50, 2.62 A)
 &rst
  ixpk= 2537, nxpk= 20, iat=1239,1220, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2538     0 AMB  20-1:2538   5.50    (#   2538:20  Double Ambig)
 &rst
  ixpk= 2538, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1222,1223,1222,1223,
 &end
#
#    0 AMB  20-2:2539    77 TYR  HB-         5.50    (#   2539:20  Single Ambig)
 &rst
  ixpk= 2539, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1222,1223,
 &end
#
#   77 TYR  HA           77 TYR  HB+         5.50    (#   2540:20  Unique         2.30, 2.46 A)
 &rst
  ixpk= 2540, nxpk= 20, iat=1220,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1222,1223,
 &end
#
#   77 TYR  HA           77 TYR  HB-         5.50    (#   2541:20  Unique         2.30, 2.46 A)
 &rst
  ixpk= 2541, nxpk= 20, iat=1220,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1222,1223,
 &end
#
#   77 TYR  HD           77 TYR  HB+         5.50    (#   2542:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 2542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1226,1235,
 igr2=1222,1223,
 &end
#
#   77 TYR  HD           77 TYR  HB-         5.50    (#   2543:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 2543, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1226,1235,
 igr2=1222,1223,
 &end
#
#   77 TYR  HN           77 TYR  HB+         5.50    (#   2544:20  Unique         3.55, 3.78 A)
 &rst
  ixpk= 2544, nxpk= 20, iat=1218,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1222,1223,
 &end
#
#   78 LYS  HN           77 TYR  HB+         5.50    (#   2545:20  Unique         1.92, 2.68 A)
 &rst
  ixpk= 2545, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1222,1223,
 &end
#
#   78 LYS  HN           77 TYR  HB-         5.50    (#   2546:20  Unique         1.92, 2.68 A)
 &rst
  ixpk= 2546, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1222,1223,
 &end
#
#   78 LYS  HN           78 LYS  HA          5.50    (#   2548:20  Unique         2.91, 2.94 A)
 &rst
  ixpk= 2548, nxpk= 20, iat=1239,1241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 LEU  HN           78 LYS  HA          5.50    (#   2549:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 2549, nxpk= 20, iat=1261,1241, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 LYS  HB+          78 LYS  HA          5.50    (#   2551:20  Unique         2.59, 2.84 A)
 &rst
  ixpk= 2551, nxpk= 20, iat=  -1,1241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1243,1244,
 &end
#
#   78 LYS  HG+          78 LYS  HA          5.50    (#   2552:20  Unique         2.08, 2.92 A)
 &rst
  ixpk= 2552, nxpk= 20, iat=  -1,1241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1246,1247,
 &end
#
#    0 AMB  20-2:2553    78 LYS  HA          5.50    (#   2553:20  Single Ambig)
 &rst
  ixpk= 2553, nxpk= 20, iat=  -1,1241, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1249,1250,1243,1244,
 &end
#
#   78 LYS  HG-          78 LYS  HA          5.50    (#   2554:20  Unique         2.08, 2.92 A)
 &rst
  ixpk= 2554, nxpk= 20, iat=  -1,1241, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1246,1247,
 &end
#
#    0 AMB  20-2:2555    78 LYS  HB-         5.50    (#   2555:20  Single Ambig)
 &rst
  ixpk= 2555, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1252,1253,1252,1253,
 igr2=1243,1244,
 &end
#
#    0 AMB  20-2:2556     0 AMB  20-1:2556   5.50    (#   2556:20  Double Ambig)
 &rst
  ixpk= 2556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1252,1253,1252,1253,
 igr2=1243,1244,1243,1244,
 &end
#
#   78 LYS  HA           78 LYS  HB+         5.50    (#   2557:20  Unique         2.59, 2.84 A)
 &rst
  ixpk= 2557, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1243,1244,
 &end
#
#   78 LYS  HA           78 LYS  HB-         5.50    (#   2558:20  Unique         2.59, 2.84 A)
 &rst
  ixpk= 2558, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1243,1244,
 &end
#
#   79 LEU  HN           78 LYS  HB+         5.50    (#   2559:20  Unique         3.38, 4.13 A)
 &rst
  ixpk= 2559, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1243,1244,
 &end
#
#   79 LEU  HN           78 LYS  HB-         5.50    (#   2560:20  Unique         3.38, 4.13 A)
 &rst
  ixpk= 2560, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1243,1244,
 &end
#
#   78 LYS  HN           78 LYS  HB-         5.50    (#   2562:20  Unique         2.18, 2.85 A)
 &rst
  ixpk= 2562, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1243,1244,
 &end
#
#   78 LYS  HN           78 LYS  HG+         5.50    (#   2563:20  Unique         3.51, 4.36 A)
 &rst
  ixpk= 2563, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1246,1247,
 &end
#
#   78 LYS  HN           78 LYS  HG-         5.50    (#   2564:20  Unique         3.51, 4.36 A)
 &rst
  ixpk= 2564, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:2565     0 AMB  20-1:2565   5.50    (#   2565:20  Double Ambig)
 &rst
  ixpk= 2565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1990,1261,
 igr2=2021,2022,1246,1247,
 &end
#
#    0 AMB  20-2:2566     0 AMB  20-1:2566   5.50    (#   2566:20  Double Ambig)
 &rst
  ixpk= 2566, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1824,1261,
 igr2= 919,1246,1247,
 &end
#
#   78 LYS  HA           78 LYS  HG+         5.50    (#   2567:20  Unique         2.08, 2.92 A)
 &rst
  ixpk= 2567, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:2568     0 AMB  20-1:2568   5.50    (#   2568:20  Double Ambig)
 &rst
  ixpk= 2568, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1241, 914,
 igr2=1246,1247, 919,
 &end
#
#   78 LYS  HB+          78 LYS  HG-         5.50    (#   2569:20  Unique         2.23, 2.61 A)
 &rst
  ixpk= 2569, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1243,1244,
 igr2=1246,1247,
 &end
#
#    0 AMB  20-2:2570     0 AMB  20-1:2570   5.50    (#   2570:20  Double Ambig)
 &rst
  ixpk= 2570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1=1525,1526,1527,1522,1523,1522,1523,
 igr2=1249,1250,1249,1250,1249,1250,
 &end
#
#    0 AMB  20-2:2571     0 AMB  20-1:2571   3.50    (#   2571:20  Double Ambig)
 &rst
  ixpk= 2571, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.27, r4= 7.77,
 igr1=1252,1253,1252,1253,1252,1253,2478,2479,2478,2479,
      
 igr2=1249,1250,1249,1250,1249,1250,2475,2476,
 &end
#
#   78 LYS  HA            0 AMB  20-1:2572   5.50    (#   2572:20  Single Ambig)
 &rst
  ixpk= 2572, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1249,1250,1249,1250,
 &end
#
#    0 AMB  20-2:2573     0 AMB  20-1:2573   5.50    (#   2573:20  Double Ambig)
 &rst
  ixpk= 2573, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1261, 810,
 igr2=1249,1250,1249,1250, 790, 791,
 &end
#
#   78 LYS  HN            0 AMB  20-1:2574   5.50    (#   2574:20  Single Ambig)
 &rst
  ixpk= 2574, nxpk= 20, iat=1239,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1249,1250,1249,1250,
 &end
#
#   79 LEU  MDX          79 LEU  HA          5.50    (#   2575:20  Unique         2.11, 4.07 A)
 &rst
  ixpk= 2575, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  20-2:2576    79 LEU  HA          4.50    (#   2576:20  Single Ambig)
 &rst
  ixpk= 2576, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,
 &end
#
#   79 LEU  HB-          79 LEU  HA          5.50    (#   2577:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 2577, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 LEU  HB+          79 LEU  HA          5.50    (#   2578:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 2578, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 LEU  HG           79 LEU  HA          5.50    (#   2579:20  Unique         2.13, 3.44 A)
 &rst
  ixpk= 2579, nxpk= 20, iat=1268,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 LEU  HG           79 LEU  HA          5.50    (#   2580:20  Unique         4.46, 5.30 A)
 &rst
  ixpk= 2580, nxpk= 20, iat=1347,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2581    79 LEU  HA          5.50    (#   2581:20  Single Ambig)
 &rst
  ixpk= 2581, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,1301,1302,
 &end
#
#    0 AMB  20-2:2582    79 LEU  HA          5.50    (#   2582:20  Single Ambig)
 &rst
  ixpk= 2582, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,1320,1321,
 &end
#
#   80 PRO  HD-          79 LEU  HA          5.50    (#   2583:20  Unique         2.00, 2.27 A)
 &rst
  ixpk= 2583, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1281,1282,
 &end
#
#   80 PRO  HD+          79 LEU  HA          4.50    (#   2584:20  Unique         2.00, 2.27 A)
 &rst
  ixpk= 2584, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1281,1282,
 &end
#
#  139 PHE  HE           79 LEU  HA          5.50    (#   2585:20  Unique         2.16, 3.76 A)
 &rst
  ixpk= 2585, nxpk= 20, iat=  -1,1263, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2279,2283,
 &end
#
#   79 LEU  HN           79 LEU  HA          5.50    (#   2586:20  Unique         2.75, 2.86 A)
 &rst
  ixpk= 2586, nxpk= 20, iat=1261,1263, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 LEU  HN           79 LEU  HB+         5.50    (#   2587:20  Unique         2.05, 3.16 A)
 &rst
  ixpk= 2587, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   79 LEU  HN           79 LEU  HB-         5.50    (#   2588:20  Unique         2.05, 3.16 A)
 &rst
  ixpk= 2588, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   79 LEU  HA           79 LEU  HB+         5.50    (#   2589:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 2589, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   79 LEU  HA           79 LEU  HB-         5.50    (#   2590:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 2590, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  20-2:2591     0 AMB  20-1:2591   5.50    (#   2591:20  Double Ambig)
 &rst
  ixpk= 2591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1284,1285,1301,1302,
 igr2=1265,1266,1265,1266,
 &end
#
#   83 LEU  HB+          79 LEU  HB-         5.50    (#   2592:20  Unique         2.09, 4.70 A)
 &rst
  ixpk= 2592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1344,1345,
 igr2=1265,1266,
 &end
#
#   83 LEU  HB-          79 LEU  HB+         5.50    (#   2593:20  Unique         2.09, 4.70 A)
 &rst
  ixpk= 2593, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1344,1345,
 igr2=1265,1266,
 &end
#
#   83 LEU  HB-          79 LEU  HB-         5.50    (#   2594:20  Unique         2.09, 4.70 A)
 &rst
  ixpk= 2594, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1344,1345,
 igr2=1265,1266,
 &end
#
#   79 LEU  HG           79 LEU  HB+         5.50    (#   2595:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 2595, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#   79 LEU  HG           79 LEU  HB-         5.50    (#   2596:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 2596, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1265,1266,
 &end
#
#    0 AMB  20-2:2597     0 AMB  20-1:2597   4.50    (#   2597:20  Double Ambig)
 &rst
  ixpk= 2597, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1265,1266,1265,1266,1265,1266,
 &end
#
#    0 AMB  20-2:2598    79 LEU  HB-         4.50    (#   2598:20  Single Ambig)
 &rst
  ixpk= 2598, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1265,1266,
 &end
#
#   79 LEU  MDX          79 LEU  HB-         4.50    (#   2599:20  Unique         2.00, 3.28 A)
 &rst
  ixpk= 2599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1265,1266,
 &end
#
#   79 LEU  MDX          79 LEU  HB+         5.50    (#   2600:20  Unique         2.00, 3.28 A)
 &rst
  ixpk= 2600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1265,1266,
 &end
#
#   95 GLN  HN           79 LEU  HG          5.50    (#   2601:20  Unique         4.11, 5.09 A)
 &rst
  ixpk= 2601, nxpk= 20, iat=1538,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 LEU  HN           79 LEU  HG          5.50    (#   2602:20  Unique         1.80, 2.29 A)
 &rst
  ixpk= 2602, nxpk= 20, iat=1261,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HN           79 LEU  HG          5.50    (#   2603:20  Unique         3.40, 3.95 A)
 &rst
  ixpk= 2603, nxpk= 20, iat=1531,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HE           79 LEU  HG          5.50    (#   2604:20  Unique         2.67, 6.40 A)
 &rst
  ixpk= 2604, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1228,1233,
 &end
#
#   79 LEU  HA           79 LEU  HG          5.50    (#   2606:20  Unique         2.13, 3.44 A)
 &rst
  ixpk= 2606, nxpk= 20, iat=1263,1268, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HA-          79 LEU  HG          5.50    (#   2607:20  Unique         1.94, 3.47 A)
 &rst
  ixpk= 2607, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1533,1534,
 &end
#
#   79 LEU  HB-          79 LEU  HG          5.50    (#   2608:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 2608, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 LEU  HB+          79 LEU  HG          5.50    (#   2609:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 2609, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#    0 AMB  20-2:2610    79 LEU  HG          4.50    (#   2610:20  Single Ambig)
 &rst
  ixpk= 2610, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,
 &end
#
#   79 LEU  MDX          79 LEU  HG          4.50    (#   2611:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2611, nxpk= 20, iat=  -1,1268, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HB-          79 LEU  MDX         3.50    (#   2613:20  Unique         2.00, 3.28 A)
 &rst
  ixpk= 2613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1265,1266,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HG           79 LEU  MDX         2.80    (#   2614:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2614, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  102 LEU  HB-         102 LEU  MDX         2.80    (#   2615:20  Unique         2.16, 3.33 A)
 &rst
  ixpk= 2615, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1683,1684,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   84 VAL  HA           79 LEU  MDX         5.50    (#   2616:20  Unique         2.66, 5.36 A)
 &rst
  ixpk= 2616, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   93 ILE  HA           79 LEU  MDX         5.50    (#   2618:20  Unique         3.67, 5.75 A)
 &rst
  ixpk= 2618, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  102 LEU  HN          102 LEU  MDX         5.50    (#   2619:20  Unique         2.23, 4.55 A)
 &rst
  ixpk= 2619, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   68 LEU  HN          102 LEU  MDX         5.50    (#   2620:20  Unique         3.23, 5.69 A)
 &rst
  ixpk= 2620, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  103 GLN  HN          102 LEU  MDX         4.50    (#   2621:20  Unique         2.22, 5.00 A)
 &rst
  ixpk= 2621, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   66 ARG  HN          102 LEU  MDX         5.50    (#   2622:20  Unique         1.85, 4.52 A)
 &rst
  ixpk= 2622, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   79 LEU  HN           79 LEU  MDX         5.50    (#   2623:20  Unique         1.94, 3.92 A)
 &rst
  ixpk= 2623, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  20-2:2624     0 AMB  20-1:2624   5.50    (#   2624:20  Double Ambig)
 &rst
  ixpk= 2624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1078,1388,
 igr2=1688,1689,1690,1692,1693,1694,1270,1271,1272,1274,
      1275,1276,
 &end
#
#    0 AMB  20-2:2625    79 LEU  MDX         5.50    (#   2625:20  Single Ambig)
 &rst
  ixpk= 2625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1226,1235,1359,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  102 LEU  HA          102 LEU  MDX         4.50    (#   2626:20  Unique         1.90, 3.66 A)
 &rst
  ixpk= 2626, nxpk= 20, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   67 ILE  HA          102 LEU  MDX         3.50    (#   2628:20  Unique         1.94, 4.16 A)
 &rst
  ixpk= 2628, nxpk= 20, iat=1042,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   79 LEU  HA           79 LEU  MDX         4.50    (#   2629:20  Unique         2.11, 4.07 A)
 &rst
  ixpk= 2629, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  20-2:2630   102 LEU  MDX         5.50    (#   2630:20  Single Ambig)
 &rst
  ixpk= 2630, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1644,1645,1644,1645,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:2631     0 AMB  20-1:2631   4.50    (#   2631:20  Double Ambig)
 &rst
  ixpk= 2631, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1004,1542,1543,
 igr2=1688,1689,1690,1692,1693,1694,1270,1271,1272,1274,
      1275,1276,
 &end
#
#    0 AMB  20-2:2632     0 AMB  20-1:2632   4.50    (#   2632:20  Double Ambig)
 &rst
  ixpk= 2632, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1284,1285,1044,1320,1321,1516,
 igr2=1270,1271,1272,1274,1275,1276,1688,1689,1690,1692,
      1693,1694,
 &end
#
#    0 AMB  20-2:2633   102 LEU  MDX         2.80    (#   2633:20  Single Ambig)
 &rst
  ixpk= 2633, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1=1050,1051, 224, 225, 755, 756, 827,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  102 LEU  HG          102 LEU  MDX         2.80    (#   2634:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2634, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   79 LEU  HB-          79 LEU  MDY         4.50    (#   2636:20  Unique         2.00, 3.28 A)
 &rst
  ixpk= 2636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1265,1266,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HG           79 LEU  MDY         3.50    (#   2637:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2637, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HB+          79 LEU  MDY         4.50    (#   2638:20  Unique         2.00, 3.28 A)
 &rst
  ixpk= 2638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1265,1266,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   80 PRO  HB+          79 LEU  MDY         5.50    (#   2639:20  Unique         5.37, 8.21 A)
 &rst
  ixpk= 2639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1287,1288,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   80 PRO  HD-          79 LEU  MDY         5.50    (#   2640:20  Unique         2.43, 5.32 A)
 &rst
  ixpk= 2640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   80 PRO  HD+          79 LEU  MDY         5.50    (#   2641:20  Unique         2.43, 5.32 A)
 &rst
  ixpk= 2641, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HA           79 LEU  MDY         3.50    (#   2643:20  Unique         2.11, 4.07 A)
 &rst
  ixpk= 2643, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  20-2:2644    79 LEU  MDY         5.50    (#   2644:20  Single Ambig)
 &rst
  ixpk= 2644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1342,1290,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   77 TYR  HE           79 LEU  MDY         5.50    (#   2645:20  Unique         1.97, 5.75 A)
 &rst
  ixpk= 2645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1228,1233,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  139 PHE  HD           79 LEU  MDY         5.50    (#   2646:20  Unique         3.20, 7.36 A)
 &rst
  ixpk= 2646, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2277,2285,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  139 PHE  HE           79 LEU  MDY         5.50    (#   2647:20  Unique         1.98, 5.52 A)
 &rst
  ixpk= 2647, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2279,2283,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   79 LEU  HN           79 LEU  MDY         5.50    (#   2648:20  Unique         1.94, 3.92 A)
 &rst
  ixpk= 2648, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  20-2:2649    79 LEU  MDY         5.50    (#   2649:20  Single Ambig)
 &rst
  ixpk= 2649, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1538,1375,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#   81 LYS  HN           80 PRO  HA          2.80    (#   2650:20  Unique         2.22, 2.87 A)
 &rst
  ixpk= 2650, nxpk= 20, iat=1294,1290, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   81 LYS  HA           80 PRO  HA          5.50    (#   2652:20  Unique         4.31, 4.85 A)
 &rst
  ixpk= 2652, nxpk= 20, iat=1296,1290, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2653    80 PRO  HA          5.50    (#   2653:20  Single Ambig)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,1290, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1281,1282,1252,1253,1252,1253,
 &end
#
#   80 PRO  HB+          80 PRO  HA          3.50    (#   2654:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2654, nxpk= 20, iat=  -1,1290, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1287,1288,
 &end
#
#    0 AMB  20-2:2655    80 PRO  HA          4.50    (#   2655:20  Single Ambig)
 &rst
  ixpk= 2655, nxpk= 20, iat=  -1,1290, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1298,1299,1298,1299,
 &end
#
#    0 AMB  20-2:2656    80 PRO  HA          5.50    (#   2656:20  Single Ambig)
 &rst
  ixpk= 2656, nxpk= 20, iat=  -1,1290, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,1320,1321,
 &end
#
#    0 AMB  20-2:2657    80 PRO  HA          4.50    (#   2657:20  Single Ambig)
 &rst
  ixpk= 2657, nxpk= 20, iat=  -1,1290, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1287,1288,1301,1302,
 &end
#
#    0 AMB  20-2:2658     0 AMB  20-1:2658   4.50    (#   2658:20  Double Ambig)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1304,1305,1304,1305,1284,1285,1940,1941,
 igr2=1290,1932,
 &end
#
#    0 AMB  20-2:2659     0 AMB  20-1:2659   5.50    (#   2659:20  Double Ambig)
 &rst
  ixpk= 2659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1287,1288,1287,1288,1287,1288,
 &end
#
#    0 AMB  20-2:2660    80 PRO  HB-         5.50    (#   2660:20  Single Ambig)
 &rst
  ixpk= 2660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1287,1288,
 &end
#
#    0 AMB  20-2:2661     0 AMB  20-1:2661   3.50    (#   2661:20  Double Ambig)
 &rst
  ixpk= 2661, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1284,1285,1320,1321,
 igr2=1287,1288,1287,1288,
 &end
#
#   80 PRO  HD-          80 PRO  HB+         5.50    (#   2662:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1287,1288,
 &end
#
#    0 AMB  20-2:2663     0 AMB  20-1:2663   5.50    (#   2663:20  Double Ambig)
 &rst
  ixpk= 2663, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1281,1282,2273,2274,
 igr2=1287,1288,1287,1288,
 &end
#
#   80 PRO  HD+          80 PRO  HB-         5.50    (#   2664:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1287,1288,
 &end
#
#   80 PRO  HD-          80 PRO  HB-         5.50    (#   2665:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1287,1288,
 &end
#
#   80 PRO  HA           80 PRO  HB+         4.50    (#   2666:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2666, nxpk= 20, iat=1290,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1287,1288,
 &end
#
#   80 PRO  HA           80 PRO  HB-         4.50    (#   2667:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 2667, nxpk= 20, iat=1290,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1287,1288,
 &end
#
#   83 LEU  HN           80 PRO  HB+         5.50    (#   2668:20  Unique         3.65, 5.85 A)
 &rst
  ixpk= 2668, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   83 LEU  HN           80 PRO  HB-         5.50    (#   2669:20  Unique         3.65, 5.85 A)
 &rst
  ixpk= 2669, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   82 ARG  HN           80 PRO  HB-         5.50    (#   2670:20  Unique         2.18, 4.31 A)
 &rst
  ixpk= 2670, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   81 LYS  HN           80 PRO  HB-         5.50    (#   2671:20  Unique         2.64, 4.27 A)
 &rst
  ixpk= 2671, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   82 ARG  HN           80 PRO  HB+         5.50    (#   2672:20  Unique         2.18, 4.31 A)
 &rst
  ixpk= 2672, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   81 LYS  HN           80 PRO  HB+         5.50    (#   2673:20  Unique         2.64, 4.27 A)
 &rst
  ixpk= 2673, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1287,1288,
 &end
#
#   83 LEU  HN           80 PRO  HG-         5.50    (#   2674:20  Unique         2.39, 4.72 A)
 &rst
  ixpk= 2674, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1284,1285,
 &end
#
#   83 LEU  HN           80 PRO  HG+         5.50    (#   2675:20  Unique         2.39, 4.72 A)
 &rst
  ixpk= 2675, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1284,1285,
 &end
#
#  142 ASP  HA          145 ARG  HG+         5.50    (#   2676:20  Unique         1.99, 4.50 A)
 &rst
  ixpk= 2676, nxpk= 20, iat=2337,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2391,2392,
 &end
#
#    0 AMB  20-2:2677     0 AMB  20-1:2677   5.50    (#   2677:20  Double Ambig)
 &rst
  ixpk= 2677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1342,
 igr2=1284,1285,1284,1285,
 &end
#
#   80 PRO  HD-          80 PRO  HG+         5.50    (#   2678:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1284,1285,
 &end
#
#   80 PRO  HD-          80 PRO  HG-         5.50    (#   2679:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2679, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1281,1282,
 igr2=1284,1285,
 &end
#
#    0 AMB  20-2:2680     0 AMB  20-1:2680   5.50    (#   2680:20  Double Ambig)
 &rst
  ixpk= 2680, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1281,1282,2273,2274,
 igr2=1284,1285,1284,1285,
 &end
#
#    0 AMB  20-2:2681    80 PRO  HG-         5.50    (#   2681:20  Single Ambig)
 &rst
  ixpk= 2681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1281,1282,2273,2274,
 igr2=1284,1285,
 &end
#
#   80 PRO  HB+          80 PRO  HG+         5.50    (#   2682:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,
 igr2=1284,1285,
 &end
#
#   80 PRO  HB+          80 PRO  HG-         5.50    (#   2683:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 2683, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,
 igr2=1284,1285,
 &end
#
#    0 AMB  20-2:2684     0 AMB  20-1:2684   5.50    (#   2684:20  Double Ambig)
 &rst
  ixpk= 2684, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 igr2=1284,1285,1284,1285,
 &end
#
#    0 AMB  20-2:2685    80 PRO  HG-         5.50    (#   2685:20  Single Ambig)
 &rst
  ixpk= 2685, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 igr2=1284,1285,
 &end
#
#    0 AMB  20-2:2686     0 AMB  20-1:2686   5.50    (#   2686:20  Double Ambig)
 &rst
  ixpk= 2686, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1281,1282,1281,1282,1281,1282,
 &end
#
#    0 AMB  20-2:2687    80 PRO  HD-         4.50    (#   2687:20  Single Ambig)
 &rst
  ixpk= 2687, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,1270,1271,1272,1274,1275,1276,
 igr2=1281,1282,
 &end
#
#    0 AMB  20-2:2689     0 AMB  20-1:2689   5.50    (#   2689:20  Double Ambig)
 &rst
  ixpk= 2689, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1344,1345,1323,1324,
 igr2=1281,1282,1281,1282,
 &end
#
#   83 LEU  HG           80 PRO  HD-         5.50    (#   2690:20  Unique         2.86, 4.68 A)
 &rst
  ixpk= 2690, nxpk= 20, iat=1347,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1281,1282,
 &end
#
#    0 AMB  20-2:2691    80 PRO  HD-         5.50    (#   2691:20  Single Ambig)
 &rst
  ixpk= 2691, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1344,1345,1323,1324,
 igr2=1281,1282,
 &end
#
#   80 PRO  HG+          80 PRO  HD+         5.50    (#   2692:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,
 igr2=1281,1282,
 &end
#
#   80 PRO  HG-          80 PRO  HD+         5.50    (#   2693:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,
 igr2=1281,1282,
 &end
#
#   80 PRO  HG+          80 PRO  HD-         5.50    (#   2694:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 2694, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,
 igr2=1281,1282,
 &end
#
#   80 PRO  HB-          80 PRO  HD-         5.50    (#   2695:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2695, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,
 igr2=1281,1282,
 &end
#
#   80 PRO  HB+          80 PRO  HD+         5.50    (#   2696:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2696, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,
 igr2=1281,1282,
 &end
#
#   80 PRO  HB+          80 PRO  HD-         5.50    (#   2697:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 2697, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1287,1288,
 igr2=1281,1282,
 &end
#
#   79 LEU  HA           80 PRO  HD+         5.50    (#   2698:20  Unique         2.00, 2.27 A)
 &rst
  ixpk= 2698, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1281,1282,
 &end
#
#   79 LEU  HA           80 PRO  HD-         5.50    (#   2699:20  Unique         2.00, 2.27 A)
 &rst
  ixpk= 2699, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1281,1282,
 &end
#
#    0 AMB  20-2:2700     0 AMB  20-1:2700   5.50    (#   2700:20  Double Ambig)
 &rst
  ixpk= 2700, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1290,1342,
 igr2=1281,1282,1281,1282,
 &end
#
#   84 VAL  MGX          81 LYS  HA          5.50    (#   2702:20  Unique         1.98, 4.11 A)
 &rst
  ixpk= 2702, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGY          81 LYS  HA          4.50    (#   2703:20  Unique         1.98, 4.11 A)
 &rst
  ixpk= 2703, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2705    81 LYS  HA          4.50    (#   2705:20  Single Ambig)
 &rst
  ixpk= 2705, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1363,1301,1302,
 &end
#
#    0 AMB  20-2:2706    81 LYS  HA          4.50    (#   2706:20  Single Ambig)
 &rst
  ixpk= 2706, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1284,1285,1249,1250,1249,1250,1243,1244,
 &end
#
#    0 AMB  20-2:2707    81 LYS  HA          3.50    (#   2707:20  Single Ambig)
 &rst
  ixpk= 2707, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1298,1299,1298,1299,
 &end
#
#    0 AMB  20-2:2708    81 LYS  HA          5.50    (#   2708:20  Single Ambig)
 &rst
  ixpk= 2708, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1307,1308,1307,1308,
 &end
#
#    0 AMB  20-2:2709    81 LYS  HA          5.50    (#   2709:20  Single Ambig)
 &rst
  ixpk= 2709, nxpk= 20, iat=  -1,1296, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1290,1342,
 &end
#
#   84 VAL  HN           81 LYS  HA          5.50    (#   2710:20  Unique         2.60, 3.25 A)
 &rst
  ixpk= 2710, nxpk= 20, iat=1359,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HE           81 LYS  HA          5.50    (#   2711:20  Unique         5.57, 6.63 A)
 &rst
  ixpk= 2711, nxpk= 20, iat=1329,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 LEU  HN           81 LYS  HA          5.50    (#   2712:20  Unique         3.50, 3.79 A)
 &rst
  ixpk= 2712, nxpk= 20, iat=1340,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HN           81 LYS  HA          5.50    (#   2713:20  Unique         2.79, 3.01 A)
 &rst
  ixpk= 2713, nxpk= 20, iat=1316,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 LYS  HN           81 LYS  HA          4.50    (#   2714:20  Unique         2.27, 2.36 A)
 &rst
  ixpk= 2714, nxpk= 20, iat=1294,1296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 TRP  HE1          81 LYS  HA          5.50    (#   2715:20  Unique         2.13, 3.08 A)
 &rst
  ixpk= 2715, nxpk= 20, iat=1409,1296, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 LYS  HN           81 LYS  HB+         4.50    (#   2716:20  Unique         2.53, 3.61 A)
 &rst
  ixpk= 2716, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1298,1299,
 &end
#
#   81 LYS  HN           81 LYS  HB-         4.50    (#   2717:20  Unique         2.53, 3.61 A)
 &rst
  ixpk= 2717, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1298,1299,
 &end
#
#    0 AMB  20-2:2718     0 AMB  20-1:2718   4.50    (#   2718:20  Double Ambig)
 &rst
  ixpk= 2718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1890,1891,1296,
 igr2=1929,1930,1298,1299,
 &end
#
#   81 LYS  HA           81 LYS  HB-         4.50    (#   2719:20  Unique         2.27, 2.70 A)
 &rst
  ixpk= 2719, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1298,1299,
 &end
#
#    0 AMB  20-2:2720     0 AMB  20-1:2720   5.50    (#   2720:20  Double Ambig)
 &rst
  ixpk= 2720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1307,1308,1307,1308,
 igr2=1298,1299,1298,1299,
 &end
#
#   84 VAL  MGY          81 LYS  HG+         5.50    (#   2721:20  Unique         2.92, 6.38 A)
 &rst
  ixpk= 2721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1301,1302,
 &end
#
#   84 VAL  MGY          81 LYS  HG-         5.50    (#   2722:20  Unique         2.92, 6.38 A)
 &rst
  ixpk= 2722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1301,1302,
 &end
#
#   81 LYS  HB-          81 LYS  HG-         4.50    (#   2723:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 2723, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1298,1299,
 igr2=1301,1302,
 &end
#
#    0 AMB  20-2:2724     0 AMB  20-1:2724   4.50    (#   2724:20  Double Ambig)
 &rst
  ixpk= 2724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1298,1299,2469,2470,
 igr2=1301,1302,2472,2473,
 &end
#
#   81 LYS  HB-          81 LYS  HG+         4.50    (#   2725:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 2725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1298,1299,
 igr2=1301,1302,
 &end
#
#   81 LYS  HB+          81 LYS  HG+         4.50    (#   2726:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 2726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1298,1299,
 igr2=1301,1302,
 &end
#
#    0 AMB  20-2:2727     0 AMB  20-1:2727   5.50    (#   2727:20  Double Ambig)
 &rst
  ixpk= 2727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1307,1308,1307,1308,
 igr2=1301,1302,1301,1302,
 &end
#
#    0 AMB  20-2:2728     0 AMB  20-1:2728   4.50    (#   2728:20  Double Ambig)
 &rst
  ixpk= 2728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1=1307,1308,1307,1308,2478,2479,2478,2479,
 igr2=1301,1302,2472,2473,
 &end
#
#   81 LYS  HA           81 LYS  HG+         5.50    (#   2729:20  Unique         2.07, 3.25 A)
 &rst
  ixpk= 2729, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   81 LYS  HA           81 LYS  HG-         5.50    (#   2730:20  Unique         2.07, 3.25 A)
 &rst
  ixpk= 2730, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   80 PRO  HA           81 LYS  HG+         5.50    (#   2731:20  Unique         2.95, 4.80 A)
 &rst
  ixpk= 2731, nxpk= 20, iat=1290,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#    0 AMB  20-2:2732     0 AMB  20-1:2732   5.50    (#   2732:20  Double Ambig)
 &rst
  ixpk= 2732, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2467,1290,
 igr2=2472,2473,1301,1302,
 &end
#
#   82 ARG  HE           81 LYS  HG+         5.50    (#   2733:20  Unique         3.61, 7.49 A)
 &rst
  ixpk= 2733, nxpk= 20, iat=1329,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#    0 AMB  20-2:2734     0 AMB  20-1:2734   5.50    (#   2734:20  Double Ambig)
 &rst
  ixpk= 2734, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2397,2279,2283,
 igr2=2472,2473,1301,1302,
 &end
#
#   81 LYS  HN           81 LYS  HG+         5.50    (#   2735:20  Unique         2.15, 3.58 A)
 &rst
  ixpk= 2735, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   81 LYS  HN           81 LYS  HG-         5.50    (#   2736:20  Unique         2.15, 3.58 A)
 &rst
  ixpk= 2736, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1301,1302,
 &end
#
#   81 LYS  HN            0 AMB  20-1:2737   5.50    (#   2737:20  Single Ambig)
 &rst
  ixpk= 2737, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1304,1305,1304,1305,
 &end
#
#   81 LYS  HA            0 AMB  20-1:2738   5.50    (#   2738:20  Single Ambig)
 &rst
  ixpk= 2738, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1304,1305,1304,1305,
 &end
#
#    0 AMB  20-2:2739     0 AMB  20-1:2739   2.80    (#   2739:20  Double Ambig)
 &rst
  ixpk= 2739, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=1307,1308,1307,1308,1307,1308,1252,1253,1252,1253,
      1252,1253,1307,1308,
 igr2=1249,1250,1249,1250,1249,1250,1249,1250,1249,1250,
      1304,1305,1304,1305,1304,1305,
 &end
#
#   84 VAL  MGY           0 AMB  20-1:2740   5.50    (#   2740:20  Single Ambig)
 &rst
  ixpk= 2740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1304,1305,1304,1305,
 &end
#
#   82 ARG  HN           82 ARG  HA          4.50    (#   2741:20  Unique         2.73, 2.90 A)
 &rst
  ixpk= 2741, nxpk= 20, iat=1316,1318, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 VAL  HN           82 ARG  HA          5.50    (#   2742:20  Unique         3.97, 4.40 A)
 &rst
  ixpk= 2742, nxpk= 20, iat=1359,1318, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  119 PRO  HD+         118 THR  HA          3.50    (#   2743:20  Unique         2.01, 2.60 A)
 &rst
  ixpk= 2743, nxpk= 20, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1923,1924,
 &end
#
#  119 PRO  HD-         118 THR  HA          3.50    (#   2744:20  Unique         2.01, 2.60 A)
 &rst
  ixpk= 2744, nxpk= 20, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1923,1924,
 &end
#
#  118 THR  MG2         118 THR  HA          3.50    (#   2745:20  Unique         2.13, 3.00 A)
 &rst
  ixpk= 2745, nxpk= 20, iat=  -1,1910, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1914,1915,1916,
 &end
#
#    0 AMB  20-2:2746    82 ARG  HA          5.50    (#   2746:20  Single Ambig)
 &rst
  ixpk= 2746, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1349,1350,1351,1353,1354,1355,1270,1271,1272,1274,
      1275,1276,
 &end
#
#   82 ARG  HN           82 ARG  HB-         4.50    (#   2747:20  Unique         2.19, 3.21 A)
 &rst
  ixpk= 2747, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1320,1321,
 &end
#
#   82 ARG  HN           82 ARG  HB+         5.50    (#   2748:20  Unique         2.19, 3.21 A)
 &rst
  ixpk= 2748, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1320,1321,
 &end
#
#   82 ARG  HA           82 ARG  HB-         3.50    (#   2749:20  Unique         2.27, 2.47 A)
 &rst
  ixpk= 2749, nxpk= 20, iat=1318,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1320,1321,
 &end
#
#    0 AMB  20-2:2750    82 ARG  HB-         4.50    (#   2750:20  Single Ambig)
 &rst
  ixpk= 2750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1326,1327,1326,1327,
 igr2=1320,1321,
 &end
#
#    0 AMB  20-2:2751     0 AMB  20-1:2751   5.50    (#   2751:20  Double Ambig)
 &rst
  ixpk= 2751, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1316,1555,
 igr2=1323,1324, 111, 112,
 &end
#
#   82 ARG  HN           82 ARG  HG-         5.50    (#   2752:20  Unique         2.13, 2.98 A)
 &rst
  ixpk= 2752, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1323,1324,
 &end
#
#   83 LEU  HN           82 ARG  HG+         5.50    (#   2753:20  Unique         1.94, 2.97 A)
 &rst
  ixpk= 2753, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1323,1324,
 &end
#
#   83 LEU  HN           82 ARG  HG-         5.50    (#   2754:20  Unique         1.94, 2.97 A)
 &rst
  ixpk= 2754, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1323,1324,
 &end
#
#   82 ARG  HB+          82 ARG  HG-         3.50    (#   2755:20  Unique         2.21, 2.72 A)
 &rst
  ixpk= 2755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1320,1321,
 igr2=1323,1324,
 &end
#
#   82 ARG  HN            0 AMB  20-1:2757   5.50    (#   2757:20  Single Ambig)
 &rst
  ixpk= 2757, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1326,1327,1326,1327,
 &end
#
#   82 ARG  HE            0 AMB  20-1:2758   5.50    (#   2758:20  Single Ambig)
 &rst
  ixpk= 2758, nxpk= 20, iat=1329,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1326,1327,1326,1327,
 &end
#
#    0 AMB  20-2:2759     0 AMB  20-1:2759   5.50    (#   2759:20  Double Ambig)
 &rst
  ixpk= 2759, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1101,1318,
 igr2=1123,1124,1123,1124,1326,1327,1326,1327,
 &end
#
#    0 AMB  20-2:2760     0 AMB  20-1:2760   2.80    (#   2760:20  Double Ambig)
 &rst
  ixpk= 2760, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.03, r4= 6.53,
 igr1=1320,1321,1320,1321,2388,2389,2388,2389,2388,2389,
      
 igr2=1326,1327,1326,1327,2394,2395,2394,2395,2394,2395,
      
 &end
#
#    0 AMB  20-2:2761    83 LEU  HA          3.50    (#   2761:20  Single Ambig)
 &rst
  ixpk= 2761, nxpk= 20, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 &end
#
#   83 LEU  HB+          83 LEU  HA          4.50    (#   2762:20  Unique         2.31, 2.66 A)
 &rst
  ixpk= 2762, nxpk= 20, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1344,1345,
 &end
#
#    0 AMB  20-2:2763    83 LEU  HA          4.50    (#   2763:20  Single Ambig)
 &rst
  ixpk= 2763, nxpk= 20, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1344,1345,1323,1324,
 &end
#
#   83 LEU  HG           83 LEU  HA          4.50    (#   2764:20  Unique         2.79, 3.46 A)
 &rst
  ixpk= 2764, nxpk= 20, iat=1347,1342, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:2765    83 LEU  HA          5.50    (#   2765:20  Single Ambig)
 &rst
  ixpk= 2765, nxpk= 20, iat=  -1,1342, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1320,1321,1298,1299,
 &end
#
#   84 VAL  HN           83 LEU  HA          5.50    (#   2766:20  Unique         3.27, 3.42 A)
 &rst
  ixpk= 2766, nxpk= 20, iat=1359,1342, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   83 LEU  HN           83 LEU  HA          5.50    (#   2767:20  Unique         2.76, 2.93 A)
 &rst
  ixpk= 2767, nxpk= 20, iat=1340,1342, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HN           83 LEU  HA          5.50    (#   2768:20  Unique         4.58, 4.85 A)
 &rst
  ixpk= 2768, nxpk= 20, iat=1316,1342, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2769     0 AMB  20-1:2769   3.50    (#   2769:20  Double Ambig)
 &rst
  ixpk= 2769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,1349,1350,1351,1353,1354,1355,
 igr2=1344,1345,1344,1345,1344,1345,
 &end
#
#    0 AMB  20-2:2770    83 LEU  HB-         3.50    (#   2770:20  Single Ambig)
 &rst
  ixpk= 2770, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,1349,1350,1351,1353,1354,1355,
 igr2=1344,1345,
 &end
#
#   79 LEU  MDX          83 LEU  HB+         5.50    (#   2771:20  Unique         1.96, 4.80 A)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1344,1345,
 &end
#
#   79 LEU  MDX          83 LEU  HB-         5.50    (#   2772:20  Unique         1.96, 4.80 A)
 &rst
  ixpk= 2772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1344,1345,
 &end
#
#   79 LEU  HB-          83 LEU  HB+         5.50    (#   2773:20  Unique         2.09, 4.70 A)
 &rst
  ixpk= 2773, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1265,1266,
 igr2=1344,1345,
 &end
#
#   79 LEU  HB-          83 LEU  HB-         5.50    (#   2774:20  Unique         2.09, 4.70 A)
 &rst
  ixpk= 2774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1265,1266,
 igr2=1344,1345,
 &end
#
#   83 LEU  HG           83 LEU  HB+         4.50    (#   2775:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 2775, nxpk= 20, iat=1347,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1344,1345,
 &end
#
#   83 LEU  HG           83 LEU  HB-         4.50    (#   2776:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 2776, nxpk= 20, iat=1347,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1344,1345,
 &end
#
#   83 LEU  HA           83 LEU  HB+         5.50    (#   2777:20  Unique         2.31, 2.66 A)
 &rst
  ixpk= 2777, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   83 LEU  HA           83 LEU  HB-         5.50    (#   2778:20  Unique         2.31, 2.66 A)
 &rst
  ixpk= 2778, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   84 VAL  HN           83 LEU  HB+         5.50    (#   2779:20  Unique         2.65, 3.67 A)
 &rst
  ixpk= 2779, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   84 VAL  HN           83 LEU  HB-         5.50    (#   2780:20  Unique         2.65, 3.67 A)
 &rst
  ixpk= 2780, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   83 LEU  HN           83 LEU  HB+         5.50    (#   2781:20  Unique         2.09, 3.13 A)
 &rst
  ixpk= 2781, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   83 LEU  HN           83 LEU  HB-         5.50    (#   2782:20  Unique         2.09, 3.13 A)
 &rst
  ixpk= 2782, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1344,1345,
 &end
#
#   83 LEU  HN           83 LEU  HG          5.50    (#   2783:20  Unique         2.23, 2.94 A)
 &rst
  ixpk= 2783, nxpk= 20, iat=1340,1347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HN           83 LEU  HG          5.50    (#   2784:20  Unique         2.36, 4.09 A)
 &rst
  ixpk= 2784, nxpk= 20, iat=1359,1347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2785     0 AMB  20-1:2785   4.50    (#   2785:20  Double Ambig)
 &rst
  ixpk= 2785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1385,1386,1385,1386,2273,2274,1385,1386,
 igr2=  31,  32,1347,
 &end
#
#   83 LEU  HG           83 LEU  MDX         2.80    (#   2786:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 2786, nxpk= 20, iat=1347,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#    0 AMB  20-2:2787    83 LEU  MDX         3.50    (#   2787:20  Single Ambig)
 &rst
  ixpk= 2787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1323,1324,1344,1345,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   83 LEU  HB+          83 LEU  MDX         2.80    (#   2788:20  Unique         2.03, 3.31 A)
 &rst
  ixpk= 2788, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1344,1345,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#    0 AMB  20-2:2789    83 LEU  MDX         4.50    (#   2789:20  Single Ambig)
 &rst
  ixpk= 2789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1284,1285,1320,1321,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   80 PRO  HB+          83 LEU  MDX         5.50    (#   2790:20  Unique         4.56, 8.22 A)
 &rst
  ixpk= 2790, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1287,1288,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   80 PRO  HD-          83 LEU  MDX         4.50    (#   2791:20  Unique         2.06, 6.07 A)
 &rst
  ixpk= 2791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1281,1282,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#    0 AMB  20-2:2792    83 LEU  MDX         5.50    (#   2792:20  Single Ambig)
 &rst
  ixpk= 2792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1326,1327,1326,1327,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   80 PRO  HD+          83 LEU  MDX         4.50    (#   2793:20  Unique         2.06, 6.07 A)
 &rst
  ixpk= 2793, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1281,1282,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   79 LEU  HA           83 LEU  MDX         5.50    (#   2794:20  Unique         3.40, 6.62 A)
 &rst
  ixpk= 2794, nxpk= 20, iat=1263,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   83 LEU  HA           83 LEU  MDX         4.50    (#   2795:20  Unique         2.02, 3.90 A)
 &rst
  ixpk= 2795, nxpk= 20, iat=1342,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   84 VAL  HN           83 LEU  MDX         5.50    (#   2796:20  Unique         3.27, 5.48 A)
 &rst
  ixpk= 2796, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   95 GLN  HE2+         83 LEU  MDX         5.50    (#   2797:20  Unique         2.04, 6.14 A)
 &rst
  ixpk= 2797, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1550,1551,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#  139 PHE  HE           83 LEU  MDX         5.50    (#   2798:20  Unique         1.99, 6.05 A)
 &rst
  ixpk= 2798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2279,2283,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   83 LEU  HN           83 LEU  MDX         5.50    (#   2799:20  Unique         2.77, 4.53 A)
 &rst
  ixpk= 2799, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   82 ARG  HN           83 LEU  MDX         5.50    (#   2800:20  Unique         3.97, 6.06 A)
 &rst
  ixpk= 2800, nxpk= 20, iat=1316,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   83 LEU  HN           83 LEU  MDY         5.50    (#   2802:20  Unique         2.77, 4.53 A)
 &rst
  ixpk= 2802, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   84 VAL  HN           83 LEU  MDY         5.50    (#   2803:20  Unique         3.27, 5.48 A)
 &rst
  ixpk= 2803, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#    0 AMB  20-2:2805     0 AMB  20-1:2805   4.50    (#   2805:20  Double Ambig)
 &rst
  ixpk= 2805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1=1284,1285, 310, 311,1320,1321,
 igr2=1349,1350,1351,1353,1354,1355, 329, 330, 331, 333,
       334, 335,
 &end
#
#    0 AMB  20-2:2806     0 AMB  20-1:2806   2.80    (#   2806:20  Double Ambig)
 &rst
  ixpk= 2806, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=2159,2160,1344,1345,
 igr2= 329, 330, 331, 333, 334, 335,1349,1350,1351,1353,
      1354,1355,
 &end
#
#    0 AMB  20-2:2807     0 AMB  20-1:2807   2.80    (#   2807:20  Double Ambig)
 &rst
  ixpk= 2807, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1347,2162,2163,
 igr2=1349,1350,1351,1353,1354,1355, 329, 330, 331, 333,
       334, 335,
 &end
#
#    0 AMB  20-2:2808    83 LEU  MDY         3.50    (#   2808:20  Single Ambig)
 &rst
  ixpk= 2808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1323,1324,1344,1345,
 igr2=1349,1350,1351,1353,1354,1355,
 &end
#
#   84 VAL  MGX          84 VAL  HA          4.50    (#   2809:20  Unique         2.16, 3.11 A)
 &rst
  ixpk= 2809, nxpk= 20, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2810   111 ILE  HA          5.50    (#   2810:20  Single Ambig)
 &rst
  ixpk= 2810, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  20-2:2811     0 AMB  20-1:2811   3.50    (#   2811:20  Double Ambig)
 &rst
  ixpk= 2811, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1365,1366,1367,1369,1370,1371, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,
 igr2=1361,1807,
 &end
#
#    0 AMB  20-2:2812     0 AMB  20-1:2812   4.50    (#   2812:20  Double Ambig)
 &rst
  ixpk= 2812, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1809,1363,1382,1383,
 igr2=1807,1361,
 &end
#
#    0 AMB  20-2:2813    84 VAL  HA          5.50    (#   2813:20  Single Ambig)
 &rst
  ixpk= 2813, nxpk= 20, iat=  -1,1361, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1382,1383,1379,1380,
 &end
#
#    0 AMB  20-2:2814     0 AMB  20-1:2814   5.50    (#   2814:20  Double Ambig)
 &rst
  ixpk= 2814, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1794,1795,1379,1380,1849,1850,1851,1842,1843,
 igr2=1807,1361,
 &end
#
#    0 AMB  20-2:2815     0 AMB  20-1:2815   5.50    (#   2815:20  Double Ambig)
 &rst
  ixpk= 2815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 891,1342,
 igr2=1807,1361,
 &end
#
#   85 ARG  HA           84 VAL  HA          5.50    (#   2816:20  Unique         4.35, 4.38 A)
 &rst
  ixpk= 2816, nxpk= 20, iat=1377,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HN           84 VAL  HA          5.50    (#   2818:20  Unique         2.75, 2.82 A)
 &rst
  ixpk= 2818, nxpk= 20, iat=1359,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  112 ASN  HN          111 ILE  HA          4.50    (#   2819:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 2819, nxpk= 20, iat=1824,1807, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 ARG  HN           84 VAL  HA          3.50    (#   2820:20  Unique         2.15, 2.26 A)
 &rst
  ixpk= 2820, nxpk= 20, iat=1375,1361, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HE1          84 VAL  HA          5.50    (#   2821:20  Unique         4.86, 4.99 A)
 &rst
  ixpk= 2821, nxpk= 20, iat=1409,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HE1          84 VAL  HB          5.50    (#   2822:20  Unique         1.92, 2.13 A)
 &rst
  ixpk= 2822, nxpk= 20, iat=1409,1363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2823    84 VAL  HB          5.50    (#   2823:20  Single Ambig)
 &rst
  ixpk= 2823, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1375,1501,
 &end
#
#   83 LEU  HN           84 VAL  HB          5.50    (#   2824:20  Unique         4.09, 4.46 A)
 &rst
  ixpk= 2824, nxpk= 20, iat=1340,1363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2825     0 AMB  20-1:2825   5.50    (#   2825:20  Double Ambig)
 &rst
  ixpk= 2825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1407,2226,
 igr2=1363,2216,2217,
 &end
#
#    0 AMB  20-2:2826     0 AMB  20-1:2826   4.50    (#   2826:20  Double Ambig)
 &rst
  ixpk= 2826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 369,2209,
 igr2=2216,2217,2216,2217,
 &end
#
#   81 LYS  HA           84 VAL  HB          5.50    (#   2827:20  Unique         1.94, 2.86 A)
 &rst
  ixpk= 2827, nxpk= 20, iat=1296,1363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HA           84 VAL  HB          5.50    (#   2828:20  Unique         3.00, 3.02 A)
 &rst
  ixpk= 2828, nxpk= 20, iat=1361,1363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   81 LYS  HB-          84 VAL  HB          5.50    (#   2829:20  Unique         3.36, 4.84 A)
 &rst
  ixpk= 2829, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1298,1299,
 &end
#
#   84 VAL  MGY          84 VAL  HB          3.50    (#   2830:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2830, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          84 VAL  HB          3.50    (#   2831:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 2831, nxpk= 20, iat=  -1,1363, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          84 VAL  MGX         3.50    (#   2832:20  Unique         1.99, 5.94 A)
 &rst
  ixpk= 2832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   93 ILE  QG2          84 VAL  MGX         4.50    (#   2833:20  Unique         3.41, 6.23 A)
 &rst
  ixpk= 2833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1518,1519,1520,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGY          84 VAL  MGX         5.50    (#   2835:20  Unique         1.99, 5.94 A)
 &rst
  ixpk= 2835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2836    84 VAL  MGX         3.50    (#   2836:20  Single Ambig)
 &rst
  ixpk= 2836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1363,1301,1302,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   79 LEU  HG           84 VAL  MGX         5.50    (#   2837:20  Unique         2.43, 4.95 A)
 &rst
  ixpk= 2837, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   79 LEU  HB+          84 VAL  MGX         5.50    (#   2838:20  Unique         2.00, 5.18 A)
 &rst
  ixpk= 2838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1265,1266,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2839    84 VAL  MGX         5.50    (#   2839:20  Single Ambig)
 &rst
  ixpk= 2839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1304,1305,1304,1305,1489,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2840    84 VAL  MGX         5.50    (#   2840:20  Single Ambig)
 &rst
  ixpk= 2840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1307,1308,1307,1308,1403,1404,1252,1253,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  HA           84 VAL  MGX         4.50    (#   2841:20  Unique         2.16, 3.11 A)
 &rst
  ixpk= 2841, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  HA           84 VAL  MGX         5.50    (#   2842:20  Unique         3.94, 6.10 A)
 &rst
  ixpk= 2842, nxpk= 20, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   81 LYS  HA           84 VAL  MGX         5.50    (#   2843:20  Unique         1.98, 4.11 A)
 &rst
  ixpk= 2843, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   93 ILE  HA           84 VAL  MGX         4.50    (#   2844:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 2844, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   85 ARG  HA           84 VAL  MGX         5.50    (#   2845:20  Unique         3.83, 5.86 A)
 &rst
  ixpk= 2845, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  HN           84 VAL  MGX         5.50    (#   2846:20  Unique         1.92, 3.70 A)
 &rst
  ixpk= 2846, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2848    84 VAL  MGX         5.50    (#   2848:20  Single Ambig)
 &rst
  ixpk= 2848, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1531,1418,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   83 LEU  HN           84 VAL  MGX         5.50    (#   2849:20  Unique         2.72, 5.35 A)
 &rst
  ixpk= 2849, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   86 TRP  HN           84 VAL  MGX         5.50    (#   2850:20  Unique         1.89, 4.43 A)
 &rst
  ixpk= 2850, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2851    84 VAL  MGX         4.50    (#   2851:20  Single Ambig)
 &rst
  ixpk= 2851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1375,1501,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   87 ASP  HN           84 VAL  MGX         5.50    (#   2852:20  Unique         4.43, 6.85 A)
 &rst
  ixpk= 2852, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   86 TRP  HE1          84 VAL  MGX         5.50    (#   2853:20  Unique         2.72, 4.09 A)
 &rst
  ixpk= 2853, nxpk= 20, iat=1409,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2855     0 AMB  20-1:2855   2.80    (#   2855:20  Double Ambig)
 &rst
  ixpk= 2855, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 224, 225,1363, 827,
 igr2= 895, 896, 897, 899, 900, 901,1365,1366,1367,1369,
      1370,1371,
 &end
#
#    0 AMB  20-2:2856     0 AMB  20-1:2856   3.50    (#   2856:20  Double Ambig)
 &rst
  ixpk= 2856, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1361,1807,
 igr2=1365,1366,1367,1369,1370,1371, 895, 896, 897, 899,
       900, 901,
 &end
#
#   81 LYS  HA           84 VAL  MGY         4.50    (#   2857:20  Unique         1.98, 4.11 A)
 &rst
  ixpk= 2857, nxpk= 20, iat=1296,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   93 ILE  HA           84 VAL  MGY         4.50    (#   2858:20  Unique         2.26, 4.22 A)
 &rst
  ixpk= 2858, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  HN           84 VAL  MGY         3.50    (#   2859:20  Unique         1.92, 3.70 A)
 &rst
  ixpk= 2859, nxpk= 20, iat=1359,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   59 GLY  HN           58 VAL  MGY         5.50    (#   2860:20  Unique         2.10, 4.38 A)
 &rst
  ixpk= 2860, nxpk= 20, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 895, 896, 897, 899, 900, 901,
 &end
#
#   83 LEU  HN           84 VAL  MGY         5.50    (#   2861:20  Unique         2.72, 5.35 A)
 &rst
  ixpk= 2861, nxpk= 20, iat=1340,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2862    84 VAL  MGY         5.50    (#   2862:20  Single Ambig)
 &rst
  ixpk= 2862, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1375,1501,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   81 LYS  HN           84 VAL  MGY         5.50    (#   2863:20  Unique         2.67, 5.36 A)
 &rst
  ixpk= 2863, nxpk= 20, iat=1294,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1365,1366,1367,1369,1370,1371,
 &end
#
#   87 ASP  HN           85 ARG  HA          5.50    (#   2864:20  Unique         3.67, 4.57 A)
 &rst
  ixpk= 2864, nxpk= 20, iat=1423,1377, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HN           85 ARG  HA          3.50    (#   2865:20  Unique         2.16, 3.28 A)
 &rst
  ixpk= 2865, nxpk= 20, iat=1399,1377, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2866     0 AMB  20-1:2866   5.50    (#   2866:20  Double Ambig)
 &rst
  ixpk= 2866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1388, 380,
 igr2=1377, 553,
 &end
#
#   86 TRP  HD1          85 ARG  HA          5.50    (#   2867:20  Unique         2.83, 3.33 A)
 &rst
  ixpk= 2867, nxpk= 20, iat=1407,1377, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2868    85 ARG  HA          5.50    (#   2868:20  Single Ambig)
 &rst
  ixpk= 2868, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1385,1386,1385,1386,
 &end
#
#   85 ARG  HB+          85 ARG  HA          4.50    (#   2869:20  Unique         2.24, 2.52 A)
 &rst
  ixpk= 2869, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1379,1380,
 &end
#
#   85 ARG  HG+          85 ARG  HA          3.50    (#   2870:20  Unique         2.65, 3.65 A)
 &rst
  ixpk= 2870, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1382,1383,
 &end
#
#   85 ARG  HB-          85 ARG  HA          3.50    (#   2871:20  Unique         2.24, 2.52 A)
 &rst
  ixpk= 2871, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1379,1380,
 &end
#
#    0 AMB  20-2:2872     0 AMB  20-1:2872   5.50    (#   2872:20  Double Ambig)
 &rst
  ixpk= 2872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1382,1383,2299,2300,
 igr2=1377, 553,
 &end
#
#   84 VAL  MGX          85 ARG  HA          5.50    (#   2873:20  Unique         3.83, 5.86 A)
 &rst
  ixpk= 2873, nxpk= 20, iat=  -1,1377, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  20-2:2874     0 AMB  20-1:2874   5.50    (#   2874:20  Double Ambig)
 &rst
  ixpk= 2874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1377,1153,
 igr2=1379,1380,1182,
 &end
#
#   85 ARG  HA           85 ARG  HB-         5.50    (#   2875:20  Unique         2.24, 2.52 A)
 &rst
  ixpk= 2875, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1379,1380,
 &end
#
#   85 ARG  HE           85 ARG  HB+         5.50    (#   2876:20  Unique         2.24, 3.74 A)
 &rst
  ixpk= 2876, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1379,1380,
 &end
#
#   85 ARG  HE           85 ARG  HB-         5.50    (#   2877:20  Unique         2.24, 3.74 A)
 &rst
  ixpk= 2877, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1379,1380,
 &end
#
#    0 AMB  20-2:2878     0 AMB  20-1:2878   5.50    (#   2878:20  Double Ambig)
 &rst
  ixpk= 2878, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1375,1501,
 igr2=1379,1380,1379,1380,
 &end
#
#    0 AMB  20-2:2879    85 ARG  HB-         5.50    (#   2879:20  Single Ambig)
 &rst
  ixpk= 2879, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1375,1501,
 igr2=1379,1380,
 &end
#
#   86 TRP  HN           85 ARG  HB+         5.50    (#   2880:20  Unique         2.93, 3.93 A)
 &rst
  ixpk= 2880, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1379,1380,
 &end
#
#    0 AMB  20-2:2881     0 AMB  20-1:2881   5.50    (#   2881:20  Double Ambig)
 &rst
  ixpk= 2881, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1399, 258,
 igr2=1379,1380, 286, 287,
 &end
#
#   87 ASP  HN           85 ARG  HG-         5.50    (#   2882:20  Unique         1.89, 3.49 A)
 &rst
  ixpk= 2882, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HN           85 ARG  HG+         5.50    (#   2883:20  Unique         1.87, 3.09 A)
 &rst
  ixpk= 2883, nxpk= 20, iat=1375,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HN           85 ARG  HG-         5.50    (#   2884:20  Unique         1.87, 3.09 A)
 &rst
  ixpk= 2884, nxpk= 20, iat=1375,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   86 TRP  HN           85 ARG  HG+         5.50    (#   2885:20  Unique         1.94, 3.65 A)
 &rst
  ixpk= 2885, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   86 TRP  HN           85 ARG  HG-         5.50    (#   2886:20  Unique         1.94, 3.65 A)
 &rst
  ixpk= 2886, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HE           85 ARG  HG+         5.50    (#   2887:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 2887, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HE           85 ARG  HG-         5.50    (#   2888:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 2888, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HA           85 ARG  HG+         5.50    (#   2891:20  Unique         2.65, 3.65 A)
 &rst
  ixpk= 2891, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   85 ARG  HA           85 ARG  HG-         5.50    (#   2892:20  Unique         2.65, 3.65 A)
 &rst
  ixpk= 2892, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   84 VAL  HA           85 ARG  HG+         5.50    (#   2893:20  Unique         3.11, 4.91 A)
 &rst
  ixpk= 2893, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#   84 VAL  HA           85 ARG  HG-         5.50    (#   2894:20  Unique         3.11, 4.91 A)
 &rst
  ixpk= 2894, nxpk= 20, iat=1361,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1382,1383,
 &end
#
#    0 AMB  20-2:2895     0 AMB  20-1:2895   4.50    (#   2895:20  Double Ambig)
 &rst
  ixpk= 2895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1385,1386,1385,1386,
 igr2=1382,1383,1382,1383,
 &end
#
#    0 AMB  20-2:2896    85 ARG  HG-         3.50    (#   2896:20  Single Ambig)
 &rst
  ixpk= 2896, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1385,1386,1385,1386,
 igr2=1382,1383,
 &end
#
#   85 ARG  HB+          85 ARG  HG+         3.50    (#   2897:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1379,1380,
 igr2=1382,1383,
 &end
#
#   85 ARG  HB+          85 ARG  HG-         4.50    (#   2898:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 2898, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1379,1380,
 igr2=1382,1383,
 &end
#
#   88 THR  MG2          85 ARG  HG+         5.50    (#   2899:20  Unique         1.98, 4.46 A)
 &rst
  ixpk= 2899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1441,1442,1443,
 igr2=1382,1383,
 &end
#
#   88 THR  MG2          85 ARG  HG-         5.50    (#   2900:20  Unique         1.98, 4.46 A)
 &rst
  ixpk= 2900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1441,1442,1443,
 igr2=1382,1383,
 &end
#
#    0 AMB  20-2:2901     0 AMB  20-1:2901   5.50    (#   2901:20  Double Ambig)
 &rst
  ixpk= 2901, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 igr2=1382,1383,1382,1383,
 &end
#
#   84 VAL  MGX           0 AMB  20-1:2902   5.50    (#   2902:20  Single Ambig)
 &rst
  ixpk= 2902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1385,1386,1385,1386,
 &end
#
#   88 THR  MG2           0 AMB  20-1:2903   5.50    (#   2903:20  Single Ambig)
 &rst
  ixpk= 2903, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1441,1442,1443,
 igr2=1385,1386,1385,1386,
 &end
#
#    0 AMB  20-2:2904     0 AMB  20-1:2904   4.50    (#   2904:20  Double Ambig)
 &rst
  ixpk= 2904, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1379,1380,1379,1380,
 igr2=1385,1386,1385,1386,
 &end
#
#   85 ARG  HG-           0 AMB  20-1:2905   3.50    (#   2905:20  Single Ambig)
 &rst
  ixpk= 2905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1382,1383,
 igr2=1385,1386,1385,1386,
 &end
#
#    0 AMB  20-2:2906     0 AMB  20-1:2906   2.80    (#   2906:20  Double Ambig)
 &rst
  ixpk= 2906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1382,1383,1382,1383,
 igr2=1385,1386,1385,1386,
 &end
#
#   85 ARG  HA            0 AMB  20-1:2907   4.50    (#   2907:20  Single Ambig)
 &rst
  ixpk= 2907, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1385,1386,1385,1386,
 &end
#
#   85 ARG  HE            0 AMB  20-1:2908   3.50    (#   2908:20  Single Ambig)
 &rst
  ixpk= 2908, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1385,1386,1385,1386,
 &end
#
#   86 TRP  HN            0 AMB  20-1:2909   5.50    (#   2909:20  Single Ambig)
 &rst
  ixpk= 2909, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1385,1386,1385,1386,
 &end
#
#   85 ARG  HN            0 AMB  20-1:2910   5.50    (#   2910:20  Single Ambig)
 &rst
  ixpk= 2910, nxpk= 20, iat=1375,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1385,1386,1385,1386,
 &end
#
#   87 ASP  HN            0 AMB  20-1:2911   5.50    (#   2911:20  Single Ambig)
 &rst
  ixpk= 2911, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1385,1386,1385,1386,
 &end
#
#   87 ASP  HN           86 TRP  HA          5.50    (#   2912:20  Unique         2.59, 2.82 A)
 &rst
  ixpk= 2912, nxpk= 20, iat=1423,1401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:2913    86 TRP  HA          5.50    (#   2913:20  Single Ambig)
 &rst
  ixpk= 2913, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1501,1375,
 &end
#
#   86 TRP  HN           86 TRP  HA          4.50    (#   2914:20  Unique         2.27, 2.37 A)
 &rst
  ixpk= 2914, nxpk= 20, iat=1399,1401, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 TRP  HE3          86 TRP  HA          4.50    (#   2915:20  Unique         2.59, 3.38 A)
 &rst
  ixpk= 2915, nxpk= 20, iat=1418,1401, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 TRP  HD1          86 TRP  HA          5.50    (#   2916:20  Unique         3.80, 4.09 A)
 &rst
  ixpk= 2916, nxpk= 20, iat=1407,1401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   88 THR  HN           86 TRP  HA          5.50    (#   2917:20  Unique         3.48, 3.67 A)
 &rst
  ixpk= 2917, nxpk= 20, iat=1435,1401, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HB+          86 TRP  HA          4.50    (#   2918:20  Unique         2.38, 2.73 A)
 &rst
  ixpk= 2918, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1403,1404,
 &end
#
#   86 TRP  HB-          86 TRP  HA          4.50    (#   2919:20  Unique         2.38, 2.73 A)
 &rst
  ixpk= 2919, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1403,1404,
 &end
#
#   91 VAL  MGY          86 TRP  HA          4.50    (#   2921:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 2921, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  MGX          86 TRP  HA          4.50    (#   2922:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 2922, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          86 TRP  HA          5.50    (#   2923:20  Unique         2.79, 5.40 A)
 &rst
  ixpk= 2923, nxpk= 20, iat=  -1,1401, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          86 TRP  HB+         5.50    (#   2924:20  Unique         3.94, 6.62 A)
 &rst
  ixpk= 2924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1403,1404,
 &end
#
#   91 VAL  MGX          86 TRP  HB+         5.50    (#   2926:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 2926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1403,1404,
 &end
#
#   91 VAL  MGX          86 TRP  HB-         5.50    (#   2927:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 2927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1403,1404,
 &end
#
#   91 VAL  MGY          86 TRP  HB+         5.50    (#   2928:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 2928, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1403,1404,
 &end
#
#   91 VAL  MGY          86 TRP  HB-         5.50    (#   2929:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 2929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1403,1404,
 &end
#
#   86 TRP  HA           86 TRP  HB+         4.50    (#   2930:20  Unique         2.38, 2.73 A)
 &rst
  ixpk= 2930, nxpk= 20, iat=1401,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1403,1404,
 &end
#
#   86 TRP  HA           86 TRP  HB-         4.50    (#   2931:20  Unique         2.38, 2.73 A)
 &rst
  ixpk= 2931, nxpk= 20, iat=1401,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1403,1404,
 &end
#
#   85 ARG  HA           86 TRP  HB+         5.50    (#   2932:20  Unique         4.29, 5.15 A)
 &rst
  ixpk= 2932, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   85 ARG  HA           86 TRP  HB-         5.50    (#   2933:20  Unique         4.29, 5.15 A)
 &rst
  ixpk= 2933, nxpk= 20, iat=1377,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HZ3          86 TRP  HB+         5.50    (#   2934:20  Unique         4.84, 5.59 A)
 &rst
  ixpk= 2934, nxpk= 20, iat=1416,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HD1          86 TRP  HB+         5.50    (#   2935:20  Unique         2.57, 3.29 A)
 &rst
  ixpk= 2935, nxpk= 20, iat=1407,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HD1          86 TRP  HB-         5.50    (#   2936:20  Unique         2.57, 3.29 A)
 &rst
  ixpk= 2936, nxpk= 20, iat=1407,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HE3          86 TRP  HB+         5.50    (#   2937:20  Unique         2.42, 3.28 A)
 &rst
  ixpk= 2937, nxpk= 20, iat=1418,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HE3          86 TRP  HB-         5.50    (#   2938:20  Unique         2.42, 3.28 A)
 &rst
  ixpk= 2938, nxpk= 20, iat=1418,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HN           86 TRP  HB+         5.50    (#   2939:20  Unique         2.56, 3.71 A)
 &rst
  ixpk= 2939, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HN           86 TRP  HB-         4.50    (#   2940:20  Unique         2.56, 3.71 A)
 &rst
  ixpk= 2940, nxpk= 20, iat=1399,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1403,1404,
 &end
#
#   87 ASP  HN           86 TRP  HB+         5.50    (#   2941:20  Unique         3.83, 4.32 A)
 &rst
  ixpk= 2941, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   87 ASP  HN           86 TRP  HB-         5.50    (#   2942:20  Unique         3.83, 4.32 A)
 &rst
  ixpk= 2942, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HE1          86 TRP  HB+         5.50    (#   2943:20  Unique         4.76, 5.04 A)
 &rst
  ixpk= 2943, nxpk= 20, iat=1409,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   86 TRP  HE1          86 TRP  HB-         5.50    (#   2944:20  Unique         4.76, 5.04 A)
 &rst
  ixpk= 2944, nxpk= 20, iat=1409,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1403,1404,
 &end
#
#   88 THR  HN           87 ASP  HA          5.50    (#   2945:20  Unique         2.70, 3.13 A)
 &rst
  ixpk= 2945, nxpk= 20, iat=1435,1425, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HB+          87 ASP  HA          2.80    (#   2946:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 2946, nxpk= 20, iat=  -1,1425, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1427,1428,
 &end
#
#    0 AMB  20-2:2947     0 AMB  20-1:2947   3.50    (#   2947:20  Double Ambig)
 &rst
  ixpk= 2947, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 555, 556,1427,1428,
 igr2= 553,1425,
 &end
#
#    0 AMB  20-2:2948     0 AMB  20-1:2948   5.50    (#   2948:20  Double Ambig)
 &rst
  ixpk= 2948, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1382,1383,1379,1380,
 igr2=1427,1428,1427,1428,
 &end
#
#   85 ARG  HG+          87 ASP  HB-         5.50    (#   2949:20  Unique         2.34, 4.65 A)
 &rst
  ixpk= 2949, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1382,1383,
 igr2=1427,1428,
 &end
#
#   87 ASP  HA           87 ASP  HB+         3.50    (#   2950:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 2950, nxpk= 20, iat=1425,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1427,1428,
 &end
#
#   87 ASP  HA           87 ASP  HB-         3.50    (#   2951:20  Unique         2.36, 2.81 A)
 &rst
  ixpk= 2951, nxpk= 20, iat=1425,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1427,1428,
 &end
#
#   88 THR  HN           87 ASP  HB+         5.50    (#   2952:20  Unique         3.09, 3.99 A)
 &rst
  ixpk= 2952, nxpk= 20, iat=1435,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1427,1428,
 &end
#
#   88 THR  HN           87 ASP  HB-         5.50    (#   2953:20  Unique         3.09, 3.99 A)
 &rst
  ixpk= 2953, nxpk= 20, iat=1435,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1427,1428,
 &end
#
#   87 ASP  HN           87 ASP  HB+         4.50    (#   2954:20  Unique         2.41, 3.11 A)
 &rst
  ixpk= 2954, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1427,1428,
 &end
#
#   87 ASP  HN           87 ASP  HB-         4.50    (#   2955:20  Unique         2.41, 3.11 A)
 &rst
  ixpk= 2955, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1427,1428,
 &end
#
#   87 ASP  HN           88 THR  HA          5.50    (#   2956:20  Unique         4.27, 4.41 A)
 &rst
  ixpk= 2956, nxpk= 20, iat=1423,1437, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   89 LYS  HN           88 THR  HA          3.50    (#   2957:20  Unique         3.12, 3.53 A)
 &rst
  ixpk= 2957, nxpk= 20, iat=1449,1437, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 THR  HN           88 THR  HA          4.50    (#   2958:20  Unique         2.77, 2.90 A)
 &rst
  ixpk= 2958, nxpk= 20, iat=1435,1437, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   88 THR  HB           88 THR  HA          3.50    (#   2959:20  Unique         2.37, 2.44 A)
 &rst
  ixpk= 2959, nxpk= 20, iat=1439,1437, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2960    88 THR  HA          5.50    (#   2960:20  Single Ambig)
 &rst
  ixpk= 2960, nxpk= 20, iat=  -1,1437, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1453,1454,1459,1460,1459,1460,
 &end
#
#   89 LYS  HG+          88 THR  HA          5.50    (#   2961:20  Unique         3.08, 4.50 A)
 &rst
  ixpk= 2961, nxpk= 20, iat=  -1,1437, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#   89 LYS  HG-          88 THR  HA          5.50    (#   2962:20  Unique         3.08, 4.50 A)
 &rst
  ixpk= 2962, nxpk= 20, iat=  -1,1437, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#   88 THR  MG2          88 THR  HA          3.50    (#   2963:20  Unique         2.32, 3.43 A)
 &rst
  ixpk= 2963, nxpk= 20, iat=  -1,1437, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1441,1442,1443,
 &end
#
#    2 ILE  QD1          88 THR  HB          5.50    (#   2964:20  Unique         1.96, 4.27 A)
 &rst
  ixpk= 2964, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  34,  35,  36,
 &end
#
#   88 THR  MG2          88 THR  HB          3.50    (#   2965:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2965, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1441,1442,1443,
 &end
#
#   89 LYS  HG+          88 THR  HB          5.50    (#   2966:20  Unique         3.58, 5.81 A)
 &rst
  ixpk= 2966, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#   85 ARG  HG+          88 THR  HB          5.50    (#   2968:20  Unique         1.99, 5.42 A)
 &rst
  ixpk= 2968, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1382,1383,
 &end
#
#   85 ARG  HB+          88 THR  HB          5.50    (#   2969:20  Unique         3.19, 6.49 A)
 &rst
  ixpk= 2969, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1379,1380,
 &end
#
#   88 THR  HA           88 THR  HB          3.50    (#   2970:20  Unique         2.37, 2.44 A)
 &rst
  ixpk= 2970, nxpk= 20, iat=1437,1439, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 THR  HN           88 THR  HB          4.50    (#   2973:20  Unique         2.30, 3.38 A)
 &rst
  ixpk= 2973, nxpk= 20, iat=1435,1439, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 LYS  HN           88 THR  HB          3.50    (#   2974:20  Unique         1.83, 3.54 A)
 &rst
  ixpk= 2974, nxpk= 20, iat=1449,1439, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:2975    88 THR  HB          5.50    (#   2975:20  Single Ambig)
 &rst
  ixpk= 2975, nxpk= 20, iat=  -1,1439, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1501,1375,1485,
 &end
#
#   87 ASP  HN           88 THR  HB          5.50    (#   2976:20  Unique         3.43, 4.70 A)
 &rst
  ixpk= 2976, nxpk= 20, iat=1423,1439, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HN           88 THR  MG2         5.50    (#   2977:20  Unique         2.78, 4.05 A)
 &rst
  ixpk= 2977, nxpk= 20, iat=1423,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1441,1442,1443,
 &end
#
#   89 LYS  HN           88 THR  MG2         4.50    (#   2978:20  Unique         1.92, 3.77 A)
 &rst
  ixpk= 2978, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1441,1442,1443,
 &end
#
#   92 CYS  HN           88 THR  MG2         5.50    (#   2979:20  Unique         2.31, 4.43 A)
 &rst
  ixpk= 2979, nxpk= 20, iat=1501,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1441,1442,1443,
 &end
#
#   88 THR  HN           88 THR  MG2         4.50    (#   2980:20  Unique         1.85, 3.16 A)
 &rst
  ixpk= 2980, nxpk= 20, iat=1435,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1441,1442,1443,
 &end
#
#   85 ARG  HE           88 THR  MG2         5.50    (#   2981:20  Unique         1.94, 4.54 A)
 &rst
  ixpk= 2981, nxpk= 20, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1441,1442,1443,
 &end
#
#    0 AMB  20-2:2983    88 THR  MG2         5.50    (#   2983:20  Single Ambig)
 &rst
  ixpk= 2983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1425,1377,
 igr2=1441,1442,1443,
 &end
#
#   88 THR  HA           88 THR  MG2         3.50    (#   2984:20  Unique         2.32, 3.43 A)
 &rst
  ixpk= 2984, nxpk= 20, iat=1437,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1441,1442,1443,
 &end
#
#   88 THR  HB           88 THR  MG2         3.50    (#   2985:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 2985, nxpk= 20, iat=1439,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1441,1442,1443,
 &end
#
#    0 AMB  20-2:2986    88 THR  MG2         5.50    (#   2986:20  Single Ambig)
 &rst
  ixpk= 2986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1385,1386,1385,1386,
 igr2=1441,1442,1443,
 &end
#
#   85 ARG  HB+          88 THR  MG2         5.50    (#   2987:20  Unique         2.27, 5.57 A)
 &rst
  ixpk= 2987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1379,1380,
 igr2=1441,1442,1443,
 &end
#
#    0 AMB  20-2:2988    88 THR  MG2         5.50    (#   2988:20  Single Ambig)
 &rst
  ixpk= 2988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1382,1383,1379,1380,
 igr2=1441,1442,1443,
 &end
#
#   91 VAL  MGY          89 LYS  HA          5.50    (#   2989:20  Unique         3.15, 5.63 A)
 &rst
  ixpk= 2989, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   89 LYS  HG+          89 LYS  HA          5.50    (#   2990:20  Unique         2.53, 3.26 A)
 &rst
  ixpk= 2990, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#   89 LYS  HG-          89 LYS  HA          5.50    (#   2991:20  Unique         2.53, 3.26 A)
 &rst
  ixpk= 2991, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#    0 AMB  20-2:2992    89 LYS  HA          4.50    (#   2992:20  Single Ambig)
 &rst
  ixpk= 2992, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1459,1460,1459,1460,1453,1454,
 &end
#
#   89 LYS  HB+          89 LYS  HA          3.50    (#   2993:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 2993, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1453,1454,
 &end
#
#   90 PRO  HB+          89 LYS  HA          5.50    (#   2994:20  Unique         4.10, 4.21 A)
 &rst
  ixpk= 2994, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1478,1479,
 &end
#
#    0 AMB  20-2:2995    89 LYS  HA          5.50    (#   2995:20  Single Ambig)
 &rst
  ixpk= 2995, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1462,1463,1462,1463,
 &end
#
#    0 AMB  20-2:2996    89 LYS  HA          5.50    (#   2996:20  Single Ambig)
 &rst
  ixpk= 2996, nxpk= 20, iat=  -1,1451, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1472,1473,1472,1473,
 &end
#
#   91 VAL  HA           89 LYS  HA          5.50    (#   2997:20  Unique         3.16, 3.77 A)
 &rst
  ixpk= 2997, nxpk= 20, iat=1487,1451, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   90 PRO  HA           89 LYS  HA          4.50    (#   2999:20  Unique         1.88, 1.91 A)
 &rst
  ixpk= 2999, nxpk= 20, iat=1481,1451, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 LYS  HN           89 LYS  HA          5.50    (#   3000:20  Unique         2.27, 2.30 A)
 &rst
  ixpk= 3000, nxpk= 20, iat=1449,1451, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HN           89 LYS  HA          4.50    (#   3001:20  Unique         2.21, 2.78 A)
 &rst
  ixpk= 3001, nxpk= 20, iat=1485,1451, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 LYS  HN           89 LYS  HB+         4.50    (#   3005:20  Unique         3.12, 3.85 A)
 &rst
  ixpk= 3005, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1453,1454,
 &end
#
#   89 LYS  HN           89 LYS  HB-         4.50    (#   3006:20  Unique         3.12, 3.85 A)
 &rst
  ixpk= 3006, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1453,1454,
 &end
#
#  103 GLN  HN           66 ARG  HB+         5.50    (#   3007:20  Unique         2.63, 3.84 A)
 &rst
  ixpk= 3007, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#  103 GLN  HN           66 ARG  HB-         5.50    (#   3008:20  Unique         2.63, 3.84 A)
 &rst
  ixpk= 3008, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1020,1021,
 &end
#
#   90 PRO  HA           89 LYS  HB-         5.50    (#   3009:20  Unique         2.06, 3.87 A)
 &rst
  ixpk= 3009, nxpk= 20, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1453,1454,
 &end
#
#    0 AMB  20-2:3010     0 AMB  20-1:3010   5.50    (#   3010:20  Double Ambig)
 &rst
  ixpk= 3010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1481,1241,
 igr2=1453,1454,1243,1244,
 &end
#
#   89 LYS  HA           89 LYS  HB+         4.50    (#   3011:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 3011, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1453,1454,
 &end
#
#   89 LYS  HA           89 LYS  HB-         4.50    (#   3012:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 3012, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1453,1454,
 &end
#
#    0 AMB  20-2:3013     0 AMB  20-1:3013   5.50    (#   3013:20  Double Ambig)
 &rst
  ixpk= 3013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1437,1401,
 igr2=1453,1454,1453,1454,
 &end
#
#    0 AMB  20-2:3014    89 LYS  HB-         5.50    (#   3014:20  Single Ambig)
 &rst
  ixpk= 3014, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1437,1401,
 igr2=1453,1454,
 &end
#
#    0 AMB  20-2:3015     0 AMB  20-1:3015   5.50    (#   3015:20  Double Ambig)
 &rst
  ixpk= 3015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1472,1473,1472,1473,
 igr2=1453,1454,1453,1454,
 &end
#
#    0 AMB  20-2:3016    89 LYS  HB-         5.50    (#   3016:20  Single Ambig)
 &rst
  ixpk= 3016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1472,1473,1472,1473,
 igr2=1453,1454,
 &end
#
#   89 LYS  HG-          89 LYS  HB+         4.50    (#   3017:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 3017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1456,1457,
 igr2=1453,1454,
 &end
#
#   89 LYS  HG-          89 LYS  HB-         4.50    (#   3018:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 3018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1456,1457,
 igr2=1453,1454,
 &end
#
#   89 LYS  HG+          89 LYS  HB-         3.50    (#   3019:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 3019, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1456,1457,
 igr2=1453,1454,
 &end
#
#   89 LYS  HG+          89 LYS  HB+         3.50    (#   3020:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 3020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1456,1457,
 igr2=1453,1454,
 &end
#
#    0 AMB  20-2:3021    89 LYS  HG-         5.50    (#   3021:20  Single Ambig)
 &rst
  ixpk= 3021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1462,1463,1462,1463,
 igr2=1456,1457,
 &end
#
#    0 AMB  20-2:3022     0 AMB  20-1:3022   5.50    (#   3022:20  Double Ambig)
 &rst
  ixpk= 3022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.85, r4=12.35,
 igr1=1462,1463,1462,1463,2709,2710,2709,2710,2709,2710,
      
 igr2=1456,1457,1456,1457,2703,2704,2703,2704,2703,2704,
      
 &end
#
#   88 THR  HA           89 LYS  HG+         5.50    (#   3023:20  Unique         3.08, 4.50 A)
 &rst
  ixpk= 3023, nxpk= 20, iat=1437,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   88 THR  HA           89 LYS  HG-         5.50    (#   3024:20  Unique         3.08, 4.50 A)
 &rst
  ixpk= 3024, nxpk= 20, iat=1437,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   89 LYS  HA           89 LYS  HG+         5.50    (#   3025:20  Unique         2.53, 3.26 A)
 &rst
  ixpk= 3025, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   89 LYS  HA           89 LYS  HG-         5.50    (#   3026:20  Unique         2.53, 3.26 A)
 &rst
  ixpk= 3026, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   89 LYS  HN           89 LYS  HG+         5.50    (#   3029:20  Unique         2.65, 3.32 A)
 &rst
  ixpk= 3029, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   89 LYS  HN           89 LYS  HG-         5.50    (#   3030:20  Unique         2.65, 3.32 A)
 &rst
  ixpk= 3030, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   91 VAL  HN           89 LYS  HG+         5.50    (#   3031:20  Unique         3.94, 5.50 A)
 &rst
  ixpk= 3031, nxpk= 20, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   91 VAL  HN           89 LYS  HG-         5.50    (#   3032:20  Unique         3.94, 5.50 A)
 &rst
  ixpk= 3032, nxpk= 20, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1456,1457,
 &end
#
#   91 VAL  HN            0 AMB  20-1:3033   5.50    (#   3033:20  Single Ambig)
 &rst
  ixpk= 3033, nxpk= 20, iat=1485,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1459,1460,1459,1460,
 &end
#
#   89 LYS  HN            0 AMB  20-1:3034   5.50    (#   3034:20  Single Ambig)
 &rst
  ixpk= 3034, nxpk= 20, iat=1449,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1459,1460,1459,1460,
 &end
#
#    0 AMB  20-2:3035     0 AMB  20-1:3035   5.50    (#   3035:20  Double Ambig)
 &rst
  ixpk= 3035, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1481, 914,
 igr2=1459,1460,1459,1460, 976, 977,
 &end
#
#   89 LYS  HA            0 AMB  20-1:3036   5.50    (#   3036:20  Single Ambig)
 &rst
  ixpk= 3036, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1459,1460,1459,1460,
 &end
#
#    0 AMB  20-2:3037     0 AMB  20-1:3037   3.50    (#   3037:20  Double Ambig)
 &rst
  ixpk= 3037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1462,1463,1462,1463,1462,1463,2709,2710,2709,2710,
      2709,2710, 979, 980, 979, 980,
 igr2=1459,1460,1459,1460,1459,1460,2706,2707,2706,2707,
      2706,2707, 976, 977, 976, 977,
 &end
#
#   91 VAL  HN           90 PRO  HA          4.50    (#   3039:20  Unique         2.15, 2.32 A)
 &rst
  ixpk= 3039, nxpk= 20, iat=1485,1481, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 LYS  HA           90 PRO  HA          5.50    (#   3040:20  Unique         1.88, 1.91 A)
 &rst
  ixpk= 3040, nxpk= 20, iat=1451,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HA           90 PRO  HA          5.50    (#   3041:20  Unique         4.31, 4.35 A)
 &rst
  ixpk= 3041, nxpk= 20, iat=1487,1481, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3042    90 PRO  HA          5.50    (#   3042:20  Single Ambig)
 &rst
  ixpk= 3042, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1472,1473,1472,1473,
 &end
#
#   90 PRO  HB+          90 PRO  HA          5.50    (#   3043:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3043, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1478,1479,
 &end
#
#   90 PRO  HB-          90 PRO  HA          5.50    (#   3044:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3044, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1478,1479,
 &end
#
#   89 LYS  HB+          90 PRO  HA          5.50    (#   3045:20  Unique         2.06, 3.87 A)
 &rst
  ixpk= 3045, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1453,1454,
 &end
#
#   89 LYS  HB-          90 PRO  HA          5.50    (#   3046:20  Unique         2.06, 3.87 A)
 &rst
  ixpk= 3046, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1453,1454,
 &end
#
#   91 VAL  MGY          90 PRO  HA          5.50    (#   3047:20  Unique         3.77, 5.61 A)
 &rst
  ixpk= 3047, nxpk= 20, iat=  -1,1481, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#    2 ILE  QG2          90 PRO  HB-         5.50    (#   3048:20  Unique         3.15, 5.06 A)
 &rst
  ixpk= 3048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2=1478,1479,
 &end
#
#    0 AMB  20-2:3049     0 AMB  20-1:3049   5.50    (#   3049:20  Double Ambig)
 &rst
  ixpk= 3049, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.08, r4=12.58,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,1522,1523,
 igr2=2629,2630,2629,2630,2629,2630,1478,1479,
 &end
#
#    0 AMB  20-2:3050    90 PRO  HB-         5.50    (#   3050:20  Single Ambig)
 &rst
  ixpk= 3050, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1472,1473,1472,1473,
 igr2=1478,1479,
 &end
#
#    0 AMB  20-2:3051     0 AMB  20-1:3051   5.50    (#   3051:20  Double Ambig)
 &rst
  ixpk= 3051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1472,1473,1472,1473,
 igr2=1478,1479,1478,1479,
 &end
#
#   89 LYS  HA           90 PRO  HB-         5.50    (#   3052:20  Unique         4.10, 4.21 A)
 &rst
  ixpk= 3052, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1478,1479,
 &end
#
#   89 LYS  HA           90 PRO  HB+         5.50    (#   3053:20  Unique         4.10, 4.21 A)
 &rst
  ixpk= 3053, nxpk= 20, iat=1451,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1478,1479,
 &end
#
#   90 PRO  HA           90 PRO  HB+         3.50    (#   3054:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3054, nxpk= 20, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1478,1479,
 &end
#
#   90 PRO  HA           90 PRO  HB-         4.50    (#   3055:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3055, nxpk= 20, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1478,1479,
 &end
#
#    0 AMB  20-2:3056     0 AMB  20-1:3056   4.50    (#   3056:20  Double Ambig)
 &rst
  ixpk= 3056, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1501,1485,
 igr2=1478,1479,1478,1479,
 &end
#
#    0 AMB  20-2:3057    90 PRO  HB-         5.50    (#   3057:20  Single Ambig)
 &rst
  ixpk= 3057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1501,1485,
 igr2=1478,1479,
 &end
#
#    0 AMB  20-2:3058     0 AMB  20-1:3058   5.50    (#   3058:20  Double Ambig)
 &rst
  ixpk= 3058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1485,1501,
 igr2=1475,1476,1475,1476,
 &end
#
#    0 AMB  20-2:3059    90 PRO  HG-         5.50    (#   3059:20  Single Ambig)
 &rst
  ixpk= 3059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1485,1501,
 igr2=1475,1476,
 &end
#
#    0 AMB  20-2:3060     0 AMB  20-1:3060   5.50    (#   3060:20  Double Ambig)
 &rst
  ixpk= 3060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  42,1481,
 igr2=1475,1476,1475,1476,
 &end
#
#    0 AMB  20-2:3061    90 PRO  HG-         5.50    (#   3061:20  Single Ambig)
 &rst
  ixpk= 3061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  42,1481,
 igr2=1475,1476,
 &end
#
#    0 AMB  20-2:3062     0 AMB  20-1:3062   3.50    (#   3062:20  Double Ambig)
 &rst
  ixpk= 3062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1472,1473,1472,1473,
 igr2=1475,1476,1475,1476,
 &end
#
#    0 AMB  20-2:3063    90 PRO  HG-         3.50    (#   3063:20  Single Ambig)
 &rst
  ixpk= 3063, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1472,1473,1472,1473,
 igr2=1475,1476,
 &end
#
#   90 PRO  HB+          90 PRO  HG+         4.50    (#   3064:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1478,1479,
 igr2=1475,1476,
 &end
#
#   90 PRO  HB+          90 PRO  HG-         5.50    (#   3065:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3065, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1478,1479,
 igr2=1475,1476,
 &end
#
#    2 ILE  QG2          90 PRO  HG+         5.50    (#   3066:20  Unique         1.97, 3.45 A)
 &rst
  ixpk= 3066, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  27,  28,  29,
 igr2=1475,1476,
 &end
#
#    2 ILE  QG2           0 AMB  20-1:3068   5.50    (#   3068:20  Single Ambig)
 &rst
  ixpk= 3068, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  27,  28,  29,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3069     0 AMB  20-1:3069   5.50    (#   3069:20  Double Ambig)
 &rst
  ixpk= 3069, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1456,1457,1456,1457,
 igr2=1472,1473,1472,1473,
 &end
#
#   90 PRO  HG-           0 AMB  20-1:3070   2.80    (#   3070:20  Single Ambig)
 &rst
  ixpk= 3070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1475,1476,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3071     0 AMB  20-1:3071   2.80    (#   3071:20  Double Ambig)
 &rst
  ixpk= 3071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1475,1476,1475,1476,1478,1479,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3072     0 AMB  20-1:3072   5.50    (#   3072:20  Double Ambig)
 &rst
  ixpk= 3072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1478,1479,1478,1479,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3073     0 AMB  20-1:3073   5.50    (#   3073:20  Double Ambig)
 &rst
  ixpk= 3073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  42,1481,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3074     0 AMB  20-1:3074   5.50    (#   3074:20  Double Ambig)
 &rst
  ixpk= 3074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1451,  85,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3075     0 AMB  20-1:3075   5.50    (#   3075:20  Double Ambig)
 &rst
  ixpk= 3075, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1449,  64,
 igr2=1472,1473,1472,1473,
 &end
#
#    0 AMB  20-2:3076     0 AMB  20-1:3076   5.50    (#   3076:20  Double Ambig)
 &rst
  ixpk= 3076, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1485,1501,
 igr2=1472,1473,1472,1473,1472,1473,
 &end
#
#   84 VAL  MGX          91 VAL  HA          5.50    (#   3077:20  Unique         3.94, 6.10 A)
 &rst
  ixpk= 3077, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          91 VAL  HA          4.50    (#   3078:20  Unique         1.99, 3.39 A)
 &rst
  ixpk= 3078, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  MGY          91 VAL  HA          4.50    (#   3080:20  Unique         1.99, 3.39 A)
 &rst
  ixpk= 3080, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  HB           91 VAL  HA          5.50    (#   3081:20  Unique         2.37, 2.59 A)
 &rst
  ixpk= 3081, nxpk= 20, iat=1489,1487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3082    91 VAL  HA          5.50    (#   3082:20  Single Ambig)
 &rst
  ixpk= 3082, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1478,1479,1475,1476,
 &end
#
#   92 CYS  HB+          91 VAL  HA          5.50    (#   3083:20  Unique         3.92, 4.96 A)
 &rst
  ixpk= 3083, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1505,1506,
 &end
#
#   92 CYS  HB-          91 VAL  HA          5.50    (#   3084:20  Unique         3.92, 4.96 A)
 &rst
  ixpk= 3084, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1505,1506,
 &end
#
#   86 TRP  HA           91 VAL  HA          5.50    (#   3085:20  Unique         2.62, 3.10 A)
 &rst
  ixpk= 3085, nxpk= 20, iat=1401,1487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   89 LYS  HA           91 VAL  HA          5.50    (#   3086:20  Unique         3.16, 3.77 A)
 &rst
  ixpk= 3086, nxpk= 20, iat=1451,1487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3088    91 VAL  HA          2.80    (#   3088:20  Single Ambig)
 &rst
  ixpk= 3088, nxpk= 20, iat=  -1,1487, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1501,1485,
 &end
#
#   92 CYS  HN           91 VAL  HB          4.50    (#   3089:20  Unique         1.75, 3.63 A)
 &rst
  ixpk= 3089, nxpk= 20, iat=1501,1489, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 TRP  HA           91 VAL  HB          5.50    (#   3092:20  Unique         1.86, 3.27 A)
 &rst
  ixpk= 3092, nxpk= 20, iat=1401,1489, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HA           91 VAL  HB          5.50    (#   3093:20  Unique         2.37, 2.59 A)
 &rst
  ixpk= 3093, nxpk= 20, iat=1487,1489, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  MGY          91 VAL  HB          3.50    (#   3094:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3094, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  MGX          91 VAL  HB          3.50    (#   3095:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3095, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          91 VAL  HB          5.50    (#   3096:20  Unique         3.30, 5.94 A)
 &rst
  ixpk= 3096, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          91 VAL  MGX         3.50    (#   3097:20  Unique         1.99, 5.94 A)
 &rst
  ixpk= 3097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   93 ILE  QG2          91 VAL  MGX         2.80    (#   3098:20  Unique         1.99, 4.88 A)
 &rst
  ixpk= 3098, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1518,1519,1520,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGY          91 VAL  MGX         4.50    (#   3099:20  Unique         1.99, 5.94 A)
 &rst
  ixpk= 3099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#  120 GLU  HB-          25 ALA  MB          5.50    (#   3101:20  Unique         3.72, 7.47 A)
 &rst
  ixpk= 3101, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1940,1941,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:3103    25 ALA  MB          5.50    (#   3103:20  Single Ambig)
 &rst
  ixpk= 3103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 421, 422, 514, 515,2021,2022,
 igr2= 384, 385, 386,
 &end
#
#    0 AMB  20-2:3105    91 VAL  MGX         5.50    (#   3105:20  Single Ambig)
 &rst
  ixpk= 3105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1363,1301,1302,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  HB           91 VAL  MGX         2.80    (#   3106:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3106, nxpk= 20, iat=1489,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   92 CYS  HB-          91 VAL  MGX         5.50    (#   3107:20  Unique         2.85, 6.45 A)
 &rst
  ixpk= 3107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1505,1506,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HB+          91 VAL  MGX         5.50    (#   3108:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 3108, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1403,1404,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  HA           91 VAL  MGX         4.50    (#   3109:20  Unique         1.99, 3.39 A)
 &rst
  ixpk= 3109, nxpk= 20, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HA           91 VAL  MGX         4.50    (#   3110:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 3110, nxpk= 20, iat=1401,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:3111    91 VAL  MGX         5.50    (#   3111:20  Single Ambig)
 &rst
  ixpk= 3111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1451,1377,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HZ3          91 VAL  MGX         4.50    (#   3112:20  Unique         1.98, 4.15 A)
 &rst
  ixpk= 3112, nxpk= 20, iat=1416,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HE3          91 VAL  MGX         5.50    (#   3113:20  Unique         1.99, 3.63 A)
 &rst
  ixpk= 3113, nxpk= 20, iat=1418,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:3114    91 VAL  MGX         3.50    (#   3114:20  Single Ambig)
 &rst
  ixpk= 3114, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1501,1485,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:3115    91 VAL  MGX         5.50    (#   3115:20  Single Ambig)
 &rst
  ixpk= 3115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1423,1512,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:3117    91 VAL  MGY         2.80    (#   3117:20  Single Ambig)
 &rst
  ixpk= 3117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1501,1485,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HE3          91 VAL  MGY         4.50    (#   3118:20  Unique         1.99, 3.63 A)
 &rst
  ixpk= 3118, nxpk= 20, iat=1418,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   86 TRP  HA           91 VAL  MGY         4.50    (#   3120:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 3120, nxpk= 20, iat=1401,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  20-2:3121    91 VAL  MGY         5.50    (#   3121:20  Single Ambig)
 &rst
  ixpk= 3121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1451,1377,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   90 PRO  HA           91 VAL  MGY         5.50    (#   3122:20  Unique         3.77, 5.61 A)
 &rst
  ixpk= 3122, nxpk= 20, iat=1481,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   91 VAL  HB           91 VAL  MGY         2.80    (#   3123:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3123, nxpk= 20, iat=1489,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1491,1492,1493,1495,1496,1497,
 &end
#
#   93 ILE  HN           92 CYS  HB+         5.50    (#   3127:20  Unique         3.57, 4.23 A)
 &rst
  ixpk= 3127, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1505,1506,
 &end
#
#   93 ILE  HN           92 CYS  HB-         5.50    (#   3128:20  Unique         3.57, 4.23 A)
 &rst
  ixpk= 3128, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1505,1506,
 &end
#
#    0 AMB  20-2:3129    92 CYS  HB-         5.50    (#   3129:20  Single Ambig)
 &rst
  ixpk= 3129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1375,1501,
 igr2=1505,1506,
 &end
#
#    0 AMB  20-2:3130     0 AMB  20-1:3130   4.50    (#   3130:20  Double Ambig)
 &rst
  ixpk= 3130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1375,1501,
 igr2=1505,1506,1505,1506,
 &end
#
#   91 VAL  HA           92 CYS  HB-         5.50    (#   3133:20  Unique         3.92, 4.96 A)
 &rst
  ixpk= 3133, nxpk= 20, iat=1487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1505,1506,
 &end
#
#   85 ARG  HG+          92 CYS  HB-         5.50    (#   3135:20  Unique         1.99, 5.78 A)
 &rst
  ixpk= 3135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1382,1383,
 igr2=1505,1506,
 &end
#
#   85 ARG  HG+          92 CYS  HB+         5.50    (#   3136:20  Unique         1.99, 5.78 A)
 &rst
  ixpk= 3136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1382,1383,
 igr2=1505,1506,
 &end
#
#    0 AMB  20-2:3137    92 CYS  HB-         5.50    (#   3137:20  Single Ambig)
 &rst
  ixpk= 3137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=  34,  35,  36,1270,1271,1272,1274,1275,1276,
 igr2=1505,1506,
 &end
#
#    0 AMB  20-2:3138     0 AMB  20-1:3138   5.50    (#   3138:20  Double Ambig)
 &rst
  ixpk= 3138, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  34,  35,  36,1270,1271,1272,1274,1275,1276,
 igr2=1505,1506,1505,1506,
 &end
#
#   91 VAL  MGX          92 CYS  HB-         5.50    (#   3139:20  Unique         2.85, 6.45 A)
 &rst
  ixpk= 3139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1505,1506,
 &end
#
#   91 VAL  MGX          93 ILE  HA          5.50    (#   3140:20  Unique         3.53, 5.83 A)
 &rst
  ixpk= 3140, nxpk= 20, iat=  -1,1514, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   92 CYS  HA           93 ILE  HG1-        5.50    (#   3141:20  Unique         3.96, 4.78 A)
 &rst
  ixpk= 3141, nxpk= 20, iat=1503,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#   94 GLY  HN           93 ILE  HG1-        5.50    (#   3142:20  Unique         2.30, 3.80 A)
 &rst
  ixpk= 3142, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#   94 GLY  HN           93 ILE  HG1+        5.50    (#   3143:20  Unique         2.30, 3.80 A)
 &rst
  ixpk= 3143, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#   93 ILE  HN           93 ILE  HG1-        5.50    (#   3144:20  Unique         1.90, 2.78 A)
 &rst
  ixpk= 3144, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1522,1523,
 &end
#
#   93 ILE  HN           93 ILE  QD1         4.50    (#   3145:20  Unique         1.83, 4.14 A)
 &rst
  ixpk= 3145, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1525,1526,1527,
 &end
#
#    0 AMB  20-2:3146    93 ILE  QD1         5.50    (#   3146:20  Single Ambig)
 &rst
  ixpk= 3146, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1501,1538,1485,
 igr2=1525,1526,1527,
 &end
#
#   94 GLY  HN           93 ILE  QD1         5.50    (#   3147:20  Unique         2.27, 4.92 A)
 &rst
  ixpk= 3147, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1525,1526,1527,
 &end
#
#    7 TYR  HE           93 ILE  QD1         5.50    (#   3148:20  Unique         1.99, 4.79 A)
 &rst
  ixpk= 3148, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  93,  98,
 igr2=1525,1526,1527,
 &end
#
#    7 TYR  HD           93 ILE  QD1         5.50    (#   3149:20  Unique         2.64, 5.72 A)
 &rst
  ixpk= 3149, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  91, 100,
 igr2=1525,1526,1527,
 &end
#
#   93 ILE  HA           93 ILE  QD1         5.50    (#   3151:20  Unique         3.76, 4.77 A)
 &rst
  ixpk= 3151, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1525,1526,1527,
 &end
#
#    6 GLY  HA+          93 ILE  QD1         5.50    (#   3152:20  Unique         1.95, 5.04 A)
 &rst
  ixpk= 3152, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  78,  79,
 igr2=1525,1526,1527,
 &end
#
#    0 AMB  20-2:3153    93 ILE  QD1         5.50    (#   3153:20  Single Ambig)
 &rst
  ixpk= 3153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1252,1253,1252,1253,1307,1308,
 igr2=1525,1526,1527,
 &end
#
#   93 ILE  HB           93 ILE  QD1         2.80    (#   3154:20  Unique         2.09, 3.14 A)
 &rst
  ixpk= 3154, nxpk= 20, iat=1516,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1525,1526,1527,
 &end
#
#   84 VAL  MGX          93 ILE  QD1         5.50    (#   3155:20  Unique         5.73, 8.59 A)
 &rst
  ixpk= 3155, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1525,1526,1527,
 &end
#
#   84 VAL  MGX          93 ILE  QG2         4.50    (#   3156:20  Unique         3.41, 6.23 A)
 &rst
  ixpk= 3156, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1365,1366,1367,1369,1370,1371,
 igr2=1518,1519,1520,
 &end
#
#   91 VAL  MGX          93 ILE  QG2         3.50    (#   3157:20  Unique         1.99, 4.88 A)
 &rst
  ixpk= 3157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1518,1519,1520,
 &end
#
#   93 ILE  HG1+         93 ILE  QG2         4.50    (#   3158:20  Unique         1.98, 3.34 A)
 &rst
  ixpk= 3158, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1522,1523,
 igr2=1518,1519,1520,
 &end
#
#   93 ILE  HG1-         93 ILE  QG2         4.50    (#   3159:20  Unique         1.98, 3.34 A)
 &rst
  ixpk= 3159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1522,1523,
 igr2=1518,1519,1520,
 &end
#
#   91 VAL  MGY          93 ILE  QG2         4.50    (#   3160:20  Unique         1.99, 4.88 A)
 &rst
  ixpk= 3160, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1491,1492,1493,1495,1496,1497,
 igr2=1518,1519,1520,
 &end
#
#   78 LYS  HG-          93 ILE  QG2         5.50    (#   3162:20  Unique         4.44, 6.56 A)
 &rst
  ixpk= 3162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1246,1247,
 igr2=1518,1519,1520,
 &end
#
#   93 ILE  HB           93 ILE  QG2         2.80    (#   3163:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3163, nxpk= 20, iat=1516,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1518,1519,1520,
 &end
#
#    0 AMB  20-2:3164    93 ILE  QG2         5.50    (#   3164:20  Single Ambig)
 &rst
  ixpk= 3164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1252,1253,1252,1253,1307,1308,
 igr2=1518,1519,1520,
 &end
#
#   93 ILE  HA           93 ILE  QG2         3.50    (#   3165:20  Unique         2.19, 3.12 A)
 &rst
  ixpk= 3165, nxpk= 20, iat=1514,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1518,1519,1520,
 &end
#
#    0 AMB  20-2:3169    93 ILE  QG2         5.50    (#   3169:20  Single Ambig)
 &rst
  ixpk= 3169, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1531,1418,
 igr2=1518,1519,1520,
 &end
#
#    0 AMB  20-2:3170    93 ILE  QG2         5.50    (#   3170:20  Single Ambig)
 &rst
  ixpk= 3170, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1501,1485,
 igr2=1518,1519,1520,
 &end
#
#   79 LEU  HN           93 ILE  QG2         5.50    (#   3171:20  Unique         5.62, 6.84 A)
 &rst
  ixpk= 3171, nxpk= 20, iat=1261,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1518,1519,1520,
 &end
#
#   93 ILE  HN           93 ILE  QG2         5.50    (#   3172:20  Unique         2.00, 3.30 A)
 &rst
  ixpk= 3172, nxpk= 20, iat=1512,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1518,1519,1520,
 &end
#
#   95 GLN  HN           94 GLY  HA+         4.50    (#   3173:20  Unique         2.19, 2.58 A)
 &rst
  ixpk= 3173, nxpk= 20, iat=1538,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1533,1534,
 &end
#
#   95 GLN  HN           94 GLY  HA-         4.50    (#   3174:20  Unique         2.19, 2.58 A)
 &rst
  ixpk= 3174, nxpk= 20, iat=1538,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1533,1534,
 &end
#
#   94 GLY  HN           94 GLY  HA+         5.50    (#   3175:20  Unique         2.65, 2.80 A)
 &rst
  ixpk= 3175, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#   94 GLY  HN           94 GLY  HA-         5.50    (#   3176:20  Unique         2.65, 2.80 A)
 &rst
  ixpk= 3176, nxpk= 20, iat=1531,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#    7 TYR  HD           94 GLY  HA+         5.50    (#   3177:20  Unique         1.95, 4.73 A)
 &rst
  ixpk= 3177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=1533,1534,
 &end
#
#    7 TYR  HE           94 GLY  HA+         5.50    (#   3178:20  Unique         1.99, 4.72 A)
 &rst
  ixpk= 3178, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=1533,1534,
 &end
#
#    7 TYR  HE           94 GLY  HA-         5.50    (#   3179:20  Unique         1.99, 4.72 A)
 &rst
  ixpk= 3179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  93,  98,
 igr2=1533,1534,
 &end
#
#    7 TYR  HD           94 GLY  HA-         5.50    (#   3180:20  Unique         1.95, 4.73 A)
 &rst
  ixpk= 3180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  91, 100,
 igr2=1533,1534,
 &end
#
#   78 LYS  HA           94 GLY  HA-         5.50    (#   3181:20  Unique         2.84, 3.35 A)
 &rst
  ixpk= 3181, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#   78 LYS  HA           94 GLY  HA+         5.50    (#   3182:20  Unique         2.84, 3.35 A)
 &rst
  ixpk= 3182, nxpk= 20, iat=1241,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#   79 LEU  HG           94 GLY  HA+         5.50    (#   3183:20  Unique         1.94, 3.47 A)
 &rst
  ixpk= 3183, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#   79 LEU  HG           94 GLY  HA-         5.50    (#   3184:20  Unique         1.94, 3.47 A)
 &rst
  ixpk= 3184, nxpk= 20, iat=1268,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1533,1534,
 &end
#
#   79 LEU  MDX          94 GLY  HA-         5.50    (#   3185:20  Unique         1.89, 4.40 A)
 &rst
  ixpk= 3185, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1533,1534,
 &end
#
#   79 LEU  MDY          94 GLY  HA-         5.50    (#   3186:20  Unique         1.89, 4.40 A)
 &rst
  ixpk= 3186, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1533,1534,
 &end
#
#   79 LEU  MDY          94 GLY  HA+         5.50    (#   3187:20  Unique         1.89, 4.40 A)
 &rst
  ixpk= 3187, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1533,1534,
 &end
#
#   79 LEU  MDX          94 GLY  HA+         5.50    (#   3188:20  Unique         1.89, 4.40 A)
 &rst
  ixpk= 3188, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1533,1534,
 &end
#
#    0 AMB  20-2:3189    95 GLN  HA          5.50    (#   3189:20  Single Ambig)
 &rst
  ixpk= 3189, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1=1270,1271,1272,1274,1275,1276,  27,  28,  29,1349,
      1350,1351,1353,1354,1355,1349,1350,1351,1353,1354,
      1355,
 &end
#
#   95 GLN  HB-          95 GLN  HA          5.50    (#   3190:20  Unique         2.33, 2.75 A)
 &rst
  ixpk= 3190, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1542,1543,
 &end
#
#    0 AMB  20-2:3191    95 GLN  HA          5.50    (#   3191:20  Single Ambig)
 &rst
  ixpk= 3191, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 111, 112,1542,1543, 108, 109, 108, 109,
 &end
#
#   95 GLN  HG-          95 GLN  HA          5.50    (#   3192:20  Unique         2.11, 3.05 A)
 &rst
  ixpk= 3192, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1546,
 &end
#
#   95 GLN  HG+          95 GLN  HA          5.50    (#   3193:20  Unique         2.11, 3.05 A)
 &rst
  ixpk= 3193, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1546,
 &end
#
#    7 TYR  HB+          95 GLN  HA          5.50    (#   3194:20  Unique         2.97, 4.24 A)
 &rst
  ixpk= 3194, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#    0 AMB  20-2:3195    95 GLN  HA          5.50    (#   3195:20  Single Ambig)
 &rst
  ixpk= 3195, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1550,1551, 151, 152,
 &end
#
#    0 AMB  20-2:3197    95 GLN  HA          5.50    (#   3197:20  Single Ambig)
 &rst
  ixpk= 3197, nxpk= 20, iat=  -1,1540, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1550,1551, 151, 152,
 &end
#
#   95 GLN  HN           95 GLN  HA          5.50    (#   3198:20  Unique         2.89, 2.91 A)
 &rst
  ixpk= 3198, nxpk= 20, iat=1538,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 LYS  HN           95 GLN  HA          5.50    (#   3199:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 3199, nxpk= 20, iat=1555,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    8 ARG  HN           95 GLN  HA          5.50    (#   3200:20  Unique         1.82, 2.13 A)
 &rst
  ixpk= 3200, nxpk= 20, iat= 104,1540, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 GLN  HA           95 GLN  HB-         5.50    (#   3201:20  Unique         2.33, 2.75 A)
 &rst
  ixpk= 3201, nxpk= 20, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1542,1543,
 &end
#
#   95 GLN  HG+          95 GLN  HB-         5.50    (#   3202:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 3202, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545,1546,
 igr2=1542,1543,
 &end
#
#    0 AMB  20-2:3203     0 AMB  20-1:3203   5.50    (#   3203:20  Double Ambig)
 &rst
  ixpk= 3203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1545,1546,2213,2214,1204,1205,
 igr2=1542,1543,2216,2217,
 &end
#
#   95 GLN  HB-          95 GLN  HG+         5.50    (#   3204:20  Unique         2.21, 2.67 A)
 &rst
  ixpk= 3204, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,
 igr2=1545,1546,
 &end
#
#   95 GLN  HA           95 GLN  HG+         5.50    (#   3205:20  Unique         2.11, 3.05 A)
 &rst
  ixpk= 3205, nxpk= 20, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1545,1546,
 &end
#
#   95 GLN  HA           95 GLN  HG-         5.50    (#   3206:20  Unique         2.11, 3.05 A)
 &rst
  ixpk= 3206, nxpk= 20, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1545,1546,
 &end
#
#    0 AMB  20-2:3207     0 AMB  20-1:3207   5.50    (#   3207:20  Double Ambig)
 &rst
  ixpk= 3207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 151, 152,1550,1551,
 igr2=1545,1546,1545,1546,
 &end
#
#    0 AMB  20-2:3208     0 AMB  20-1:3208   5.50    (#   3208:20  Double Ambig)
 &rst
  ixpk= 3208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 151, 152,1550,1551,
 igr2=1545,1546,1545,1546,
 &end
#
#    0 AMB  20-2:3209     0 AMB  20-1:3209   5.50    (#   3209:20  Double Ambig)
 &rst
  ixpk= 3209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 151, 152, 151, 152,1550,1551,
 igr2=1581,1582,1545,1546,
 &end
#
#   97 GLN  HN           96 LYS  HA          5.50    (#   3210:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 3210, nxpk= 20, iat=1577,1557, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HN           96 LYS  HA          5.50    (#   3211:20  Unique         4.83, 5.19 A)
 &rst
  ixpk= 3211, nxpk= 20, iat=1218,1557, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 LYS  HN           96 LYS  HA          5.50    (#   3212:20  Unique         2.88, 2.93 A)
 &rst
  ixpk= 3212, nxpk= 20, iat=1555,1557, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3213    96 LYS  HA          5.50    (#   3213:20  Single Ambig)
 &rst
  ixpk= 3213, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1538,1151,
 &end
#
#   76 ARG  HA           96 LYS  HA          5.50    (#   3214:20  Unique         3.06, 3.43 A)
 &rst
  ixpk= 3214, nxpk= 20, iat=1196,1557, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HG-          96 LYS  HA          5.50    (#   3215:20  Unique         1.96, 4.44 A)
 &rst
  ixpk= 3215, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1201,1202,
 &end
#
#   96 LYS  HB-          96 LYS  HA          5.50    (#   3216:20  Unique         2.29, 2.71 A)
 &rst
  ixpk= 3216, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1559,1560,
 &end
#
#    0 AMB  20-2:3217    96 LYS  HA          5.50    (#   3217:20  Single Ambig)
 &rst
  ixpk= 3217, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1559,1560,1198,1199,
 &end
#
#    0 AMB  20-2:3218    96 LYS  HA          5.50    (#   3218:20  Single Ambig)
 &rst
  ixpk= 3218, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  87,  88,1568,1569,
 &end
#
#   76 ARG  HD-          96 LYS  HA          5.50    (#   3219:20  Unique         2.47, 5.70 A)
 &rst
  ixpk= 3219, nxpk= 20, iat=  -1,1557, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#   96 LYS  HD-          96 LYS  HB+         5.50    (#   3221:20  Unique         1.97, 3.08 A)
 &rst
  ixpk= 3221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1559,1560,
 &end
#
#   96 LYS  HD-          96 LYS  HB-         5.50    (#   3222:20  Unique         1.97, 3.08 A)
 &rst
  ixpk= 3222, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1559,1560,
 &end
#
#    0 AMB  20-2:3223     0 AMB  20-1:3223   5.50    (#   3223:20  Double Ambig)
 &rst
  ixpk= 3223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1565,1566,1201,1202,
 igr2=1559,1560,1559,1560,
 &end
#
#   76 ARG  HG-          96 LYS  HB-         5.50    (#   3225:20  Unique         2.17, 5.54 A)
 &rst
  ixpk= 3225, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1201,1202,
 igr2=1559,1560,
 &end
#
#    0 AMB  20-2:3226     0 AMB  20-1:3226   5.50    (#   3226:20  Double Ambig)
 &rst
  ixpk= 3226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=  27,  28,  29,1270,1271,1272,1274,1275,1276,
 igr2=1559,1560,1559,1560,
 &end
#
#    0 AMB  20-2:3227    96 LYS  HB-         5.50    (#   3227:20  Single Ambig)
 &rst
  ixpk= 3227, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  87,  88,1568,1569,
 igr2=1559,1560,
 &end
#
#    7 TYR  HB+          96 LYS  HB+         5.50    (#   3229:20  Unique         1.94, 2.79 A)
 &rst
  ixpk= 3229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  87,  88,
 igr2=1559,1560,
 &end
#
#    0 AMB  20-2:3230     0 AMB  20-1:3230   5.50    (#   3230:20  Double Ambig)
 &rst
  ixpk= 3230, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  44,  45,1155,1156,
 igr2=1559,1560,1559,1560,
 &end
#
#    9 PRO  HA           96 LYS  HB+         5.50    (#   3232:20  Unique         2.54, 3.78 A)
 &rst
  ixpk= 3232, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#    9 PRO  HA           96 LYS  HB-         5.50    (#   3233:20  Unique         2.54, 3.78 A)
 &rst
  ixpk= 3233, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#   96 LYS  HA           96 LYS  HB+         5.50    (#   3234:20  Unique         2.29, 2.71 A)
 &rst
  ixpk= 3234, nxpk= 20, iat=1557,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#   97 GLN  HN           96 LYS  HB+         5.50    (#   3235:20  Unique         4.18, 4.38 A)
 &rst
  ixpk= 3235, nxpk= 20, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#   97 GLN  HN           96 LYS  HB-         5.50    (#   3236:20  Unique         4.18, 4.38 A)
 &rst
  ixpk= 3236, nxpk= 20, iat=1577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1559,1560,
 &end
#
#   96 LYS  HD-          96 LYS  HE+         5.50    (#   3237:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 3237, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1568,1569,
 &end
#
#   96 LYS  HD-          96 LYS  HE-         5.50    (#   3238:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 3238, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1568,1569,
 &end
#
#   96 LYS  HG+          96 LYS  HE+         5.50    (#   3239:20  Unique         1.98, 3.20 A)
 &rst
  ixpk= 3239, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1562,1563,
 igr2=1568,1569,
 &end
#
#   96 LYS  HG+          96 LYS  HE-         5.50    (#   3240:20  Unique         1.98, 3.20 A)
 &rst
  ixpk= 3240, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1562,1563,
 igr2=1568,1569,
 &end
#
#   96 LYS  HD+          96 LYS  HE-         5.50    (#   3241:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 3241, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1568,1569,
 &end
#
#   96 LYS  HD+          96 LYS  HE+         5.50    (#   3242:20  Unique         2.22, 2.69 A)
 &rst
  ixpk= 3242, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,
 igr2=1568,1569,
 &end
#
#    0 AMB  20-2:3243     0 AMB  20-1:3243   5.50    (#   3243:20  Double Ambig)
 &rst
  ixpk= 3243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1155,1156,  87,  88,
 igr2=1568,1569,1568,1569,
 &end
#
#   96 LYS  HB-          96 LYS  HE-         5.50    (#   3244:20  Unique         1.99, 3.62 A)
 &rst
  ixpk= 3244, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1559,1560,
 igr2=1568,1569,
 &end
#
#   96 LYS  HB+          96 LYS  HE+         5.50    (#   3245:20  Unique         1.99, 3.62 A)
 &rst
  ixpk= 3245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1559,1560,
 igr2=1568,1569,
 &end
#
#    0 AMB  20-2:3246    96 LYS  HE-         5.50    (#   3246:20  Single Ambig)
 &rst
  ixpk= 3246, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1155,1156,  87,  88,
 igr2=1568,1569,
 &end
#
#    9 PRO  HA           96 LYS  HE-         5.50    (#   3248:20  Unique         1.97, 2.52 A)
 &rst
  ixpk= 3248, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1568,1569,
 &end
#
#    9 PRO  HA           96 LYS  HE+         5.50    (#   3249:20  Unique         1.97, 2.52 A)
 &rst
  ixpk= 3249, nxpk= 20, iat= 138,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1568,1569,
 &end
#
#   11 VAL  MGY          97 GLN  HA          5.50    (#   3250:20  Unique         3.33, 5.57 A)
 &rst
  ixpk= 3250, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB+          97 GLN  HA          5.50    (#   3251:20  Unique         4.02, 4.82 A)
 &rst
  ixpk= 3251, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#    0 AMB  20-2:3252    97 GLN  HA          5.50    (#   3252:20  Single Ambig)
 &rst
  ixpk= 3252, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1581,1582,1568,1569,
 &end
#
#   97 GLN  HB+          97 GLN  HA          5.50    (#   3254:20  Unique         2.23, 2.51 A)
 &rst
  ixpk= 3254, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#   10 ASN  HB+          97 GLN  HA          5.50    (#   3255:20  Unique         3.02, 4.61 A)
 &rst
  ixpk= 3255, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#    0 AMB  20-2:3256    97 GLN  HA          5.50    (#   3256:20  Single Ambig)
 &rst
  ixpk= 3256, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 138, 144,
 &end
#
#   11 VAL  HA           97 GLN  HA          5.50    (#   3257:20  Unique         2.58, 3.08 A)
 &rst
  ixpk= 3257, nxpk= 20, iat= 158,1579, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+         97 GLN  HA          5.50    (#   3258:20  Unique         3.51, 5.31 A)
 &rst
  ixpk= 3258, nxpk= 20, iat=  -1,1579, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   12 GLY  HN           97 GLN  HA          5.50    (#   3260:20  Unique         3.65, 4.17 A)
 &rst
  ixpk= 3260, nxpk= 20, iat= 172,1579, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           97 GLN  HA          4.50    (#   3261:20  Unique         2.18, 2.28 A)
 &rst
  ixpk= 3261, nxpk= 20, iat=1594,1579, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HN           97 GLN  HA          5.50    (#   3262:20  Unique         2.57, 3.02 A)
 &rst
  ixpk= 3262, nxpk= 20, iat= 142,1579, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HN           97 GLN  HA          5.50    (#   3263:20  Unique         2.89, 2.91 A)
 &rst
  ixpk= 3263, nxpk= 20, iat=1577,1579, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HB-          98 LYS  HA          5.50    (#   3269:20  Unique         2.33, 2.62 A)
 &rst
  ixpk= 3269, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#   98 LYS  HG-          98 LYS  HA          5.50    (#   3270:20  Unique         2.22, 3.25 A)
 &rst
  ixpk= 3270, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1601,1602,
 &end
#
#   98 LYS  HG+          98 LYS  HA          5.50    (#   3271:20  Unique         2.22, 3.25 A)
 &rst
  ixpk= 3271, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1601,1602,
 &end
#
#   98 LYS  HD-          98 LYS  HA          5.50    (#   3272:20  Unique         2.38, 4.76 A)
 &rst
  ixpk= 3272, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1604,1605,
 &end
#
#   98 LYS  HB+          98 LYS  HA          5.50    (#   3273:20  Unique         2.33, 2.62 A)
 &rst
  ixpk= 3273, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#   75 LEU  MDY          98 LYS  HA          5.50    (#   3274:20  Unique         3.38, 6.62 A)
 &rst
  ixpk= 3274, nxpk= 20, iat=  -1,1596, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1184,1185,1186,1188,1189,1190,
 &end
#
#   99 TRP  HD1          98 LYS  HA          5.50    (#   3275:20  Unique         2.77, 3.42 A)
 &rst
  ixpk= 3275, nxpk= 20, iat=1624,1596, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HN           98 LYS  HA          4.50    (#   3276:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 3276, nxpk= 20, iat=1616,1596, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   98 LYS  HN           98 LYS  HA          5.50    (#   3277:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 3277, nxpk= 20, iat=1594,1596, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HG-          98 LYS  HB+         5.50    (#   3280:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3280, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1598,1599,
 &end
#
#    0 AMB  20-2:3281    98 LYS  HB-         5.50    (#   3281:20  Single Ambig)
 &rst
  ixpk= 3281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 162, 163, 164, 166, 167, 168,1601,1602,
 igr2=1598,1599,
 &end
#
#   98 LYS  HG-          98 LYS  HB-         5.50    (#   3282:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1598,1599,
 &end
#
#    0 AMB  20-2:3283     0 AMB  20-1:3283   4.50    (#   3283:20  Double Ambig)
 &rst
  ixpk= 3283, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1= 162, 163, 164, 166, 167, 168,1601,1602,
 igr2=1598,1599,1598,1599,
 &end
#
#   98 LYS  HD-          98 LYS  HB+         5.50    (#   3284:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1598,1599,
 &end
#
#   98 LYS  HD-          98 LYS  HB-         5.50    (#   3285:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1598,1599,
 &end
#
#   98 LYS  HD+          98 LYS  HB-         5.50    (#   3286:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1598,1599,
 &end
#
#   98 LYS  HD+          98 LYS  HB+         5.50    (#   3287:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1598,1599,
 &end
#
#    0 AMB  20-2:3289    98 LYS  HB-         5.50    (#   3289:20  Single Ambig)
 &rst
  ixpk= 3289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 700, 701, 702, 755, 756,
 igr2=1598,1599,
 &end
#
#   98 LYS  HE+          98 LYS  HB+         5.50    (#   3291:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1598,1599,
 &end
#
#   98 LYS  HE+          98 LYS  HB-         5.50    (#   3292:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1598,1599,
 &end
#
#   98 LYS  HE-          98 LYS  HB-         5.50    (#   3293:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3293, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1598,1599,
 &end
#
#   98 LYS  HA           98 LYS  HB-         5.50    (#   3294:20  Unique         2.33, 2.62 A)
 &rst
  ixpk= 3294, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   98 LYS  HA           98 LYS  HB+         5.50    (#   3295:20  Unique         2.33, 2.62 A)
 &rst
  ixpk= 3295, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   11 VAL  HA           98 LYS  HB+         5.50    (#   3297:20  Unique         3.13, 4.71 A)
 &rst
  ixpk= 3297, nxpk= 20, iat= 158,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   97 GLN  HA           98 LYS  HB+         5.50    (#   3298:20  Unique         4.02, 4.82 A)
 &rst
  ixpk= 3298, nxpk= 20, iat=1579,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   97 GLN  HA           98 LYS  HB-         5.50    (#   3299:20  Unique         4.02, 4.82 A)
 &rst
  ixpk= 3299, nxpk= 20, iat=1579,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   74 TRP  HH2          98 LYS  HB-         5.50    (#   3300:20  Unique         3.24, 4.54 A)
 &rst
  ixpk= 3300, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   99 TRP  HN           98 LYS  HB+         5.50    (#   3301:20  Unique         3.05, 4.14 A)
 &rst
  ixpk= 3301, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   99 TRP  HN           98 LYS  HB-         5.50    (#   3302:20  Unique         3.05, 4.14 A)
 &rst
  ixpk= 3302, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   98 LYS  HN           98 LYS  HB+         5.50    (#   3303:20  Unique         2.32, 3.01 A)
 &rst
  ixpk= 3303, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   98 LYS  HN           98 LYS  HB-         5.50    (#   3304:20  Unique         2.32, 3.01 A)
 &rst
  ixpk= 3304, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1598,1599,
 &end
#
#   98 LYS  HB-          98 LYS  HG+         5.50    (#   3305:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3305, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1601,1602,
 &end
#
#   98 LYS  HB-          98 LYS  HG-         5.50    (#   3306:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1601,1602,
 &end
#
#   98 LYS  HD-          98 LYS  HG+         5.50    (#   3307:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1601,1602,
 &end
#
#   98 LYS  HD-          98 LYS  HG-         4.50    (#   3308:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1604,1605,
 igr2=1601,1602,
 &end
#
#   98 LYS  HD+          98 LYS  HG-         5.50    (#   3309:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1601,1602,
 &end
#
#   98 LYS  HD+          98 LYS  HG+         4.50    (#   3310:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1604,1605,
 igr2=1601,1602,
 &end
#
#   98 LYS  HB+          98 LYS  HG+         5.50    (#   3311:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3311, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1601,1602,
 &end
#
#   98 LYS  HB+          98 LYS  HG-         5.50    (#   3312:20  Unique         2.26, 2.72 A)
 &rst
  ixpk= 3312, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1601,1602,
 &end
#
#    0 AMB  20-2:3313     0 AMB  20-1:3313   5.50    (#   3313:20  Double Ambig)
 &rst
  ixpk= 3313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 700, 701, 702, 755, 756,
 igr2=1601,1602,1601,1602,
 &end
#
#    0 AMB  20-2:3314    98 LYS  HG-         5.50    (#   3314:20  Single Ambig)
 &rst
  ixpk= 3314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 700, 701, 702, 755, 756,
 igr2=1601,1602,
 &end
#
#   98 LYS  HE-          98 LYS  HG+         5.50    (#   3315:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1601,1602,
 &end
#
#   98 LYS  HE-          98 LYS  HG-         5.50    (#   3316:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1601,1602,
 &end
#
#   98 LYS  HE+          98 LYS  HG+         5.50    (#   3317:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3317, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1601,1602,
 &end
#
#   98 LYS  HE+          98 LYS  HG-         5.50    (#   3318:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3318, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1601,1602,
 &end
#
#   98 LYS  HA           98 LYS  HG+         5.50    (#   3319:20  Unique         2.22, 3.25 A)
 &rst
  ixpk= 3319, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   98 LYS  HA           98 LYS  HG-         5.50    (#   3320:20  Unique         2.22, 3.25 A)
 &rst
  ixpk= 3320, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#    0 AMB  20-2:3321     0 AMB  20-1:3321   5.50    (#   3321:20  Double Ambig)
 &rst
  ixpk= 3321, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1153,1103,
 igr2=1601,1602,1601,1602,
 &end
#
#    0 AMB  20-2:3322    98 LYS  HG-         5.50    (#   3322:20  Single Ambig)
 &rst
  ixpk= 3322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1153,1103,
 igr2=1601,1602,
 &end
#
#   74 TRP  HH2          98 LYS  HG+         5.50    (#   3323:20  Unique         2.85, 4.92 A)
 &rst
  ixpk= 3323, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   74 TRP  HH2          98 LYS  HG-         5.50    (#   3324:20  Unique         2.85, 4.92 A)
 &rst
  ixpk= 3324, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   99 TRP  HN           98 LYS  HG+         5.50    (#   3325:20  Unique         3.00, 4.35 A)
 &rst
  ixpk= 3325, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   99 TRP  HN           98 LYS  HG-         5.50    (#   3326:20  Unique         3.00, 4.35 A)
 &rst
  ixpk= 3326, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   98 LYS  HN           98 LYS  HG-         5.50    (#   3327:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 3327, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   98 LYS  HN           98 LYS  HG+         5.50    (#   3328:20  Unique         2.05, 3.56 A)
 &rst
  ixpk= 3328, nxpk= 20, iat=1594,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   71 THR  HN           98 LYS  HG+         5.50    (#   3329:20  Unique         3.12, 5.33 A)
 &rst
  ixpk= 3329, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   71 THR  HN           98 LYS  HG-         5.50    (#   3330:20  Unique         3.12, 5.33 A)
 &rst
  ixpk= 3330, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1601,1602,
 &end
#
#   74 TRP  HH2          98 LYS  HD+         5.50    (#   3331:20  Unique         2.86, 4.33 A)
 &rst
  ixpk= 3331, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1604,1605,
 &end
#
#   74 TRP  HH2          98 LYS  HD-         5.50    (#   3332:20  Unique         2.86, 4.33 A)
 &rst
  ixpk= 3332, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1604,1605,
 &end
#
#   98 LYS  HA           98 LYS  HD+         5.50    (#   3337:20  Unique         2.38, 4.76 A)
 &rst
  ixpk= 3337, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1604,1605,
 &end
#
#   98 LYS  HA           98 LYS  HD-         5.50    (#   3338:20  Unique         2.38, 4.76 A)
 &rst
  ixpk= 3338, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1604,1605,
 &end
#
#    0 AMB  20-2:3339     0 AMB  20-1:3339   5.50    (#   3339:20  Double Ambig)
 &rst
  ixpk= 3339, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1542,1543,1607,1608,
 igr2=1201,1202,1604,1605,
 &end
#
#   98 LYS  HE+          98 LYS  HD-         5.50    (#   3340:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1604,1605,
 &end
#
#   98 LYS  HE-          98 LYS  HD-         5.50    (#   3341:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1604,1605,
 &end
#
#   98 LYS  HE-          98 LYS  HD+         5.50    (#   3342:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608,
 igr2=1604,1605,
 &end
#
#    0 AMB  20-2:3343     0 AMB  20-1:3343   4.50    (#   3343:20  Double Ambig)
 &rst
  ixpk= 3343, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 700, 701, 702,1542,1543,
 igr2=1604,1605,1201,1202,
 &end
#
#   46 ALA  MB           98 LYS  HD-         4.50    (#   3344:20  Unique         1.97, 3.47 A)
 &rst
  ixpk= 3344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 700, 701, 702,
 igr2=1604,1605,
 &end
#
#   98 LYS  HB+          98 LYS  HD+         5.50    (#   3345:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1604,1605,
 &end
#
#   98 LYS  HB+          98 LYS  HD-         5.50    (#   3346:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1604,1605,
 &end
#
#   98 LYS  HG-          98 LYS  HD+         5.50    (#   3347:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1604,1605,
 &end
#
#    0 AMB  20-2:3348     0 AMB  20-1:3348   4.50    (#   3348:20  Double Ambig)
 &rst
  ixpk= 3348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1=1601,1602, 162, 163, 164, 166, 167, 168,
 igr2=1604,1605,1604,1605,
 &end
#
#   98 LYS  HG-          98 LYS  HD-         4.50    (#   3349:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3349, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1601,1602,
 igr2=1604,1605,
 &end
#
#    0 AMB  20-2:3350    98 LYS  HD-         4.50    (#   3350:20  Single Ambig)
 &rst
  ixpk= 3350, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1601,1602, 162, 163, 164, 166, 167, 168,
 igr2=1604,1605,
 &end
#
#   98 LYS  HB-          98 LYS  HD+         5.50    (#   3351:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1604,1605,
 &end
#
#   98 LYS  HB-          98 LYS  HD-         5.50    (#   3352:20  Unique         2.13, 3.13 A)
 &rst
  ixpk= 3352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1604,1605,
 &end
#
#   98 LYS  HB-          98 LYS  HE-         5.50    (#   3353:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1607,1608,
 &end
#
#   98 LYS  HB-          98 LYS  HE+         5.50    (#   3354:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3354, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1607,1608,
 &end
#
#   98 LYS  HG+          98 LYS  HE+         5.50    (#   3355:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1607,1608,
 &end
#
#   98 LYS  HG-          98 LYS  HE+         5.50    (#   3356:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1607,1608,
 &end
#
#   98 LYS  HG-          98 LYS  HE-         5.50    (#   3357:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1607,1608,
 &end
#
#   98 LYS  HG+          98 LYS  HE-         5.50    (#   3358:20  Unique         1.99, 3.20 A)
 &rst
  ixpk= 3358, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1601,1602,
 igr2=1607,1608,
 &end
#
#   98 LYS  HD-          98 LYS  HE+         5.50    (#   3359:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1607,1608,
 &end
#
#   98 LYS  HD+          98 LYS  HE+         5.50    (#   3360:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1607,1608,
 &end
#
#   98 LYS  HD+          98 LYS  HE-         5.50    (#   3361:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3361, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1607,1608,
 &end
#
#   98 LYS  HD-          98 LYS  HE-         5.50    (#   3362:20  Unique         2.22, 2.70 A)
 &rst
  ixpk= 3362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605,
 igr2=1607,1608,
 &end
#
#   98 LYS  HB+          98 LYS  HE+         5.50    (#   3363:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1607,1608,
 &end
#
#   98 LYS  HB+          98 LYS  HE-         5.50    (#   3364:20  Unique         1.99, 3.46 A)
 &rst
  ixpk= 3364, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1598,1599,
 igr2=1607,1608,
 &end
#
#   46 ALA  MB           98 LYS  HE+         5.50    (#   3365:20  Unique         2.24, 4.34 A)
 &rst
  ixpk= 3365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 700, 701, 702,
 igr2=1607,1608,
 &end
#
#   46 ALA  MB           98 LYS  HE-         5.50    (#   3366:20  Unique         2.24, 4.34 A)
 &rst
  ixpk= 3366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 700, 701, 702,
 igr2=1607,1608,
 &end
#
#   70 SER  HB-          98 LYS  HE+         5.50    (#   3368:20  Unique         3.65, 6.34 A)
 &rst
  ixpk= 3368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1092,1093,
 igr2=1607,1608,
 &end
#
#   70 SER  HB+          98 LYS  HE+         5.50    (#   3369:20  Unique         3.65, 6.34 A)
 &rst
  ixpk= 3369, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1092,1093,
 igr2=1607,1608,
 &end
#
#   70 SER  HB+          98 LYS  HE-         5.50    (#   3370:20  Unique         3.65, 6.34 A)
 &rst
  ixpk= 3370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1092,1093,
 igr2=1607,1608,
 &end
#
#   98 LYS  HA           98 LYS  HE+         5.50    (#   3371:20  Unique         2.99, 4.76 A)
 &rst
  ixpk= 3371, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1607,1608,
 &end
#
#   98 LYS  HA           98 LYS  HE-         5.50    (#   3372:20  Unique         2.99, 4.76 A)
 &rst
  ixpk= 3372, nxpk= 20, iat=1596,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1607,1608,
 &end
#
#   74 TRP  HH2          98 LYS  HE-         5.50    (#   3374:20  Unique         3.40, 5.01 A)
 &rst
  ixpk= 3374, nxpk= 20, iat=1166,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1607,1608,
 &end
#
#   74 TRP  HE1          98 LYS  HE-         5.50    (#   3377:20  Unique         2.69, 4.23 A)
 &rst
  ixpk= 3377, nxpk= 20, iat=1161,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1607,1608,
 &end
#
#  100 PHE  HN           99 TRP  HA          4.50    (#   3378:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 3378, nxpk= 20, iat=1640,1618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 GLY  HN           99 TRP  HA          5.50    (#   3379:20  Unique         2.97, 3.30 A)
 &rst
  ixpk= 3379, nxpk= 20, iat= 172,1618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HE3          99 TRP  HA          5.50    (#   3381:20  Unique         3.28, 3.68 A)
 &rst
  ixpk= 3381, nxpk= 20, iat=1635,1618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HD1          99 TRP  HA          5.50    (#   3382:20  Unique         3.15, 3.84 A)
 &rst
  ixpk= 3382, nxpk= 20, iat=1624,1618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HA           99 TRP  HA          5.50    (#   3383:20  Unique         4.84, 5.16 A)
 &rst
  ixpk= 3383, nxpk= 20, iat= 158,1618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HB-          99 TRP  HA          5.50    (#   3384:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 3384, nxpk= 20, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#   99 TRP  HB+          99 TRP  HA          5.50    (#   3385:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 3385, nxpk= 20, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#    0 AMB  20-2:3386    99 TRP  HA          5.50    (#   3386:20  Single Ambig)
 &rst
  ixpk= 3386, nxpk= 20, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1644,1645,1644,1645,
 &end
#
#   11 VAL  HB           99 TRP  HA          5.50    (#   3387:20  Unique         5.34, 5.56 A)
 &rst
  ixpk= 3387, nxpk= 20, iat= 160,1618, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3388    99 TRP  HA          5.50    (#   3388:20  Single Ambig)
 &rst
  ixpk= 3388, nxpk= 20, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1604,1605, 185, 186, 187, 227, 228, 229,
 &end
#
#    0 AMB  20-2:3389    99 TRP  HA          5.50    (#   3389:20  Single Ambig)
 &rst
  ixpk= 3389, nxpk= 20, iat=  -1,1618, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 162, 163, 164, 166, 167, 168,1601,1602, 192, 193,
       194,
 &end
#
#  147 VAL  MGX          99 TRP  HB+         5.50    (#   3390:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 3390, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1620,1621,
 &end
#
#  147 VAL  MGX          99 TRP  HB-         5.50    (#   3391:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 3391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=1620,1621,
 &end
#
#   71 THR  MG2          99 TRP  HB+         5.50    (#   3392:20  Unique         1.99, 4.24 A)
 &rst
  ixpk= 3392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=1620,1621,
 &end
#
#   71 THR  MG2          99 TRP  HB-         5.50    (#   3393:20  Unique         1.99, 4.24 A)
 &rst
  ixpk= 3393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=1620,1621,
 &end
#
#   99 TRP  HA           99 TRP  HB+         5.50    (#   3394:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 3394, nxpk= 20, iat=1618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HA           99 TRP  HB-         5.50    (#   3395:20  Unique         2.40, 2.75 A)
 &rst
  ixpk= 3395, nxpk= 20, iat=1618,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HD1          99 TRP  HB+         5.50    (#   3396:20  Unique         2.70, 3.35 A)
 &rst
  ixpk= 3396, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HD1          99 TRP  HB-         5.50    (#   3397:20  Unique         2.70, 3.35 A)
 &rst
  ixpk= 3397, nxpk= 20, iat=1624,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HE3          99 TRP  HB+         5.50    (#   3398:20  Unique         2.40, 3.21 A)
 &rst
  ixpk= 3398, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HE3          99 TRP  HB-         5.50    (#   3399:20  Unique         2.40, 3.21 A)
 &rst
  ixpk= 3399, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HN           99 TRP  HB+         5.50    (#   3400:20  Unique         2.25, 3.05 A)
 &rst
  ixpk= 3400, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   99 TRP  HN           99 TRP  HB-         5.50    (#   3401:20  Unique         2.25, 3.05 A)
 &rst
  ixpk= 3401, nxpk= 20, iat=1616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#   71 THR  HN           99 TRP  HB-         5.50    (#   3402:20  Unique         3.60, 5.04 A)
 &rst
  ixpk= 3402, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1620,1621,
 &end
#
#  100 PHE  HN            0 AMB  20-1:3403   5.50    (#   3403:20  Single Ambig)
 &rst
  ixpk= 3403, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1644,1645,1644,1645,
 &end
#
#  101 LEU  HN            0 AMB  20-1:3404   5.50    (#   3404:20  Single Ambig)
 &rst
  ixpk= 3404, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1644,1645,1644,1645,
 &end
#
#    0 AMB  20-2:3405     0 AMB  20-1:3405   5.50    (#   3405:20  Double Ambig)
 &rst
  ixpk= 3405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 773, 782,1029,
 igr2=1644,1645,1644,1645,1644,1645,
 &end
#
#   99 TRP  HA            0 AMB  20-1:3406   5.50    (#   3406:20  Single Ambig)
 &rst
  ixpk= 3406, nxpk= 20, iat=1618,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1644,1645,1644,1645,
 &end
#
#    0 AMB  20-2:3408     0 AMB  20-1:3408   5.50    (#   3408:20  Double Ambig)
 &rst
  ixpk= 3408, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 755, 756, 755, 756,
 igr2=1644,1645,1644,1645,
 &end
#
#  102 LEU  MDX           0 AMB  20-1:3409   5.50    (#   3409:20  Single Ambig)
 &rst
  ixpk= 3409, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1688,1689,1690,1692,1693,1694,
 igr2=1644,1645,1644,1645,
 &end
#
#    0 AMB  20-2:3410     0 AMB  20-1:3410   5.50    (#   3410:20  Double Ambig)
 &rst
  ixpk= 3410, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 759, 760, 761,1601,1602,
 igr2=1644,1645,1644,1645,
 &end
#
#  101 LEU  MDX         101 LEU  HA          5.50    (#   3411:20  Unique         1.99, 3.58 A)
 &rst
  ixpk= 3411, nxpk= 20, iat=  -1,1662, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  MDY         101 LEU  HB+         5.50    (#   3412:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1664,1665,
 &end
#
#  101 LEU  MDX         101 LEU  HB+         5.50    (#   3413:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1664,1665,
 &end
#
#  101 LEU  MDY         101 LEU  HB-         5.50    (#   3414:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3414, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1664,1665,
 &end
#
#  101 LEU  MDX         101 LEU  HB-         5.50    (#   3415:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3415, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=1664,1665,
 &end
#
#   69 ALA  MB          101 LEU  HB+         5.50    (#   3416:20  Unique         1.98, 3.06 A)
 &rst
  ixpk= 3416, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1082,1083,1084,
 igr2=1664,1665,
 &end
#
#   69 ALA  MB          101 LEU  HB-         5.50    (#   3417:20  Unique         1.98, 3.06 A)
 &rst
  ixpk= 3417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1082,1083,1084,
 igr2=1664,1665,
 &end
#
#  101 LEU  HA          101 LEU  HB+         5.50    (#   3418:20  Unique         2.38, 2.77 A)
 &rst
  ixpk= 3418, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#  101 LEU  HA          101 LEU  HB-         5.50    (#   3419:20  Unique         2.38, 2.77 A)
 &rst
  ixpk= 3419, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#  103 GLN  HE2-        101 LEU  HB+         5.50    (#   3421:20  Unique         4.19, 6.12 A)
 &rst
  ixpk= 3421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1710,1711,
 igr2=1664,1665,
 &end
#
#   69 ALA  HN          101 LEU  HB+         5.50    (#   3422:20  Unique         1.94, 3.40 A)
 &rst
  ixpk= 3422, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#   69 ALA  HN          101 LEU  HB-         5.50    (#   3423:20  Unique         1.94, 3.40 A)
 &rst
  ixpk= 3423, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#  101 LEU  HN          101 LEU  HB+         5.50    (#   3424:20  Unique         2.20, 2.58 A)
 &rst
  ixpk= 3424, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#  101 LEU  HN          101 LEU  HB-         5.50    (#   3425:20  Unique         2.20, 2.58 A)
 &rst
  ixpk= 3425, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1664,1665,
 &end
#
#    0 AMB  20-2:3426   101 LEU  HG          5.50    (#   3426:20  Single Ambig)
 &rst
  ixpk= 3426, nxpk= 20, iat=  -1,1667, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 204, 205, 206, 208, 209, 210,1669,1670,1671,1673,
      1674,1675,
 &end
#
#    0 AMB  20-2:3427     0 AMB  20-1:3427   5.50    (#   3427:20  Double Ambig)
 &rst
  ixpk= 3427, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 224, 225,1066,
 igr2=1724,1725,1726,1728,1729,1730,1667,
 &end
#
#  102 LEU  HN          101 LEU  MDX         4.50    (#   3428:20  Unique         1.94, 4.57 A)
 &rst
  ixpk= 3428, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3429     0 AMB  20-1:3429   5.50    (#   3429:20  Double Ambig)
 &rst
  ixpk= 3429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2363,1660,
 igr2=2232,2233,2234,2236,2237,2238,1669,1670,1671,1673,
      1674,1675,
 &end
#
#  101 LEU  HA          101 LEU  MDX         4.50    (#   3430:20  Unique         1.99, 3.58 A)
 &rst
  ixpk= 3430, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3431     0 AMB  20-1:3431   5.50    (#   3431:20  Double Ambig)
 &rst
  ixpk= 3431, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2506,2507,2367,2368,
 igr2=1669,1670,1671,1673,1674,1675,2232,2233,2234,2236,
      2237,2238,
 &end
#
#    0 AMB  20-2:3432     0 AMB  20-1:3432   5.50    (#   3432:20  Double Ambig)
 &rst
  ixpk= 3432, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 555, 556, 237, 238,
 igr2=2232,2233,2234,2236,2237,2238,1669,1670,1671,1673,
      1674,1675,
 &end
#
#    0 AMB  20-2:3433   136 VAL  MGY         4.50    (#   3433:20  Single Ambig)
 &rst
  ixpk= 3433, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2318,2319,2315,2316,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:3434   101 LEU  MDX         2.80    (#   3434:20  Single Ambig)
 &rst
  ixpk= 3434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=1664,1665,2565,2566,2567,2569,2570,2571,2549,2550,
      2551,2553,2554,2555,1667,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  HB-         101 LEU  MDX         5.50    (#   3436:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1664,1665,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  102 LEU  HN          101 LEU  MDY         5.50    (#   3437:20  Unique         1.94, 4.57 A)
 &rst
  ixpk= 3437, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#   68 LEU  HN          101 LEU  MDY         5.50    (#   3438:20  Unique         3.22, 5.84 A)
 &rst
  ixpk= 3438, nxpk= 20, iat=1059,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  HN          101 LEU  MDY         5.50    (#   3439:20  Unique         3.76, 5.13 A)
 &rst
  ixpk= 3439, nxpk= 20, iat=1660,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3440   101 LEU  MDY         5.50    (#   3440:20  Single Ambig)
 &rst
  ixpk= 3440, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2575,1088,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#   69 ALA  HN          101 LEU  MDY         5.50    (#   3441:20  Unique         2.75, 5.28 A)
 &rst
  ixpk= 3441, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  155 VAL  HN          101 LEU  MDY         5.50    (#   3442:20  Unique         2.66, 5.38 A)
 &rst
  ixpk= 3442, nxpk= 20, iat=2559,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3443   101 LEU  MDY         5.50    (#   3443:20  Single Ambig)
 &rst
  ixpk= 3443, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2543,2603,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  103 GLN  HE2-        101 LEU  MDY         5.50    (#   3444:20  Unique         1.93, 4.36 A)
 &rst
  ixpk= 3444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  HA          101 LEU  MDY         5.50    (#   3445:20  Unique         1.99, 3.58 A)
 &rst
  ixpk= 3445, nxpk= 20, iat=1662,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  151 PHE  HA          101 LEU  MDY         5.50    (#   3446:20  Unique         4.09, 6.31 A)
 &rst
  ixpk= 3446, nxpk= 20, iat=2504,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#   68 LEU  HA          101 LEU  MDY         5.50    (#   3447:20  Unique         4.49, 7.52 A)
 &rst
  ixpk= 3447, nxpk= 20, iat=1061,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  151 PHE  HB+         101 LEU  MDY         5.50    (#   3448:20  Unique         1.99, 4.13 A)
 &rst
  ixpk= 3448, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2506,2507,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  151 PHE  HB-         101 LEU  MDY         5.50    (#   3449:20  Unique         1.99, 4.13 A)
 &rst
  ixpk= 3449, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2506,2507,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3450   101 LEU  MDY         5.50    (#   3450:20  Single Ambig)
 &rst
  ixpk= 3450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2547, 202,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3451   101 LEU  MDY         5.50    (#   3451:20  Single Ambig)
 &rst
  ixpk= 3451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2491,2492,1020,1021, 265, 266,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  155 VAL  HB          101 LEU  MDY         5.50    (#   3452:20  Unique         1.97, 4.86 A)
 &rst
  ixpk= 3452, nxpk= 20, iat=2563,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3453   101 LEU  MDY         5.50    (#   3453:20  Single Ambig)
 &rst
  ixpk= 3453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1686,1023,1024,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3454   101 LEU  MDY         4.50    (#   3454:20  Single Ambig)
 &rst
  ixpk= 3454, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1082,1083,1084,1063,1064,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3455   101 LEU  MDY         3.50    (#   3455:20  Single Ambig)
 &rst
  ixpk= 3455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.77, r4= 8.27,
 igr1=1664,1665,2565,2566,2567,2569,2570,2571,2549,2550,
      2551,2553,2554,2555,1068,1069,1070,1072,1073,1074,
      
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3456   101 LEU  MDY         3.50    (#   3456:20  Single Ambig)
 &rst
  ixpk= 3456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.23, r4= 7.73,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,1667,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  154 VAL  MGY         101 LEU  MDY         3.50    (#   3457:20  Unique         2.00, 5.81 A)
 &rst
  ixpk= 3457, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2549,2550,2551,2553,2554,2555,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#  101 LEU  HB-         101 LEU  MDY         5.50    (#   3459:20  Unique         1.99, 3.37 A)
 &rst
  ixpk= 3459, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1664,1665,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#   68 LEU  HB-         101 LEU  MDX         4.50    (#   3460:20  Unique         2.17, 5.33 A)
 &rst
  ixpk= 3460, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1063,1064,
 igr2=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  20-2:3461     0 AMB  20-1:3461   4.50    (#   3461:20  Double Ambig)
 &rst
  ixpk= 3461, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.42, r4= 9.92,
 igr1=1082,1083,1084,1063,1064, 514, 515,
 igr2=1669,1670,1671,1673,1674,1675,2232,2233,2234,2236,
      2237,2238,
 &end
#
#    0 AMB  20-2:3462   136 VAL  MGY         4.50    (#   3462:20  Single Ambig)
 &rst
  ixpk= 3462, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2293,2294,2318,2319,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:3463   102 LEU  HA          4.50    (#   3463:20  Single Ambig)
 &rst
  ixpk= 3463, nxpk= 20, iat=  -1,1681, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1688,1689,1690,1692,1693,1694,1068,1069,1070,1072,
      1073,1074,
 &end
#
#   68 LEU  MDX         102 LEU  HA          5.50    (#   3464:20  Unique         2.09, 6.92 A)
 &rst
  ixpk= 3464, nxpk= 20, iat=  -1,1681, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#  102 LEU  HB-         102 LEU  HA          5.50    (#   3465:20  Unique         2.31, 2.77 A)
 &rst
  ixpk= 3465, nxpk= 20, iat=  -1,1681, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#  102 LEU  HG          102 LEU  HA          5.50    (#   3466:20  Unique         2.60, 3.15 A)
 &rst
  ixpk= 3466, nxpk= 20, iat=1686,1681, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HB+         102 LEU  HA          5.50    (#   3467:20  Unique         2.31, 2.77 A)
 &rst
  ixpk= 3467, nxpk= 20, iat=  -1,1681, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#   65 VAL  HB          102 LEU  HA          5.50    (#   3468:20  Unique         3.77, 4.37 A)
 &rst
  ixpk= 3468, nxpk= 20, iat=1004,1681, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HA          102 LEU  HA          5.50    (#   3469:20  Unique         2.48, 2.75 A)
 &rst
  ixpk= 3469, nxpk= 20, iat=1042,1681, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HN          102 LEU  HA          4.50    (#   3470:20  Unique         2.16, 2.21 A)
 &rst
  ixpk= 3470, nxpk= 20, iat=1698,1681, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 LEU  HN          102 LEU  HA          5.50    (#   3471:20  Unique         2.63, 3.04 A)
 &rst
  ixpk= 3471, nxpk= 20, iat=1059,1681, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HN          102 LEU  HA          5.50    (#   3472:20  Unique         2.89, 2.92 A)
 &rst
  ixpk= 3472, nxpk= 20, iat=1679,1681, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HN          102 LEU  HB+         5.50    (#   3473:20  Unique         2.12, 2.98 A)
 &rst
  ixpk= 3473, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  102 LEU  HN          102 LEU  HB-         5.50    (#   3474:20  Unique         2.12, 2.98 A)
 &rst
  ixpk= 3474, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  103 GLN  HN          102 LEU  HB+         5.50    (#   3475:20  Unique         2.58, 3.62 A)
 &rst
  ixpk= 3475, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  103 GLN  HN          102 LEU  HB-         5.50    (#   3476:20  Unique         2.58, 3.62 A)
 &rst
  ixpk= 3476, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   66 ARG  HN          102 LEU  HB-         5.50    (#   3477:20  Unique         2.44, 3.86 A)
 &rst
  ixpk= 3477, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   65 VAL  HA          102 LEU  HB-         5.50    (#   3478:20  Unique         3.95, 5.18 A)
 &rst
  ixpk= 3478, nxpk= 20, iat=1002,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  102 LEU  HA          102 LEU  HB-         5.50    (#   3479:20  Unique         2.31, 2.77 A)
 &rst
  ixpk= 3479, nxpk= 20, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  102 LEU  HA          102 LEU  HB+         5.50    (#   3480:20  Unique         2.31, 2.77 A)
 &rst
  ixpk= 3480, nxpk= 20, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   15 ILE  HA          102 LEU  HB-         5.50    (#   3481:20  Unique         2.36, 3.36 A)
 &rst
  ixpk= 3481, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   15 ILE  HA          102 LEU  HB+         5.50    (#   3482:20  Unique         2.36, 3.36 A)
 &rst
  ixpk= 3482, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   65 VAL  HB          102 LEU  HB+         5.50    (#   3484:20  Unique         1.97, 3.34 A)
 &rst
  ixpk= 3484, nxpk= 20, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   65 VAL  HB          102 LEU  HB-         5.50    (#   3485:20  Unique         1.97, 3.34 A)
 &rst
  ixpk= 3485, nxpk= 20, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  102 LEU  HG          102 LEU  HB+         5.50    (#   3486:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 3486, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#  102 LEU  HG          102 LEU  HB-         5.50    (#   3487:20  Unique         2.35, 2.66 A)
 &rst
  ixpk= 3487, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1683,1684,
 &end
#
#   65 VAL  MGY         102 LEU  HB-         4.50    (#   3492:20  Unique         3.05, 5.02 A)
 &rst
  ixpk= 3492, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1006,1007,1008,1010,1011,1012,
 igr2=1683,1684,
 &end
#
#    0 AMB  20-2:3493   102 LEU  HB-         4.50    (#   3493:20  Single Ambig)
 &rst
  ixpk= 3493, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 227, 228, 229,1688,1689,1690,1692,1693,1694,
 igr2=1683,1684,
 &end
#
#    0 AMB  20-2:3494     0 AMB  20-1:3494   4.50    (#   3494:20  Double Ambig)
 &rst
  ixpk= 3494, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1006,1007,1008,1010,1011,1012,1006,1007,1008,1010,
      1011,1012,
 igr2=1683,1684,1683,1684,
 &end
#
#    0 AMB  20-2:3495     0 AMB  20-1:3495   4.50    (#   3495:20  Double Ambig)
 &rst
  ixpk= 3495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 227, 228, 229,1688,1689,1690,1692,1693,1694,
 igr2=1683,1684,1683,1684,
 &end
#
#   40 ILE  HN           40 ILE  HG1-        5.50    (#   3496:20  Unique         1.94, 2.92 A)
 &rst
  ixpk= 3496, nxpk= 20, iat= 616,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 626, 627,
 &end
#
#   80 PRO  HD-          79 LEU  MDX         5.50    (#   3497:20  Unique         2.43, 5.32 A)
 &rst
  ixpk= 3497, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1281,1282,
 igr2=1270,1271,1272,1274,1275,1276,
 &end
#
#  102 LEU  HN          102 LEU  MDY         5.50    (#   3498:20  Unique         2.23, 4.55 A)
 &rst
  ixpk= 3498, nxpk= 20, iat=1679,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  103 GLN  HN          102 LEU  MDY         5.50    (#   3499:20  Unique         2.22, 5.00 A)
 &rst
  ixpk= 3499, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   66 ARG  HN          102 LEU  MDY         5.50    (#   3500:20  Unique         1.85, 4.52 A)
 &rst
  ixpk= 3500, nxpk= 20, iat=1016,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   69 ALA  HN          102 LEU  MDY         5.50    (#   3501:20  Unique         3.77, 6.71 A)
 &rst
  ixpk= 3501, nxpk= 20, iat=1078,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   65 VAL  HN          102 LEU  MDY         5.50    (#   3502:20  Unique         5.15, 7.03 A)
 &rst
  ixpk= 3502, nxpk= 20, iat=1000,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   51 TYR  HD          102 LEU  MDY         5.50    (#   3503:20  Unique         2.79, 6.23 A)
 &rst
  ixpk= 3503, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 773, 782,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  102 LEU  HA          102 LEU  MDY         5.50    (#   3504:20  Unique         1.90, 3.66 A)
 &rst
  ixpk= 3504, nxpk= 20, iat=1681,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:3505   102 LEU  MDY         5.50    (#   3505:20  Single Ambig)
 &rst
  ixpk= 3505, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1644,1645,1644,1645,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#   65 VAL  HB          102 LEU  MDY         5.50    (#   3506:20  Unique         1.95, 3.83 A)
 &rst
  ixpk= 3506, nxpk= 20, iat=1004,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:3507   102 LEU  MDY         5.50    (#   3507:20  Single Ambig)
 &rst
  ixpk= 3507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1044, 218,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:3508   102 LEU  MDY         3.50    (#   3508:20  Single Ambig)
 &rst
  ixpk= 3508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1683,1684, 224, 225,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  102 LEU  HG          102 LEU  MDY         2.80    (#   3509:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3509, nxpk= 20, iat=1686,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#  102 LEU  HB-         102 LEU  MDY         4.50    (#   3510:20  Unique         2.16, 3.33 A)
 &rst
  ixpk= 3510, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1683,1684,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:3511   102 LEU  MDY         4.50    (#   3511:20  Single Ambig)
 &rst
  ixpk= 3511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 192, 193, 194, 759, 760, 761,
 igr2=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  20-2:3512   103 GLN  HA          5.50    (#   3512:20  Single Ambig)
 &rst
  ixpk= 3512, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 227, 228, 229,1068,1069,1070,1072,1073,1074,2612,
      2613,2614,2616,2617,2618,2565,2566,2567,2569,2570,
      2571,
 &end
#
#    0 AMB  20-2:3513   103 GLN  HA          5.50    (#   3513:20  Single Ambig)
 &rst
  ixpk= 3513, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1066, 224, 225,
 &end
#
#    0 AMB  20-2:3514   103 GLN  HA          5.50    (#   3514:20  Single Ambig)
 &rst
  ixpk= 3514, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 220, 221, 222,1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  20-2:3515   103 GLN  HA          5.50    (#   3515:20  Single Ambig)
 &rst
  ixpk= 3515, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 265, 266,1023,1024,
 &end
#
#  103 GLN  HB-         103 GLN  HA          4.50    (#   3516:20  Unique         2.45, 2.82 A)
 &rst
  ixpk= 3516, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1702,1703,
 &end
#
#  103 GLN  HB+         103 GLN  HA          5.50    (#   3517:20  Unique         2.45, 2.82 A)
 &rst
  ixpk= 3517, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1702,1703,
 &end
#
#    0 AMB  20-2:3518   103 GLN  HA          4.50    (#   3518:20  Single Ambig)
 &rst
  ixpk= 3518, nxpk= 20, iat=  -1,1700, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1705,1706,1705,1706,
 &end
#
#  104 LEU  HN          103 GLN  HA          4.50    (#   3519:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 3519, nxpk= 20, iat=1715,1700, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  103 GLN  HN          103 GLN  HA          5.50    (#   3520:20  Unique         2.90, 2.92 A)
 &rst
  ixpk= 3520, nxpk= 20, iat=1698,1700, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN          103 GLN  HA          5.50    (#   3521:20  Unique         2.40, 3.20 A)
 &rst
  ixpk= 3521, nxpk= 20, iat= 233,1700, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HN          103 GLN  HB+         5.50    (#   3522:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 3522, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#  103 GLN  HN          103 GLN  HB-         5.50    (#   3523:20  Unique         2.17, 2.86 A)
 &rst
  ixpk= 3523, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#  103 GLN  HA          103 GLN  HB-         5.50    (#   3524:20  Unique         2.45, 2.82 A)
 &rst
  ixpk= 3524, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#    0 AMB  20-2:3526     0 AMB  20-1:3526   3.50    (#   3526:20  Double Ambig)
 &rst
  ixpk= 3526, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1702,1703,2610,
 igr2=1705,1706,1705,1706,1705,1706,
 &end
#
#  103 GLN  HA            0 AMB  20-1:3527   5.50    (#   3527:20  Single Ambig)
 &rst
  ixpk= 3527, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1705,1706,1705,1706,
 &end
#
#  103 GLN  HE2-          0 AMB  20-1:3528   5.50    (#   3528:20  Single Ambig)
 &rst
  ixpk= 3528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1710,1711,
 igr2=1705,1706,1705,1706,
 &end
#
#    0 AMB  20-2:3529     0 AMB  20-1:3529   4.50    (#   3529:20  Double Ambig)
 &rst
  ixpk= 3529, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1710,1711,1710,1711,
 igr2=1705,1706,1705,1706,
 &end
#
#  104 LEU  HN            0 AMB  20-1:3530   5.50    (#   3530:20  Single Ambig)
 &rst
  ixpk= 3530, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1705,1706,1705,1706,
 &end
#
#  103 GLN  HN            0 AMB  20-1:3531   5.50    (#   3531:20  Single Ambig)
 &rst
  ixpk= 3531, nxpk= 20, iat=1698,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1705,1706,1705,1706,
 &end
#
#  105 VAL  HN          104 LEU  HA          5.50    (#   3532:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 3532, nxpk= 20, iat=1734,1717, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HN          104 LEU  HA          5.50    (#   3533:20  Unique         2.77, 2.83 A)
 &rst
  ixpk= 3533, nxpk= 20, iat=1715,1717, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HB-         104 LEU  HA          5.50    (#   3534:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 3534, nxpk= 20, iat=  -1,1717, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1719,1720,
 &end
#
#  104 LEU  MDY         104 LEU  HB-         5.50    (#   3535:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3535, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1719,1720,
 &end
#
#    0 AMB  20-2:3536   104 LEU  HB-         4.50    (#   3536:20  Single Ambig)
 &rst
  ixpk= 3536, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1724,1725,1726,1728,1729,1730, 220, 221, 222,
 igr2=1719,1720,
 &end
#
#  104 LEU  MDX         104 LEU  HB+         5.50    (#   3537:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3537, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1719,1720,
 &end
#
#  104 LEU  MDY         104 LEU  HB+         5.50    (#   3538:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3538, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1719,1720,
 &end
#
#  104 LEU  HA          104 LEU  HB+         5.50    (#   3541:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 3541, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  104 LEU  HA          104 LEU  HB-         5.50    (#   3542:20  Unique         2.35, 2.74 A)
 &rst
  ixpk= 3542, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#   17 ASN  HA          104 LEU  HB-         5.50    (#   3543:20  Unique         1.82, 2.68 A)
 &rst
  ixpk= 3543, nxpk= 20, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#   17 ASN  HA          104 LEU  HB+         5.50    (#   3544:20  Unique         1.82, 2.68 A)
 &rst
  ixpk= 3544, nxpk= 20, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  103 GLN  HA          104 LEU  HB+         5.50    (#   3545:20  Unique         4.15, 4.60 A)
 &rst
  ixpk= 3545, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  103 GLN  HA          104 LEU  HB-         5.50    (#   3546:20  Unique         4.15, 4.60 A)
 &rst
  ixpk= 3546, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#   17 ASN  HD2+        104 LEU  HB-         5.50    (#   3547:20  Unique         2.90, 4.80 A)
 &rst
  ixpk= 3547, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 253, 254,
 igr2=1719,1720,
 &end
#
#  104 LEU  HN          104 LEU  HB-         5.50    (#   3549:20  Unique         2.05, 2.55 A)
 &rst
  ixpk= 3549, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  104 LEU  HN          104 LEU  HB+         5.50    (#   3550:20  Unique         2.05, 2.55 A)
 &rst
  ixpk= 3550, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  105 VAL  HN          104 LEU  HB+         5.50    (#   3551:20  Unique         3.67, 4.37 A)
 &rst
  ixpk= 3551, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  105 VAL  HN          104 LEU  HB-         5.50    (#   3552:20  Unique         3.67, 4.37 A)
 &rst
  ixpk= 3552, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1719,1720,
 &end
#
#  105 VAL  HN          104 LEU  HG          5.50    (#   3553:20  Unique         2.71, 3.86 A)
 &rst
  ixpk= 3553, nxpk= 20, iat=1734,1722, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HN          104 LEU  HG          5.50    (#   3554:20  Unique         3.32, 4.36 A)
 &rst
  ixpk= 3554, nxpk= 20, iat=1715,1722, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HN          104 LEU  HG          5.50    (#   3555:20  Unique         1.93, 3.13 A)
 &rst
  ixpk= 3555, nxpk= 20, iat=1750,1722, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3556     0 AMB  20-1:3556   5.50    (#   3556:20  Double Ambig)
 &rst
  ixpk= 3556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1857,1717,
 igr2=1926,1927,1722,
 &end
#
#    0 AMB  20-2:3557     0 AMB  20-1:3557   5.50    (#   3557:20  Double Ambig)
 &rst
  ixpk= 3557, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1840,1932,1910,
 igr2=1926,1927,1926,1927,1926,1927,
 &end
#
#  155 VAL  HA          158 LEU  HG          5.50    (#   3558:20  Unique         2.58, 4.58 A)
 &rst
  ixpk= 3558, nxpk= 20, iat=2561,2610, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HB+         104 LEU  HG          5.50    (#   3559:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 3559, nxpk= 20, iat=  -1,1722, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1719,1720,
 &end
#
#  104 LEU  HB-         104 LEU  HG          5.50    (#   3560:20  Unique         2.28, 2.73 A)
 &rst
  ixpk= 3560, nxpk= 20, iat=  -1,1722, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1719,1720,
 &end
#
#  104 LEU  MDX         104 LEU  HG          4.50    (#   3561:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3561, nxpk= 20, iat=  -1,1722, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  MDY         104 LEU  HG          4.50    (#   3562:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3562, nxpk= 20, iat=  -1,1722, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  20-2:3563   158 LEU  HG          3.50    (#   3563:20  Single Ambig)
 &rst
  ixpk= 3563, nxpk= 20, iat=  -1,2610, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,
 &end
#
#  111 ILE  QD1         104 LEU  MDX         5.50    (#   3564:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 3564, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1818,1819,1820,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HB-         104 LEU  MDX         4.50    (#   3565:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3565, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1719,1720,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HG          104 LEU  MDX         3.50    (#   3566:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3566, nxpk= 20, iat=1722,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HB+         104 LEU  MDX         5.50    (#   3567:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3567, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1719,1720,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HA          104 LEU  MDX         4.50    (#   3568:20  Unique         1.96, 3.90 A)
 &rst
  ixpk= 3568, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#   65 VAL  HA          104 LEU  MDX         5.50    (#   3569:20  Unique         4.57, 7.14 A)
 &rst
  ixpk= 3569, nxpk= 20, iat=1002,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  106 SER  HN          104 LEU  MDX         4.50    (#   3570:20  Unique         1.83, 4.23 A)
 &rst
  ixpk= 3570, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  107 GLY  HN          104 LEU  MDX         5.50    (#   3571:20  Unique         1.95, 3.51 A)
 &rst
  ixpk= 3571, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HN          104 LEU  MDX         5.50    (#   3572:20  Unique         3.16, 5.08 A)
 &rst
  ixpk= 3572, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  105 VAL  HN          104 LEU  MDX         4.50    (#   3573:20  Unique         2.20, 4.99 A)
 &rst
  ixpk= 3573, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  126 TRP  HE1         104 LEU  MDY         5.50    (#   3574:20  Unique         3.80, 5.99 A)
 &rst
  ixpk= 3574, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  105 VAL  HN          104 LEU  MDY         5.50    (#   3575:20  Unique         2.20, 4.99 A)
 &rst
  ixpk= 3575, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HN          104 LEU  MDY         5.50    (#   3576:20  Unique         3.16, 5.08 A)
 &rst
  ixpk= 3576, nxpk= 20, iat=1715,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  108 ASP  HN          104 LEU  MDY         5.50    (#   3577:20  Unique         2.03, 4.65 A)
 &rst
  ixpk= 3577, nxpk= 20, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#   17 ASN  HN          104 LEU  MDY         5.50    (#   3578:20  Unique         2.87, 6.30 A)
 &rst
  ixpk= 3578, nxpk= 20, iat= 244,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  126 TRP  HZ2         104 LEU  MDY         4.50    (#   3579:20  Unique         2.19, 4.91 A)
 &rst
  ixpk= 3579, nxpk= 20, iat=2051,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  106 SER  HN          104 LEU  MDY         5.50    (#   3580:20  Unique         1.83, 4.23 A)
 &rst
  ixpk= 3580, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  126 TRP  HH2         104 LEU  MDY         5.50    (#   3581:20  Unique         2.42, 5.71 A)
 &rst
  ixpk= 3581, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#   17 ASN  HD2+        104 LEU  MDY         5.50    (#   3582:20  Unique         1.93, 5.31 A)
 &rst
  ixpk= 3582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 253, 254,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#   17 ASN  HA          104 LEU  MDY         5.50    (#   3583:20  Unique         1.98, 4.46 A)
 &rst
  ixpk= 3583, nxpk= 20, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  103 GLN  HA            0 AMB  20-1:3584   5.50    (#   3584:20  Single Ambig)
 &rst
  ixpk= 3584, nxpk= 20, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr2=1667,1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HA          104 LEU  MDY         5.50    (#   3585:20  Unique         1.96, 3.90 A)
 &rst
  ixpk= 3585, nxpk= 20, iat=1717,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  108 ASP  HA          104 LEU  MDY         5.50    (#   3586:20  Unique         3.10, 5.61 A)
 &rst
  ixpk= 3586, nxpk= 20, iat=1770,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  20-2:3587   104 LEU  MDY         5.50    (#   3587:20  Single Ambig)
 &rst
  ixpk= 3587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 248, 249,1772,1773,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HB+         104 LEU  MDY         4.50    (#   3588:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1719,1720,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HG          104 LEU  MDY         4.50    (#   3589:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 3589, nxpk= 20, iat=1722,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  104 LEU  HB-         104 LEU  MDY         5.50    (#   3590:20  Unique         1.98, 3.28 A)
 &rst
  ixpk= 3590, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1719,1720,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  20-2:3591   104 LEU  MDY         4.50    (#   3591:20  Single Ambig)
 &rst
  ixpk= 3591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  QD1         104 LEU  MDY         5.50    (#   3592:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 3592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1818,1819,1820,
 igr2=1724,1725,1726,1728,1729,1730,
 &end
#
#  105 VAL  MGX         105 VAL  HA          4.50    (#   3593:20  Unique         2.18, 3.17 A)
 &rst
  ixpk= 3593, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  MGY         105 VAL  HA          3.50    (#   3594:20  Unique         2.18, 3.17 A)
 &rst
  ixpk= 3594, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  HB          105 VAL  HA          3.50    (#   3596:20  Unique         2.39, 2.92 A)
 &rst
  ixpk= 3596, nxpk= 20, iat=1738,1736, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:3597   105 VAL  HA          5.50    (#   3597:20  Single Ambig)
 &rst
  ixpk= 3597, nxpk= 20, iat=  -1,1736, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 268, 269, 268, 269,
 &end
#
#  106 SER  HN          105 VAL  HA          5.50    (#   3598:20  Unique         2.76, 3.33 A)
 &rst
  ixpk= 3598, nxpk= 20, iat=1750,1736, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HN          105 VAL  HA          5.50    (#   3599:20  Unique         2.86, 2.91 A)
 &rst
  ixpk= 3599, nxpk= 20, iat=1734,1736, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HN          105 VAL  HB          5.50    (#   3600:20  Unique         2.56, 2.83 A)
 &rst
  ixpk= 3600, nxpk= 20, iat=1734,1738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HN          149 LYS  HB+         3.50    (#   3601:20  Unique         2.14, 2.55 A)
 &rst
  ixpk= 3601, nxpk= 20, iat=2465,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2469,2470,
 &end
#
#  106 SER  HN          105 VAL  HB          5.50    (#   3602:20  Unique         2.69, 3.45 A)
 &rst
  ixpk= 3602, nxpk= 20, iat=1750,1738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HN          149 LYS  HB+         5.50    (#   3603:20  Unique         2.81, 3.65 A)
 &rst
  ixpk= 3603, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2469,2470,
 &end
#
#   77 TYR  HD          143 VAL  HB          5.50    (#   3604:20  Unique         2.54, 5.59 A)
 &rst
  ixpk= 3604, nxpk= 20, iat=  -1,2351, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1235,
 &end
#
#  106 SER  HA          105 VAL  HB          5.50    (#   3605:20  Unique         4.10, 4.52 A)
 &rst
  ixpk= 3605, nxpk= 20, iat=1752,1738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3606     0 AMB  20-1:3606   3.50    (#   3606:20  Double Ambig)
 &rst
  ixpk= 3606, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2467,1736,
 igr2=2469,2470,1738,
 &end
#
#  146 ARG  HA          149 LYS  HB+         5.50    (#   3607:20  Unique         2.24, 3.59 A)
 &rst
  ixpk= 3607, nxpk= 20, iat=2410,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2469,2470,
 &end
#
#    0 AMB  20-2:3608     0 AMB  20-1:3608   5.50    (#   3608:20  Double Ambig)
 &rst
  ixpk= 3608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2291,1754,1755, 740,2489,
 igr2=2351,1738, 674, 675,2469,2470,
 &end
#
#    0 AMB  20-2:3609     0 AMB  20-1:3609   5.50    (#   3609:20  Double Ambig)
 &rst
  ixpk= 3609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.88, r4=11.38,
 igr1= 268, 269, 268, 269,1026,1027,1026,1027,2418,2419,
      2418,2419,
 igr2=1738,2469,2470,2469,2470,
 &end
#
#    0 AMB  20-2:3610     0 AMB  20-1:3610   5.50    (#   3610:20  Double Ambig)
 &rst
  ixpk= 3610, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2478,2479,2478,2479,
 igr2=2469,2470,2469,2470,
 &end
#
#    0 AMB  20-2:3611     0 AMB  20-1:3611   3.50    (#   3611:20  Double Ambig)
 &rst
  ixpk= 3611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=2475,2476,2472,2473,
 igr2=2469,2470,2469,2470,
 &end
#
#  149 LYS  HG-         149 LYS  HB+         4.50    (#   3612:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2472,2473,
 igr2=2469,2470,
 &end
#
#  105 VAL  MGX         105 VAL  HB          3.50    (#   3613:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3613, nxpk= 20, iat=  -1,1738, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  MGY         105 VAL  HB          2.80    (#   3614:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3614, nxpk= 20, iat=  -1,1738, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  115 THR  HN          115 THR  MG2         4.50    (#   3616:20  Unique         1.97, 3.31 A)
 &rst
  ixpk= 3616, nxpk= 20, iat=1872,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1878,1879,1880,
 &end
#
#    0 AMB  20-2:3617     0 AMB  20-1:3617   4.50    (#   3617:20  Double Ambig)
 &rst
  ixpk= 3617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1= 849, 853,1750,
 igr2=1878,1879,1880,1006,1007,1008,1010,1011,1012,
 &end
#
#  112 ASN  HD2+        115 THR  MG2         4.50    (#   3618:20  Unique         2.07, 5.29 A)
 &rst
  ixpk= 3618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1833,1834,
 igr2=1878,1879,1880,
 &end
#
#  112 ASN  HD2-        115 THR  MG2         5.50    (#   3619:20  Unique         2.07, 5.29 A)
 &rst
  ixpk= 3619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1833,1834,
 igr2=1878,1879,1880,
 &end
#
#  107 GLY  HN          106 SER  HA          5.50    (#   3620:20  Unique         2.19, 3.42 A)
 &rst
  ixpk= 3620, nxpk= 20, iat=1761,1752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HN          106 SER  HA          5.50    (#   3621:20  Unique         2.79, 2.92 A)
 &rst
  ixpk= 3621, nxpk= 20, iat=1750,1752, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HB-         106 SER  HA          5.50    (#   3622:20  Unique         2.24, 2.74 A)
 &rst
  ixpk= 3622, nxpk= 20, iat=  -1,1752, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1754,1755,
 &end
#
#  106 SER  HB+         106 SER  HA          4.50    (#   3623:20  Unique         2.24, 2.74 A)
 &rst
  ixpk= 3623, nxpk= 20, iat=  -1,1752, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1754,1755,
 &end
#
#    0 AMB  20-2:3624     0 AMB  20-1:3624   5.50    (#   3624:20  Double Ambig)
 &rst
  ixpk= 3624, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1754,1755,1754,1755,
 &end
#
#    0 AMB  20-2:3625   106 SER  HB-         5.50    (#   3625:20  Single Ambig)
 &rst
  ixpk= 3625, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1754,1755,
 &end
#
#  105 VAL  MGX         106 SER  HB-         5.50    (#   3626:20  Unique         3.22, 6.85 A)
 &rst
  ixpk= 3626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1754,1755,
 &end
#
#  105 VAL  MGX         106 SER  HB+         5.50    (#   3627:20  Unique         3.22, 6.85 A)
 &rst
  ixpk= 3627, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1754,1755,
 &end
#
#  105 VAL  MGY         106 SER  HB+         5.50    (#   3628:20  Unique         3.22, 6.85 A)
 &rst
  ixpk= 3628, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1740,1741,1742,1744,1745,1746,
 igr2=1754,1755,
 &end
#
#  104 LEU  MDX         106 SER  HB+         5.50    (#   3629:20  Unique         2.64, 5.52 A)
 &rst
  ixpk= 3629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1754,1755,
 &end
#
#  104 LEU  MDX         106 SER  HB-         5.50    (#   3630:20  Unique         2.64, 5.52 A)
 &rst
  ixpk= 3630, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1754,1755,
 &end
#
#  109 ALA  MB          106 SER  HB+         5.50    (#   3631:20  Unique         2.70, 7.16 A)
 &rst
  ixpk= 3631, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1784,1785,1786,
 igr2=1754,1755,
 &end
#
#  110 GLU  HB-         106 SER  HB+         5.50    (#   3632:20  Unique         1.98, 3.55 A)
 &rst
  ixpk= 3632, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,
 igr2=1754,1755,
 &end
#
#  110 GLU  HB-         106 SER  HB-         5.50    (#   3633:20  Unique         1.98, 3.55 A)
 &rst
  ixpk= 3633, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,
 igr2=1754,1755,
 &end
#
#  110 GLU  HB+         106 SER  HB+         5.50    (#   3634:20  Unique         1.98, 3.55 A)
 &rst
  ixpk= 3634, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,
 igr2=1754,1755,
 &end
#
#  110 GLU  HB+         106 SER  HB-         5.50    (#   3635:20  Unique         1.98, 3.55 A)
 &rst
  ixpk= 3635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,
 igr2=1754,1755,
 &end
#
#  110 GLU  HG-         106 SER  HB+         5.50    (#   3636:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1754,1755,
 &end
#
#  110 GLU  HG+         106 SER  HB-         5.50    (#   3637:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3637, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1754,1755,
 &end
#
#  110 GLU  HG-         106 SER  HB-         5.50    (#   3638:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1754,1755,
 &end
#
#  110 GLU  HG+         106 SER  HB+         5.50    (#   3639:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1754,1755,
 &end
#
#    0 AMB  20-2:3640     0 AMB  20-1:3640   5.50    (#   3640:20  Double Ambig)
 &rst
  ixpk= 3640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 992, 993, 992, 993,
 igr2=1754,1755,1754,1755,
 &end
#
#    0 AMB  20-2:3641   106 SER  HB-         5.50    (#   3641:20  Single Ambig)
 &rst
  ixpk= 3641, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 992, 993, 992, 993,
 igr2=1754,1755,
 &end
#
#  107 GLY  HA+         106 SER  HB+         5.50    (#   3642:20  Unique         4.05, 4.82 A)
 &rst
  ixpk= 3642, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1763,1764,
 igr2=1754,1755,
 &end
#
#  107 GLY  HA+         106 SER  HB-         5.50    (#   3643:20  Unique         4.05, 4.82 A)
 &rst
  ixpk= 3643, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1763,1764,
 igr2=1754,1755,
 &end
#
#  106 SER  HA          106 SER  HB+         3.50    (#   3644:20  Unique         2.24, 2.74 A)
 &rst
  ixpk= 3644, nxpk= 20, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1754,1755,
 &end
#
#  106 SER  HA          106 SER  HB-         4.50    (#   3645:20  Unique         2.24, 2.74 A)
 &rst
  ixpk= 3645, nxpk= 20, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1754,1755,
 &end
#
#  106 SER  HN          106 SER  HB+         5.50    (#   3646:20  Unique         2.13, 3.09 A)
 &rst
  ixpk= 3646, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1754,1755,
 &end
#
#  106 SER  HN          106 SER  HB-         5.50    (#   3647:20  Unique         2.13, 3.09 A)
 &rst
  ixpk= 3647, nxpk= 20, iat=1750,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1754,1755,
 &end
#
#  107 GLY  HN          106 SER  HB+         4.50    (#   3648:20  Unique         1.95, 2.66 A)
 &rst
  ixpk= 3648, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1754,1755,
 &end
#
#  107 GLY  HN          106 SER  HB-         4.50    (#   3649:20  Unique         1.95, 2.66 A)
 &rst
  ixpk= 3649, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1754,1755,
 &end
#
#  105 VAL  HN          106 SER  HB+         5.50    (#   3650:20  Unique         3.67, 5.02 A)
 &rst
  ixpk= 3650, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1754,1755,
 &end
#
#  105 VAL  HN          106 SER  HB-         5.50    (#   3651:20  Unique         3.67, 5.02 A)
 &rst
  ixpk= 3651, nxpk= 20, iat=1734,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1754,1755,
 &end
#
#  104 LEU  MDY         107 GLY  HA-         5.50    (#   3652:20  Unique         1.98, 3.94 A)
 &rst
  ixpk= 3652, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1763,1764,
 &end
#
#    0 AMB  20-2:3653   107 GLY  HA-         5.50    (#   3653:20  Single Ambig)
 &rst
  ixpk= 3653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1784,1785,1786, 248, 249, 919,
 igr2=1763,1764,
 &end
#
#    0 AMB  20-2:3654   107 GLY  HA-         5.50    (#   3654:20  Single Ambig)
 &rst
  ixpk= 3654, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 248, 249,1772,1773,1772,1773,
 igr2=1763,1764,
 &end
#
#  106 SER  HA          107 GLY  HA-         5.50    (#   3655:20  Unique         4.34, 4.81 A)
 &rst
  ixpk= 3655, nxpk= 20, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1763,1764,
 &end
#
#  110 GLU  HN          107 GLY  HA-         5.50    (#   3656:20  Unique         3.01, 4.19 A)
 &rst
  ixpk= 3656, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1763,1764,
 &end
#
#  110 GLU  HN          107 GLY  HA+         5.50    (#   3657:20  Unique         3.01, 4.19 A)
 &rst
  ixpk= 3657, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1763,1764,
 &end
#
#  108 ASP  HN          107 GLY  HA+         4.50    (#   3658:20  Unique         2.14, 2.62 A)
 &rst
  ixpk= 3658, nxpk= 20, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1763,1764,
 &end
#
#  108 ASP  HN          107 GLY  HA-         3.50    (#   3659:20  Unique         2.14, 2.62 A)
 &rst
  ixpk= 3659, nxpk= 20, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1763,1764,
 &end
#
#  107 GLY  HN          107 GLY  HA-         4.50    (#   3660:20  Unique         2.30, 2.73 A)
 &rst
  ixpk= 3660, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1763,1764,
 &end
#
#  107 GLY  HN          107 GLY  HA+         3.50    (#   3661:20  Unique         2.30, 2.73 A)
 &rst
  ixpk= 3661, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1763,1764,
 &end
#
#  111 ILE  QD1         108 ASP  HA          4.50    (#   3662:20  Unique         1.95, 3.19 A)
 &rst
  ixpk= 3662, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QG2           0 AMB  20-1:3663   5.50    (#   3663:20  Single Ambig)
 &rst
  ixpk= 3663, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1811,1812,1813,
 igr2=1770,1840,
 &end
#
#  111 ILE  HG1+        108 ASP  HA          5.50    (#   3664:20  Unique         2.03, 3.46 A)
 &rst
  ixpk= 3664, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  20-2:3665     0 AMB  20-1:3665   5.50    (#   3665:20  Double Ambig)
 &rst
  ixpk= 3665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1770,1840,
 &end
#
#    0 AMB  20-2:3666     0 AMB  20-1:3666   5.50    (#   3666:20  Double Ambig)
 &rst
  ixpk= 3666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1878,1879,1880, 895, 896, 897, 899, 900, 901, 895,
       896, 897, 899, 900, 901,
 igr2=1840,1770,
 &end
#
#  104 LEU  MDY         108 ASP  HA          4.50    (#   3667:20  Unique         3.10, 5.61 A)
 &rst
  ixpk= 3667, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  HG1-        108 ASP  HA          5.50    (#   3668:20  Unique         2.03, 3.46 A)
 &rst
  ixpk= 3668, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  20-2:3669   108 ASP  HA          5.50    (#   3669:20  Single Ambig)
 &rst
  ixpk= 3669, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1784,1785,1786, 248, 249,
 &end
#
#    0 AMB  20-2:3670   113 MET  HA          4.50    (#   3670:20  Single Ambig)
 &rst
  ixpk= 3670, nxpk= 20, iat=  -1,1840, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1842,1843,1842,1843,
 &end
#
#  113 MET  HG+         113 MET  HA          3.50    (#   3671:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 3671, nxpk= 20, iat=  -1,1840, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1845,1846,
 &end
#
#    0 AMB  20-2:3672   108 ASP  HA          3.50    (#   3672:20  Single Ambig)
 &rst
  ixpk= 3672, nxpk= 20, iat=  -1,1770, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1772,1773,1772,1773,
 &end
#
#  111 ILE  HN          108 ASP  HA          5.50    (#   3673:20  Unique         2.87, 3.14 A)
 &rst
  ixpk= 3673, nxpk= 20, iat=1805,1770, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 GLU  HN          108 ASP  HA          5.50    (#   3674:20  Unique         3.79, 4.07 A)
 &rst
  ixpk= 3674, nxpk= 20, iat=1790,1770, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HZ2         108 ASP  HA          5.50    (#   3675:20  Unique         1.99, 2.87 A)
 &rst
  ixpk= 3675, nxpk= 20, iat=2051,1770, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 ASP  HN          108 ASP  HA          4.50    (#   3677:20  Unique         2.72, 2.76 A)
 &rst
  ixpk= 3677, nxpk= 20, iat=1768,1770, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  113 MET  HN          113 MET  HA          5.50    (#   3678:20  Unique         2.27, 2.56 A)
 &rst
  ixpk= 3678, nxpk= 20, iat=1838,1840, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 ASP  HN          109 ALA  HA          5.50    (#   3679:20  Unique         5.21, 5.33 A)
 &rst
  ixpk= 3679, nxpk= 20, iat=1768,1782, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 ALA  HN          109 ALA  HA          4.50    (#   3680:20  Unique         2.76, 2.81 A)
 &rst
  ixpk= 3680, nxpk= 20, iat=1780,1782, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 GLU  HN          109 ALA  HA          5.50    (#   3681:20  Unique         3.46, 3.51 A)
 &rst
  ixpk= 3681, nxpk= 20, iat=1790,1782, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  HN          109 ALA  HA          5.50    (#   3682:20  Unique         3.69, 4.36 A)
 &rst
  ixpk= 3682, nxpk= 20, iat=1805,1782, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 ALA  MB          109 ALA  HA          2.80    (#   3683:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3683, nxpk= 20, iat=  -1,1782, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1784,1785,1786,
 &end
#
#  108 ASP  HN          109 ALA  MB          5.50    (#   3684:20  Unique         4.60, 5.50 A)
 &rst
  ixpk= 3684, nxpk= 20, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1784,1785,1786,
 &end
#
#  109 ALA  HN          109 ALA  MB          2.80    (#   3685:20  Unique         2.07, 2.89 A)
 &rst
  ixpk= 3685, nxpk= 20, iat=1780,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1784,1785,1786,
 &end
#
#  110 GLU  HN          109 ALA  MB          4.50    (#   3686:20  Unique         2.59, 3.54 A)
 &rst
  ixpk= 3686, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1784,1785,1786,
 &end
#
#  111 ILE  HN          109 ALA  MB          5.50    (#   3687:20  Unique         4.62, 5.34 A)
 &rst
  ixpk= 3687, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1784,1785,1786,
 &end
#
#  109 ALA  HA          109 ALA  MB          2.80    (#   3688:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3688, nxpk= 20, iat=1782,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1784,1785,1786,
 &end
#
#  110 GLU  HA          109 ALA  MB          5.50    (#   3689:20  Unique         3.96, 4.94 A)
 &rst
  ixpk= 3689, nxpk= 20, iat=1792,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1784,1785,1786,
 &end
#
#    0 AMB  20-2:3690   109 ALA  MB          5.50    (#   3690:20  Single Ambig)
 &rst
  ixpk= 3690, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1772,1773,1772,1773,
 igr2=1784,1785,1786,
 &end
#
#  110 GLU  HN          110 GLU  HA          4.50    (#   3692:20  Unique         2.90, 2.93 A)
 &rst
  ixpk= 3692, nxpk= 20, iat=1790,1792, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 ILE  HN          110 GLU  HA          4.50    (#   3693:20  Unique         3.12, 3.39 A)
 &rst
  ixpk= 3693, nxpk= 20, iat=1805,1792, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  110 GLU  HG+         110 GLU  HA          5.50    (#   3694:20  Unique         2.06, 3.15 A)
 &rst
  ixpk= 3694, nxpk= 20, iat=  -1,1792, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#  110 GLU  HB+         110 GLU  HA          4.50    (#   3695:20  Unique         2.23, 2.73 A)
 &rst
  ixpk= 3695, nxpk= 20, iat=  -1,1792, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1794,1795,
 &end
#
#  110 GLU  HB-         110 GLU  HA          3.50    (#   3696:20  Unique         2.23, 2.73 A)
 &rst
  ixpk= 3696, nxpk= 20, iat=  -1,1792, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1794,1795,
 &end
#
#  110 GLU  HN          110 GLU  HB-         4.50    (#   3697:20  Unique         2.19, 2.97 A)
 &rst
  ixpk= 3697, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1794,1795,
 &end
#
#  110 GLU  HN          110 GLU  HB+         5.50    (#   3698:20  Unique         2.19, 2.97 A)
 &rst
  ixpk= 3698, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1794,1795,
 &end
#
#  111 ILE  HN          110 GLU  HB+         5.50    (#   3699:20  Unique         2.63, 3.64 A)
 &rst
  ixpk= 3699, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1794,1795,
 &end
#
#    0 AMB  20-2:3700     0 AMB  20-1:3700   5.50    (#   3700:20  Double Ambig)
 &rst
  ixpk= 3700, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1805,1435,
 igr2=1794,1795,1379,1380,
 &end
#
#  110 GLU  HA          110 GLU  HB-         5.50    (#   3701:20  Unique         2.23, 2.73 A)
 &rst
  ixpk= 3701, nxpk= 20, iat=1792,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1794,1795,
 &end
#
#  110 GLU  HA          110 GLU  HB+         4.50    (#   3702:20  Unique         2.23, 2.73 A)
 &rst
  ixpk= 3702, nxpk= 20, iat=1792,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1794,1795,
 &end
#
#  110 GLU  HG+         110 GLU  HB+         4.50    (#   3703:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3703, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1797,1798,
 igr2=1794,1795,
 &end
#
#  110 GLU  HG+         110 GLU  HB-         5.50    (#   3704:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1794,1795,
 &end
#
#  110 GLU  HG-         110 GLU  HB-         5.50    (#   3705:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1797,1798,
 igr2=1794,1795,
 &end
#
#  110 GLU  HG-         110 GLU  HB+         4.50    (#   3706:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3706, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1797,1798,
 igr2=1794,1795,
 &end
#
#    0 AMB  20-2:3707     0 AMB  20-1:3707   5.50    (#   3707:20  Double Ambig)
 &rst
  ixpk= 3707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1794,1795,1794,1795,
 &end
#
#    0 AMB  20-2:3708   110 GLU  HB-         5.50    (#   3708:20  Single Ambig)
 &rst
  ixpk= 3708, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1794,1795,
 &end
#
#    0 AMB  20-2:3709     0 AMB  20-1:3709   5.50    (#   3709:20  Double Ambig)
 &rst
  ixpk= 3709, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1797,1798,1797,1798,
 &end
#
#    0 AMB  20-2:3710   110 GLU  HG-         5.50    (#   3710:20  Single Ambig)
 &rst
  ixpk= 3710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1797,1798,
 &end
#
#  109 ALA  MB          110 GLU  HG+         5.50    (#   3711:20  Unique         2.81, 5.30 A)
 &rst
  ixpk= 3711, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1784,1785,1786,
 igr2=1797,1798,
 &end
#
#  109 ALA  MB          110 GLU  HG-         5.50    (#   3712:20  Unique         2.81, 5.30 A)
 &rst
  ixpk= 3712, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1784,1785,1786,
 igr2=1797,1798,
 &end
#
#  110 GLU  HB-         110 GLU  HG+         4.50    (#   3713:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1794,1795,
 igr2=1797,1798,
 &end
#
#  110 GLU  HB-         110 GLU  HG-         4.50    (#   3714:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3714, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1794,1795,
 igr2=1797,1798,
 &end
#
#  110 GLU  HB+         110 GLU  HG+         4.50    (#   3715:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1794,1795,
 igr2=1797,1798,
 &end
#
#  110 GLU  HB+         110 GLU  HG-         4.50    (#   3716:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 3716, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1794,1795,
 igr2=1797,1798,
 &end
#
#  106 SER  HB-         110 GLU  HG+         5.50    (#   3717:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3717, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1754,1755,
 igr2=1797,1798,
 &end
#
#  106 SER  HB-         110 GLU  HG-         5.50    (#   3718:20  Unique         2.00, 4.10 A)
 &rst
  ixpk= 3718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1754,1755,
 igr2=1797,1798,
 &end
#
#  110 GLU  HA          110 GLU  HG+         4.50    (#   3719:20  Unique         2.06, 3.15 A)
 &rst
  ixpk= 3719, nxpk= 20, iat=1792,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1797,1798,
 &end
#
#  110 GLU  HA          110 GLU  HG-         5.50    (#   3720:20  Unique         2.06, 3.15 A)
 &rst
  ixpk= 3720, nxpk= 20, iat=1792,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  106 SER  HA          110 GLU  HG-         5.50    (#   3721:20  Unique         2.80, 4.77 A)
 &rst
  ixpk= 3721, nxpk= 20, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  106 SER  HA          110 GLU  HG+         5.50    (#   3722:20  Unique         2.80, 4.77 A)
 &rst
  ixpk= 3722, nxpk= 20, iat=1752,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  111 ILE  HN          110 GLU  HG+         5.50    (#   3723:20  Unique         2.36, 4.67 A)
 &rst
  ixpk= 3723, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  111 ILE  HN          110 GLU  HG-         5.50    (#   3724:20  Unique         2.36, 4.67 A)
 &rst
  ixpk= 3724, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  110 GLU  HN          110 GLU  HG+         5.50    (#   3725:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 3725, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  110 GLU  HN          110 GLU  HG-         5.50    (#   3726:20  Unique         2.31, 3.52 A)
 &rst
  ixpk= 3726, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  107 GLY  HN          110 GLU  HG+         5.50    (#   3727:20  Unique         3.50, 5.24 A)
 &rst
  ixpk= 3727, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  107 GLY  HN          110 GLU  HG-         5.50    (#   3728:20  Unique         3.50, 5.24 A)
 &rst
  ixpk= 3728, nxpk= 20, iat=1761,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1797,1798,
 &end
#
#  111 ILE  QD1         111 ILE  HA          5.50    (#   3729:20  Unique         1.95, 3.88 A)
 &rst
  ixpk= 3729, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QG2         111 ILE  HA          5.50    (#   3730:20  Unique         2.34, 3.42 A)
 &rst
  ixpk= 3730, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  HG1+        111 ILE  HA          5.50    (#   3731:20  Unique         1.95, 2.78 A)
 &rst
  ixpk= 3731, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#  104 LEU  MDX         111 ILE  HA          5.50    (#   3733:20  Unique         4.58, 6.82 A)
 &rst
  ixpk= 3733, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  HG1-        111 ILE  HA          5.50    (#   3734:20  Unique         1.95, 2.78 A)
 &rst
  ixpk= 3734, nxpk= 20, iat=  -1,1807, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  20-2:3735     0 AMB  20-1:3735   4.50    (#   3735:20  Double Ambig)
 &rst
  ixpk= 3735, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1809,1382,1383,
 igr2=1807,1361,
 &end
#
#    0 AMB  20-2:3737     0 AMB  20-1:3737   5.50    (#   3737:20  Double Ambig)
 &rst
  ixpk= 3737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1770,1514,1840,
 igr2=1807,1361,
 &end
#
#    0 AMB  20-2:3738     0 AMB  20-1:3738   5.50    (#   3738:20  Double Ambig)
 &rst
  ixpk= 3738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1805,1550,1551,
 igr2=1807,1361,
 &end
#
#   83 LEU  HN           84 VAL  HA          5.50    (#   3739:20  Unique         4.39, 4.66 A)
 &rst
  ixpk= 3739, nxpk= 20, iat=1340,1361, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3740     0 AMB  20-1:3740   5.50    (#   3740:20  Double Ambig)
 &rst
  ixpk= 3740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1790,1531,
 igr2=1807,1361,
 &end
#
#  112 ASN  HN          111 ILE  HB          5.50    (#   3741:20  Unique         4.02, 4.31 A)
 &rst
  ixpk= 3741, nxpk= 20, iat=1824,1809, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 GLU  HN          111 ILE  HB          5.50    (#   3742:20  Unique         3.90, 4.19 A)
 &rst
  ixpk= 3742, nxpk= 20, iat=1790,1809, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  HN          111 ILE  HB          4.50    (#   3744:20  Unique         2.11, 2.33 A)
 &rst
  ixpk= 3744, nxpk= 20, iat=1805,1809, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  108 ASP  HA          111 ILE  HB          5.50    (#   3745:20  Unique         1.88, 2.11 A)
 &rst
  ixpk= 3745, nxpk= 20, iat=1770,1809, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  HA          111 ILE  HB          5.50    (#   3746:20  Unique         2.74, 2.93 A)
 &rst
  ixpk= 3746, nxpk= 20, iat=1807,1809, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  HG1-        111 ILE  HB          5.50    (#   3747:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 3747, nxpk= 20, iat=  -1,1809, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  20-2:3748   111 ILE  HB          5.50    (#   3748:20  Single Ambig)
 &rst
  ixpk= 3748, nxpk= 20, iat=  -1,1809, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  111 ILE  HG1+        111 ILE  HB          5.50    (#   3749:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 3749, nxpk= 20, iat=  -1,1809, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#  111 ILE  QG2         111 ILE  HB          4.50    (#   3750:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3750, nxpk= 20, iat=  -1,1809, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  QD1         111 ILE  HB          4.50    (#   3751:20  Unique         2.05, 3.16 A)
 &rst
  ixpk= 3751, nxpk= 20, iat=  -1,1809, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QD1         111 ILE  HG1+        5.50    (#   3752:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3752, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1818,1819,1820,
 igr2=1815,1816,
 &end
#
#  111 ILE  QG2         111 ILE  HG1+        5.50    (#   3753:20  Unique         2.31, 3.35 A)
 &rst
  ixpk= 3753, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1811,1812,1813,
 igr2=1815,1816,
 &end
#
#    0 AMB  20-2:3754     0 AMB  20-1:3754   5.50    (#   3754:20  Double Ambig)
 &rst
  ixpk= 3754, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1815,1816,1815,1816,
 &end
#
#    0 AMB  20-2:3755     0 AMB  20-1:3755   5.50    (#   3755:20  Double Ambig)
 &rst
  ixpk= 3755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1815,1816,1815,1816,
 &end
#
#  104 LEU  MDX         111 ILE  HG1+        5.50    (#   3756:20  Unique         2.46, 5.46 A)
 &rst
  ixpk= 3756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1815,1816,
 &end
#
#  111 ILE  HB          111 ILE  HG1+        5.50    (#   3758:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 3758, nxpk= 20, iat=1809,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1815,1816,
 &end
#
#  111 ILE  HA          111 ILE  HG1+        5.50    (#   3759:20  Unique         1.95, 2.78 A)
 &rst
  ixpk= 3759, nxpk= 20, iat=1807,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1815,1816,
 &end
#
#  108 ASP  HA          111 ILE  HG1+        5.50    (#   3760:20  Unique         2.03, 3.46 A)
 &rst
  ixpk= 3760, nxpk= 20, iat=1770,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1815,1816,
 &end
#
#  111 ILE  HN          111 ILE  HG1+        5.50    (#   3761:20  Unique         1.88, 3.51 A)
 &rst
  ixpk= 3761, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1815,1816,
 &end
#
#  112 ASN  HN          111 ILE  HG1+        5.50    (#   3762:20  Unique         2.55, 4.16 A)
 &rst
  ixpk= 3762, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1815,1816,
 &end
#
#  111 ILE  QG2         111 ILE  QD1         3.50    (#   3763:20  Unique         2.00, 4.04 A)
 &rst
  ixpk= 3763, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1811,1812,1813,
 igr2=1818,1819,1820,
 &end
#
#  111 ILE  HG1+        111 ILE  QD1         4.50    (#   3764:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3764, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1815,1816,
 igr2=1818,1819,1820,
 &end
#
#    0 AMB  20-2:3765   111 ILE  QD1         4.50    (#   3765:20  Single Ambig)
 &rst
  ixpk= 3765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1818,1819,1820,
 &end
#
#    0 AMB  20-2:3766   111 ILE  QD1         5.50    (#   3766:20  Single Ambig)
 &rst
  ixpk= 3766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1818,1819,1820,
 &end
#
#  104 LEU  MDX         111 ILE  QD1         5.50    (#   3767:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 3767, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1818,1819,1820,
 &end
#
#  104 LEU  MDY         111 ILE  QD1         4.50    (#   3768:20  Unique         1.99, 4.56 A)
 &rst
  ixpk= 3768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1818,1819,1820,
 &end
#
#  111 ILE  HG1-        111 ILE  QD1         3.50    (#   3769:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 3769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1815,1816,
 igr2=1818,1819,1820,
 &end
#
#  111 ILE  HB          111 ILE  QD1         4.50    (#   3770:20  Unique         2.05, 3.16 A)
 &rst
  ixpk= 3770, nxpk= 20, iat=1809,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1818,1819,1820,
 &end
#
#    0 AMB  20-2:3771   111 ILE  QD1         5.50    (#   3771:20  Single Ambig)
 &rst
  ixpk= 3771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=1849,1850,1851,1794,1795,
 igr2=1818,1819,1820,
 &end
#
#   58 VAL  HB          111 ILE  QD1         5.50    (#   3772:20  Unique         1.96, 4.28 A)
 &rst
  ixpk= 3772, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#    0 AMB  20-2:3773   111 ILE  QD1         5.50    (#   3773:20  Single Ambig)
 &rst
  ixpk= 3773, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1772,1773,1772,1773,
 igr2=1818,1819,1820,
 &end
#
#  111 ILE  HA          111 ILE  QD1         5.50    (#   3774:20  Unique         1.95, 3.88 A)
 &rst
  ixpk= 3774, nxpk= 20, iat=1807,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  108 ASP  HA          111 ILE  QD1         4.50    (#   3775:20  Unique         1.95, 3.19 A)
 &rst
  ixpk= 3775, nxpk= 20, iat=1770,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1818,1819,1820,
 &end
#
#  107 GLY  HA+         111 ILE  QD1         5.50    (#   3776:20  Unique         1.96, 5.27 A)
 &rst
  ixpk= 3776, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1763,1764,
 igr2=1818,1819,1820,
 &end
#
#  126 TRP  HH2         111 ILE  QD1         5.50    (#   3778:20  Unique         1.99, 2.88 A)
 &rst
  ixpk= 3778, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  111 ILE  HN          111 ILE  QD1         5.50    (#   3779:20  Unique         2.24, 4.18 A)
 &rst
  ixpk= 3779, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  126 TRP  HZ2         111 ILE  QD1         5.50    (#   3781:20  Unique         1.98, 3.19 A)
 &rst
  ixpk= 3781, nxpk= 20, iat=2051,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  110 GLU  HN          111 ILE  QD1         5.50    (#   3782:20  Unique         3.64, 5.61 A)
 &rst
  ixpk= 3782, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  112 ASN  HN          111 ILE  QD1         5.50    (#   3783:20  Unique         3.72, 5.47 A)
 &rst
  ixpk= 3783, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  109 ALA  HN          111 ILE  QD1         5.50    (#   3784:20  Unique         4.39, 5.94 A)
 &rst
  ixpk= 3784, nxpk= 20, iat=1780,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  108 ASP  HN          111 ILE  QD1         5.50    (#   3785:20  Unique         3.12, 4.60 A)
 &rst
  ixpk= 3785, nxpk= 20, iat=1768,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  126 TRP  HE1         111 ILE  QD1         5.50    (#   3787:20  Unique         4.34, 5.72 A)
 &rst
  ixpk= 3787, nxpk= 20, iat=2048,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1818,1819,1820,
 &end
#
#  113 MET  HN          111 ILE  QG2         5.50    (#   3789:20  Unique         1.94, 4.06 A)
 &rst
  ixpk= 3789, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#  112 ASN  HN          111 ILE  QG2         4.50    (#   3790:20  Unique         2.13, 3.68 A)
 &rst
  ixpk= 3790, nxpk= 20, iat=1824,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1811,1812,1813,
 &end
#
#  110 GLU  HN          111 ILE  QG2         5.50    (#   3791:20  Unique         5.17, 6.38 A)
 &rst
  ixpk= 3791, nxpk= 20, iat=1790,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3792   111 ILE  QG2         5.50    (#   3792:20  Single Ambig)
 &rst
  ixpk= 3792, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2051,1867,1868, 905,
 igr2=1811,1812,1813,
 &end
#
#  111 ILE  HN          111 ILE  QG2         5.50    (#   3794:20  Unique         3.12, 4.31 A)
 &rst
  ixpk= 3794, nxpk= 20, iat=1805,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#  126 TRP  HH2         111 ILE  QG2         5.50    (#   3795:20  Unique         1.98, 4.25 A)
 &rst
  ixpk= 3795, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#   58 VAL  HA          111 ILE  QG2         5.50    (#   3797:20  Unique         2.19, 4.28 A)
 &rst
  ixpk= 3797, nxpk= 20, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3798   111 ILE  QG2         5.50    (#   3798:20  Single Ambig)
 &rst
  ixpk= 3798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1770,1840,
 igr2=1811,1812,1813,
 &end
#
#   59 GLY  HA+         111 ILE  QG2         5.50    (#   3799:20  Unique         4.45, 7.32 A)
 &rst
  ixpk= 3799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 907, 908,
 igr2=1811,1812,1813,
 &end
#
#  111 ILE  HA          111 ILE  QG2         4.50    (#   3800:20  Unique         2.34, 3.42 A)
 &rst
  ixpk= 3800, nxpk= 20, iat=1807,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3801   111 ILE  QG2         5.50    (#   3801:20  Single Ambig)
 &rst
  ixpk= 3801, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1772,1773,1772,1773,
 igr2=1811,1812,1813,
 &end
#
#  112 ASN  HB-         111 ILE  QG2         5.50    (#   3802:20  Unique         4.66, 6.09 A)
 &rst
  ixpk= 3802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1828,1829,
 igr2=1811,1812,1813,
 &end
#
#  113 MET  HG+         111 ILE  QG2         4.50    (#   3803:20  Unique         1.97, 3.41 A)
 &rst
  ixpk= 3803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1845,1846,
 igr2=1811,1812,1813,
 &end
#
#   58 VAL  HB          111 ILE  QG2         5.50    (#   3804:20  Unique         2.06, 4.70 A)
 &rst
  ixpk= 3804, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3805   111 ILE  QG2         4.50    (#   3805:20  Single Ambig)
 &rst
  ixpk= 3805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1849,1850,1851,1842,1843,
 igr2=1811,1812,1813,
 &end
#
#  111 ILE  HB          111 ILE  QG2         3.50    (#   3806:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 3806, nxpk= 20, iat=1809,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1811,1812,1813,
 &end
#
#  111 ILE  HG1-        111 ILE  QG2         4.50    (#   3808:20  Unique         2.31, 3.35 A)
 &rst
  ixpk= 3808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1815,1816,
 igr2=1811,1812,1813,
 &end
#
#  104 LEU  MDY         111 ILE  QG2         5.50    (#   3809:20  Unique         5.20, 7.91 A)
 &rst
  ixpk= 3809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1811,1812,1813,
 &end
#
#  104 LEU  MDX         111 ILE  QG2         5.50    (#   3810:20  Unique         5.20, 7.91 A)
 &rst
  ixpk= 3810, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1724,1725,1726,1728,1729,1730,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3811   111 ILE  QG2         3.50    (#   3811:20  Single Ambig)
 &rst
  ixpk= 3811, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1811,1812,1813,
 &end
#
#    0 AMB  20-2:3812   111 ILE  QG2         5.50    (#   3812:20  Single Ambig)
 &rst
  ixpk= 3812, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 igr2=1811,1812,1813,
 &end
#
#  111 ILE  HG1+        111 ILE  QG2         4.50    (#   3813:20  Unique         2.31, 3.35 A)
 &rst
  ixpk= 3813, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1815,1816,
 igr2=1811,1812,1813,
 &end
#
#  113 MET  HN          112 ASN  HB-         5.50    (#   3814:20  Unique         2.27, 3.60 A)
 &rst
  ixpk= 3814, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1828,1829,
 &end
#
#  113 MET  HN          112 ASN  HB+         5.50    (#   3815:20  Unique         2.27, 3.60 A)
 &rst
  ixpk= 3815, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1828,1829,
 &end
#
#   59 GLY  HN          112 ASN  HB+         5.50    (#   3816:20  Unique         4.38, 5.54 A)
 &rst
  ixpk= 3816, nxpk= 20, iat= 905,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1828,1829,
 &end
#
#  112 ASN  HD2-        112 ASN  HB-         5.50    (#   3817:20  Unique         2.11, 3.16 A)
 &rst
  ixpk= 3817, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1833,1834,
 igr2=1828,1829,
 &end
#
#   59 GLY  HA+         112 ASN  HB-         5.50    (#   3819:20  Unique         1.98, 3.90 A)
 &rst
  ixpk= 3819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 907, 908,
 igr2=1828,1829,
 &end
#
#    0 AMB  20-2:3821     0 AMB  20-1:3821   5.50    (#   3821:20  Double Ambig)
 &rst
  ixpk= 3821, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1855,1824,
 igr2=1828,1829,1828,1829,
 &end
#
#    0 AMB  20-2:3822   112 ASN  HB-         5.50    (#   3822:20  Single Ambig)
 &rst
  ixpk= 3822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1855,1824,
 igr2=1828,1829,
 &end
#
#  112 ASN  HD2+        112 ASN  HB-         5.50    (#   3823:20  Unique         2.11, 3.16 A)
 &rst
  ixpk= 3823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1833,1834,
 igr2=1828,1829,
 &end
#
#  112 ASN  HD2-        112 ASN  HB+         5.50    (#   3824:20  Unique         2.11, 3.16 A)
 &rst
  ixpk= 3824, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1833,1834,
 igr2=1828,1829,
 &end
#
#   59 GLY  HA+         112 ASN  HB+         5.50    (#   3826:20  Unique         1.98, 3.90 A)
 &rst
  ixpk= 3826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 907, 908,
 igr2=1828,1829,
 &end
#
#  115 THR  MG2         112 ASN  HB+         5.50    (#   3827:20  Unique         1.99, 4.38 A)
 &rst
  ixpk= 3827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2=1828,1829,
 &end
#
#  115 THR  MG2         112 ASN  HB-         5.50    (#   3828:20  Unique         1.99, 4.38 A)
 &rst
  ixpk= 3828, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2=1828,1829,
 &end
#
#  113 MET  HG-         113 MET  HA          4.50    (#   3829:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 3829, nxpk= 20, iat=  -1,1840, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1845,1846,
 &end
#
#  126 TRP  HH2         108 ASP  HA          5.50    (#   3830:20  Unique         3.28, 4.05 A)
 &rst
  ixpk= 3830, nxpk= 20, iat=2053,1770, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:3831   113 MET  HA          5.50    (#   3831:20  Single Ambig)
 &rst
  ixpk= 3831, nxpk= 20, iat=  -1,1840, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1855,1824,
 &end
#
#  109 ALA  HN          108 ASP  HA          5.50    (#   3832:20  Unique         3.42, 3.47 A)
 &rst
  ixpk= 3832, nxpk= 20, iat=1780,1770, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  113 MET  HN            0 AMB  20-1:3833   5.50    (#   3833:20  Single Ambig)
 &rst
  ixpk= 3833, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1842,1843,1842,1843,
 &end
#
#  113 MET  HN            0 AMB  20-1:3834   5.50    (#   3834:20  Single Ambig)
 &rst
  ixpk= 3834, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1842,1843,1842,1843,
 &end
#
#  113 MET  HA            0 AMB  20-1:3835   5.50    (#   3835:20  Single Ambig)
 &rst
  ixpk= 3835, nxpk= 20, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1842,1843,1842,1843,
 &end
#
#  113 MET  HA            0 AMB  20-1:3836   5.50    (#   3836:20  Single Ambig)
 &rst
  ixpk= 3836, nxpk= 20, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1842,1843,1842,1843,
 &end
#
#  113 MET  HG-           0 AMB  20-1:3837   5.50    (#   3837:20  Single Ambig)
 &rst
  ixpk= 3837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1845,1846,
 igr2=1842,1843,1842,1843,
 &end
#
#  113 MET  HG-           0 AMB  20-1:3838   5.50    (#   3838:20  Single Ambig)
 &rst
  ixpk= 3838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1845,1846,
 igr2=1842,1843,1842,1843,
 &end
#
#    0 AMB  20-2:3839     0 AMB  20-1:3839   5.50    (#   3839:20  Double Ambig)
 &rst
  ixpk= 3839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1845,1846,1845,1846,
 igr2=1842,1843,1842,1843,
 &end
#
#    0 AMB  20-2:3840     0 AMB  20-1:3840   5.50    (#   3840:20  Double Ambig)
 &rst
  ixpk= 3840, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1845,1846,1845,1846,
 igr2=1842,1843,1842,1843,
 &end
#
#  111 ILE  QG2         113 MET  HG-         5.50    (#   3841:20  Unique         1.97, 3.41 A)
 &rst
  ixpk= 3841, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1811,1812,1813,
 igr2=1845,1846,
 &end
#
#  111 ILE  QG2         113 MET  HG+         5.50    (#   3842:20  Unique         1.97, 3.41 A)
 &rst
  ixpk= 3842, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1811,1812,1813,
 igr2=1845,1846,
 &end
#
#    0 AMB  20-2:3843   113 MET  HG-         5.50    (#   3843:20  Single Ambig)
 &rst
  ixpk= 3843, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1845,1846,
 &end
#
#    0 AMB  20-2:3844     0 AMB  20-1:3844   5.50    (#   3844:20  Double Ambig)
 &rst
  ixpk= 3844, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1845,1846,1845,1846,
 &end
#
#    0 AMB  20-2:3845     0 AMB  20-1:3845   4.50    (#   3845:20  Double Ambig)
 &rst
  ixpk= 3845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 igr2=1845,1846,1845,1846,1845,1846,
 &end
#
#    0 AMB  20-2:3846   113 MET  HG-         4.50    (#   3846:20  Single Ambig)
 &rst
  ixpk= 3846, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 igr2=1845,1846,
 &end
#
#  113 MET  HA          113 MET  HG+         5.50    (#   3847:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 3847, nxpk= 20, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1845,1846,
 &end
#
#  113 MET  HA          113 MET  HG-         5.50    (#   3848:20  Unique         2.05, 3.07 A)
 &rst
  ixpk= 3848, nxpk= 20, iat=1840,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1845,1846,
 &end
#
#    0 AMB  20-2:3850     0 AMB  20-1:3850   5.50    (#   3850:20  Double Ambig)
 &rst
  ixpk= 3850, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1824,1855,1990,
 igr2=1845,1846,1845,1846,1845,1846,
 &end
#
#    0 AMB  20-2:3851   113 MET  HG-         5.50    (#   3851:20  Single Ambig)
 &rst
  ixpk= 3851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1824,1855,1990,
 igr2=1845,1846,
 &end
#
#  113 MET  HN          113 MET  HG+         5.50    (#   3852:20  Unique         2.12, 3.03 A)
 &rst
  ixpk= 3852, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1845,1846,
 &end
#
#  113 MET  HN          113 MET  HG-         5.50    (#   3853:20  Unique         2.12, 3.03 A)
 &rst
  ixpk= 3853, nxpk= 20, iat=1838,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1845,1846,
 &end
#
#  125 ARG  HN          113 MET  ME          5.50    (#   3855:20  Unique         3.09, 4.80 A)
 &rst
  ixpk= 3855, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1849,1850,1851,
 &end
#
#  124 TRP  HN          113 MET  ME          5.50    (#   3857:20  Unique         2.32, 4.18 A)
 &rst
  ixpk= 3857, nxpk= 20, iat=1990,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3858   113 MET  ME          5.50    (#   3858:20  Single Ambig)
 &rst
  ixpk= 3858, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 390, 380,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3859   113 MET  ME          5.50    (#   3859:20  Single Ambig)
 &rst
  ixpk= 3859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1983,2051,
 igr2=1849,1850,1851,
 &end
#
#  126 TRP  HH2         113 MET  ME          4.50    (#   3861:20  Unique         2.09, 3.66 A)
 &rst
  ixpk= 3861, nxpk= 20, iat=2053,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1849,1850,1851,
 &end
#
#  124 TRP  HA          113 MET  ME          5.50    (#   3862:20  Unique         1.99, 3.80 A)
 &rst
  ixpk= 3862, nxpk= 20, iat=1992,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1849,1850,1851,
 &end
#
#   25 ALA  HA          113 MET  ME          5.50    (#   3863:20  Unique         2.69, 4.49 A)
 &rst
  ixpk= 3863, nxpk= 20, iat= 382,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1849,1850,1851,
 &end
#
#   58 VAL  HA          113 MET  ME          4.50    (#   3864:20  Unique         2.55, 4.47 A)
 &rst
  ixpk= 3864, nxpk= 20, iat= 891,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3865   113 MET  ME          5.50    (#   3865:20  Single Ambig)
 &rst
  ixpk= 3865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1840,1770,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3866   113 MET  ME          5.50    (#   3866:20  Single Ambig)
 &rst
  ixpk= 3866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1955,1956,1807,
 igr2=1849,1850,1851,
 &end
#
#  124 TRP  HB-         113 MET  ME          5.50    (#   3867:20  Unique         3.09, 5.37 A)
 &rst
  ixpk= 3867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1994,1995,
 igr2=1849,1850,1851,
 &end
#
#  124 TRP  HB+         113 MET  ME          4.50    (#   3868:20  Unique         3.09, 5.37 A)
 &rst
  ixpk= 3868, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1994,1995,
 igr2=1849,1850,1851,
 &end
#
#  113 MET  HG-         113 MET  ME          4.50    (#   3869:20  Unique         2.10, 3.29 A)
 &rst
  ixpk= 3869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1845,1846,
 igr2=1849,1850,1851,
 &end
#
#  113 MET  HG+         113 MET  ME          3.50    (#   3870:20  Unique         2.10, 3.29 A)
 &rst
  ixpk= 3870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1845,1846,
 igr2=1849,1850,1851,
 &end
#
#  111 ILE  HB          113 MET  ME          5.50    (#   3871:20  Unique         3.96, 5.29 A)
 &rst
  ixpk= 3871, nxpk= 20, iat=1809,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3872   113 MET  ME          4.50    (#   3872:20  Single Ambig)
 &rst
  ixpk= 3872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 350, 351, 352,1815,1816,
 igr2=1849,1850,1851,
 &end
#
#    0 AMB  20-2:3873   113 MET  ME          2.80    (#   3873:20  Single Ambig)
 &rst
  ixpk= 3873, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 igr2=1849,1850,1851,
 &end
#
#   25 ALA  MB          113 MET  ME          3.50    (#   3874:20  Unique         1.99, 4.30 A)
 &rst
  ixpk= 3874, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 384, 385, 386,
 igr2=1849,1850,1851,
 &end
#
#  111 ILE  QG2         113 MET  ME          3.50    (#   3875:20  Unique         1.97, 3.82 A)
 &rst
  ixpk= 3875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1811,1812,1813,
 igr2=1849,1850,1851,
 &end
#
#  111 ILE  QD1         113 MET  ME          5.50    (#   3876:20  Unique         2.49, 5.13 A)
 &rst
  ixpk= 3876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1818,1819,1820,
 igr2=1849,1850,1851,
 &end
#
#  114 GLN  HB-         114 GLN  HA          4.50    (#   3877:20  Unique         2.23, 2.70 A)
 &rst
  ixpk= 3877, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1859,1860,
 &end
#
#    0 AMB  20-2:3878   114 GLN  HA          3.50    (#   3878:20  Single Ambig)
 &rst
  ixpk= 3878, nxpk= 20, iat=  -1,1857, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1862,1863,1862,1863,1859,1860,
 &end
#
#  114 GLN  HN          114 GLN  HA          5.50    (#   3879:20  Unique         2.85, 2.92 A)
 &rst
  ixpk= 3879, nxpk= 20, iat=1855,1857, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 GLN  HN          114 GLN  HB-         5.50    (#   3880:20  Unique         2.24, 3.21 A)
 &rst
  ixpk= 3880, nxpk= 20, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1859,1860,
 &end
#
#  114 GLN  HA          114 GLN  HB-         5.50    (#   3881:20  Unique         2.23, 2.70 A)
 &rst
  ixpk= 3881, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1859,1860,
 &end
#
#  114 GLN  HA            0 AMB  20-1:3882   3.50    (#   3882:20  Single Ambig)
 &rst
  ixpk= 3882, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1862,1863,1862,1863,
 &end
#
#  116 SER  HN          115 THR  HA          5.50    (#   3883:20  Unique         3.42, 3.47 A)
 &rst
  ixpk= 3883, nxpk= 20, iat=1886,1874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  115 THR  HN          115 THR  HA          4.50    (#   3884:20  Unique         2.75, 2.79 A)
 &rst
  ixpk= 3884, nxpk= 20, iat=1872,1874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:3885     0 AMB  20-1:3885   5.50    (#   3885:20  Double Ambig)
 &rst
  ixpk= 3885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2575,2654,
 igr2=2596,2597,2596,2597,
 &end
#
#  157 SER  HN            0 AMB  20-1:3886   3.50    (#   3886:20  Single Ambig)
 &rst
  ixpk= 3886, nxpk= 20, iat=2592,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2596,2597,2596,2597,
 &end
#
#  158 LEU  HN            0 AMB  20-1:3887   4.50    (#   3887:20  Single Ambig)
 &rst
  ixpk= 3887, nxpk= 20, iat=2603,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2596,2597,2596,2597,
 &end
#
#  112 ASN  HD2-        115 THR  HA          5.50    (#   3888:20  Unique         2.20, 4.28 A)
 &rst
  ixpk= 3888, nxpk= 20, iat=  -1,1874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1833,1834,
 &end
#
#    0 AMB  20-2:3889   115 THR  HA          5.50    (#   3889:20  Single Ambig)
 &rst
  ixpk= 3889, nxpk= 20, iat=  -1,1874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1888,1857,
 &end
#
#  117 SER  HA          117 SER  HB+         3.50    (#   3890:20  Unique         2.62, 2.81 A)
 &rst
  ixpk= 3890, nxpk= 20, iat=1899,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1901,1902,
 &end
#
#  154 VAL  HA            0 AMB  20-1:3891   5.50    (#   3891:20  Single Ambig)
 &rst
  ixpk= 3891, nxpk= 20, iat=2545,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2596,2597,2596,2597,
 &end
#
#  112 ASN  HB-         115 THR  HA          5.50    (#   3892:20  Unique         2.55, 4.17 A)
 &rst
  ixpk= 3892, nxpk= 20, iat=  -1,1874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1828,1829,
 &end
#
#    0 AMB  20-2:3893     0 AMB  20-1:3893   5.50    (#   3893:20  Double Ambig)
 &rst
  ixpk= 3893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.56, r4=11.06,
 igr1=1862,1863,1862,1863,1859,1860,2646,2647,2646,2647,
      
 igr2=1874,2596,2597,2596,2597,
 &end
#
#    0 AMB  20-2:3894     0 AMB  20-1:3894   5.50    (#   3894:20  Double Ambig)
 &rst
  ixpk= 3894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.17, r4=11.67,
 igr1=2579,2580,2579,2580,2579,2580,1929,1930,2626,2627,
      
 igr2=2596,2597,2596,2597,2596,2597,1874,
 &end
#
#    0 AMB  20-2:3895     0 AMB  20-1:3895   5.50    (#   3895:20  Double Ambig)
 &rst
  ixpk= 3895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2610,2607,2608,2607,2608,
 igr2=2596,2597,2596,2597,2596,2597,
 &end
#
#    0 AMB  20-2:3896     0 AMB  20-1:3896   5.50    (#   3896:20  Double Ambig)
 &rst
  ixpk= 3896, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2607,2608,2563,
 igr2=2596,2597,2596,2597,2596,2597,
 &end
#
#    0 AMB  20-2:3897     0 AMB  20-1:3897   3.50    (#   3897:20  Double Ambig)
 &rst
  ixpk= 3897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.60, r4= 7.10,
 igr1=1878,1879,1880,2612,2613,2614,2616,2617,2618,
 igr2=1874,2596,2597,2596,2597,
 &end
#
#  115 THR  MG2         115 THR  HB          3.50    (#   3898:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 3898, nxpk= 20, iat=  -1,1876, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1878,1879,1880,
 &end
#
#  116 SER  HB-         115 THR  HB          5.50    (#   3899:20  Unique         3.80, 5.64 A)
 &rst
  ixpk= 3899, nxpk= 20, iat=  -1,1876, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1890,1891,
 &end
#
#    0 AMB  20-2:3900     0 AMB  20-1:3900   5.50    (#   3900:20  Double Ambig)
 &rst
  ixpk= 3900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1888,1857, 914,
 igr2=1876,1912,
 &end
#
#  115 THR  HN          115 THR  HB          4.50    (#   3903:20  Unique         2.41, 2.85 A)
 &rst
  ixpk= 3903, nxpk= 20, iat=1872,1876, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  116 SER  HN          115 THR  HB          5.50    (#   3904:20  Unique         3.18, 3.85 A)
 &rst
  ixpk= 3904, nxpk= 20, iat=1886,1876, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  116 SER  HB-         116 SER  HA          4.50    (#   3907:20  Unique         2.53, 2.81 A)
 &rst
  ixpk= 3907, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1890,1891,
 &end
#
#  116 SER  HB+         116 SER  HA          4.50    (#   3908:20  Unique         2.53, 2.81 A)
 &rst
  ixpk= 3908, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1890,1891,
 &end
#
#    0 AMB  20-2:3910   116 SER  HA          5.50    (#   3910:20  Single Ambig)
 &rst
  ixpk= 3910, nxpk= 20, iat=  -1,1888, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1908,1872,
 &end
#
#  116 SER  HN          116 SER  HA          5.50    (#   3911:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 3911, nxpk= 20, iat=1886,1888, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  117 SER  HN          116 SER  HA          3.50    (#   3912:20  Unique         2.92, 3.11 A)
 &rst
  ixpk= 3912, nxpk= 20, iat=1897,1888, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  117 SER  HN          116 SER  HB-         5.50    (#   3913:20  Unique         3.64, 4.09 A)
 &rst
  ixpk= 3913, nxpk= 20, iat=1897,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1890,1891,
 &end
#
#  117 SER  HN          116 SER  HB+         4.50    (#   3914:20  Unique         3.64, 4.09 A)
 &rst
  ixpk= 3914, nxpk= 20, iat=1897,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1890,1891,
 &end
#
#  116 SER  HN          116 SER  HB+         4.50    (#   3915:20  Unique         2.32, 2.71 A)
 &rst
  ixpk= 3915, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1890,1891,
 &end
#
#  116 SER  HN          116 SER  HB-         4.50    (#   3916:20  Unique         2.32, 2.71 A)
 &rst
  ixpk= 3916, nxpk= 20, iat=1886,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1890,1891,
 &end
#
#  118 THR  HN          116 SER  HB-         5.50    (#   3917:20  Unique         3.14, 4.07 A)
 &rst
  ixpk= 3917, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1890,1891,
 &end
#
#  118 THR  HN          116 SER  HB+         5.50    (#   3918:20  Unique         3.14, 4.07 A)
 &rst
  ixpk= 3918, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1890,1891,
 &end
#
#  116 SER  HA          116 SER  HB+         3.50    (#   3919:20  Unique         2.53, 2.81 A)
 &rst
  ixpk= 3919, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1890,1891,
 &end
#
#  116 SER  HA          116 SER  HB-         4.50    (#   3920:20  Unique         2.53, 2.81 A)
 &rst
  ixpk= 3920, nxpk= 20, iat=1888,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1890,1891,
 &end
#
#  119 PRO  HA          116 SER  HB-         5.50    (#   3921:20  Unique         2.93, 3.69 A)
 &rst
  ixpk= 3921, nxpk= 20, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1890,1891,
 &end
#
#  119 PRO  HA          116 SER  HB+         5.50    (#   3922:20  Unique         2.93, 3.69 A)
 &rst
  ixpk= 3922, nxpk= 20, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1890,1891,
 &end
#
#   56 GLU  HB+         116 SER  HB+         5.50    (#   3923:20  Unique         3.30, 5.54 A)
 &rst
  ixpk= 3923, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864,
 igr2=1890,1891,
 &end
#
#   56 GLU  HB+         116 SER  HB-         5.50    (#   3924:20  Unique         3.30, 5.54 A)
 &rst
  ixpk= 3924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864,
 igr2=1890,1891,
 &end
#
#   56 GLU  HB-         116 SER  HB+         5.50    (#   3925:20  Unique         3.30, 5.54 A)
 &rst
  ixpk= 3925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864,
 igr2=1890,1891,
 &end
#
#  119 PRO  HB-         116 SER  HB-         5.50    (#   3926:20  Unique         1.98, 3.74 A)
 &rst
  ixpk= 3926, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,
 igr2=1890,1891,
 &end
#
#  117 SER  HB+         117 SER  HA          2.80    (#   3927:20  Unique         2.62, 2.81 A)
 &rst
  ixpk= 3927, nxpk= 20, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1901,1902,
 &end
#
#  117 SER  HB-         117 SER  HA          3.50    (#   3928:20  Unique         2.62, 2.81 A)
 &rst
  ixpk= 3928, nxpk= 20, iat=  -1,1899, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1901,1902,
 &end
#
#    0 AMB  20-2:3929     0 AMB  20-1:3929   5.50    (#   3929:20  Double Ambig)
 &rst
  ixpk= 3929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1914,1915,1916,2549,2550,2551,2553,2554,2555,
 igr2=1901,1902,2596,2597,2596,2597,
 &end
#
#  118 THR  MG2         117 SER  HB-         5.50    (#   3930:20  Unique         2.81, 5.12 A)
 &rst
  ixpk= 3930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1914,1915,1916,
 igr2=1901,1902,
 &end
#
#  157 SER  HA            0 AMB  20-1:3931   2.80    (#   3931:20  Single Ambig)
 &rst
  ixpk= 3931, nxpk= 20, iat=2594,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=2596,2597,2596,2597,
 &end
#
#  117 SER  HA          117 SER  HB-         3.50    (#   3932:20  Unique         2.62, 2.81 A)
 &rst
  ixpk= 3932, nxpk= 20, iat=1899,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1901,1902,
 &end
#
#    0 AMB  20-2:3933   117 SER  HB-         5.50    (#   3933:20  Single Ambig)
 &rst
  ixpk= 3933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1888,1857,
 igr2=1901,1902,
 &end
#
#    0 AMB  20-2:3934     0 AMB  20-1:3934   5.50    (#   3934:20  Double Ambig)
 &rst
  ixpk= 3934, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1888,1857,
 igr2=1901,1902,1874,
 &end
#
#  118 THR  HN          117 SER  HB-         5.50    (#   3935:20  Unique         2.17, 2.81 A)
 &rst
  ixpk= 3935, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1901,1902,
 &end
#
#    0 AMB  20-2:3936     0 AMB  20-1:3936   5.50    (#   3936:20  Double Ambig)
 &rst
  ixpk= 3936, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1908,1872,
 igr2=1901,1902,1874,
 &end
#
#  117 SER  HN          117 SER  HB+         4.50    (#   3937:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 3937, nxpk= 20, iat=1897,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1901,1902,
 &end
#
#  117 SER  HN          117 SER  HB-         4.50    (#   3938:20  Unique         3.20, 3.52 A)
 &rst
  ixpk= 3938, nxpk= 20, iat=1897,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1901,1902,
 &end
#
#    0 AMB  20-2:3939     0 AMB  20-1:3939   4.50    (#   3939:20  Double Ambig)
 &rst
  ixpk= 3939, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1908,1340,
 igr2=1910,1318,
 &end
#
#  118 THR  HB          118 THR  HA          4.50    (#   3940:20  Unique         2.38, 2.56 A)
 &rst
  ixpk= 3940, nxpk= 20, iat=1912,1910, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   82 ARG  HB+          82 ARG  HA          3.50    (#   3941:20  Unique         2.27, 2.47 A)
 &rst
  ixpk= 3941, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1320,1321,
 &end
#
#   82 ARG  HB-          82 ARG  HA          3.50    (#   3942:20  Unique         2.27, 2.47 A)
 &rst
  ixpk= 3942, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1320,1321,
 &end
#
#   82 ARG  HG-          82 ARG  HA          4.50    (#   3943:20  Unique         2.26, 3.68 A)
 &rst
  ixpk= 3943, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1323,1324,
 &end
#
#   82 ARG  HG+          82 ARG  HA          4.50    (#   3944:20  Unique         2.26, 3.68 A)
 &rst
  ixpk= 3944, nxpk= 20, iat=  -1,1318, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1323,1324,
 &end
#
#  118 THR  MG2         118 THR  HB          3.50    (#   3945:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 3945, nxpk= 20, iat=  -1,1912, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1914,1915,1916,
 &end
#
#    0 AMB  20-2:3946     0 AMB  20-1:3946   5.50    (#   3946:20  Double Ambig)
 &rst
  ixpk= 3946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1923,1924, 442, 443,
 igr2=1912,1876,
 &end
#
#    0 AMB  20-2:3947     0 AMB  20-1:3947   5.50    (#   3947:20  Double Ambig)
 &rst
  ixpk= 3947, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1923,1924,1923,1924,
 igr2=1912,1876,
 &end
#
#  118 THR  HA          118 THR  HB          3.50    (#   3948:20  Unique         2.38, 2.56 A)
 &rst
  ixpk= 3948, nxpk= 20, iat=1910,1912, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  115 THR  HN          115 THR  HB          4.50    (#   3950:20  Unique         2.41, 2.85 A)
 &rst
  ixpk= 3950, nxpk= 20, iat=1872,1876, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  117 SER  HN          118 THR  MG2         5.50    (#   3952:20  Unique         5.60, 6.69 A)
 &rst
  ixpk= 3952, nxpk= 20, iat=1897,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1914,1915,1916,
 &end
#
#  118 THR  HN          118 THR  MG2         5.50    (#   3953:20  Unique         2.46, 4.09 A)
 &rst
  ixpk= 3953, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1914,1915,1916,
 &end
#
#  118 THR  HA          118 THR  MG2         3.50    (#   3954:20  Unique         2.13, 3.00 A)
 &rst
  ixpk= 3954, nxpk= 20, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1914,1915,1916,
 &end
#
#  118 THR  HB          118 THR  MG2         2.80    (#   3955:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 3955, nxpk= 20, iat=1912,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1914,1915,1916,
 &end
#
#  119 PRO  HD+         118 THR  MG2         5.50    (#   3956:20  Unique         4.02, 5.33 A)
 &rst
  ixpk= 3956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1923,1924,
 igr2=1914,1915,1916,
 &end
#
#    0 AMB  20-2:3957   118 THR  MG2         5.50    (#   3957:20  Single Ambig)
 &rst
  ixpk= 3957, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 442, 443,1923,1924,
 igr2=1914,1915,1916,
 &end
#
#  120 GLU  HB-         119 PRO  HA          5.50    (#   3958:20  Unique         4.22, 5.29 A)
 &rst
  ixpk= 3958, nxpk= 20, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1940,1941,
 &end
#
#    0 AMB  20-2:3959   119 PRO  HA          4.50    (#   3959:20  Single Ambig)
 &rst
  ixpk= 3959, nxpk= 20, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1929,1930, 863, 864,
 &end
#
#  119 PRO  HB+         119 PRO  HA          4.50    (#   3960:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3960, nxpk= 20, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1929,1930,
 &end
#
#  116 SER  HB-         119 PRO  HA          5.50    (#   3961:20  Unique         2.93, 3.69 A)
 &rst
  ixpk= 3961, nxpk= 20, iat=  -1,1932, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1890,1891,
 &end
#
#  120 GLU  HN          119 PRO  HA          3.50    (#   3963:20  Unique         2.70, 3.38 A)
 &rst
  ixpk= 3963, nxpk= 20, iat=1936,1932, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  121 PHE  HN          119 PRO  HA          5.50    (#   3964:20  Unique         4.36, 5.29 A)
 &rst
  ixpk= 3964, nxpk= 20, iat=1951,1932, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 GLU  HN          119 PRO  HB+         5.50    (#   3967:20  Unique         1.76, 2.95 A)
 &rst
  ixpk= 3967, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1929,1930,
 &end
#
#  120 GLU  HN          119 PRO  HB-         4.50    (#   3968:20  Unique         1.76, 2.95 A)
 &rst
  ixpk= 3968, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1929,1930,
 &end
#
#    0 AMB  20-2:3969     0 AMB  20-1:3969   5.50    (#   3969:20  Double Ambig)
 &rst
  ixpk= 3969, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 446, 454, 847, 855,
 igr2=1929,1930,1929,1930,
 &end
#
#    0 AMB  20-2:3970     0 AMB  20-1:3970   5.50    (#   3970:20  Double Ambig)
 &rst
  ixpk= 3970, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1857, 876,
 igr2=1929,1930,1929,1930,
 &end
#
#  119 PRO  HA          119 PRO  HB+         4.50    (#   3971:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3971, nxpk= 20, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1929,1930,
 &end
#
#  119 PRO  HA          119 PRO  HB-         3.50    (#   3972:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 3972, nxpk= 20, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1929,1930,
 &end
#
#    0 AMB  20-2:3973     0 AMB  20-1:3973   5.50    (#   3973:20  Double Ambig)
 &rst
  ixpk= 3973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1923,1924,1955,1956,
 igr2=1929,1930,1929,1930,
 &end
#
#  119 PRO  HD-         119 PRO  HB+         5.50    (#   3974:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 3974, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1923,1924,
 igr2=1929,1930,
 &end
#
#  119 PRO  HG+         119 PRO  HB+         4.50    (#   3975:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3975, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1926,1927,
 igr2=1929,1930,
 &end
#
#    0 AMB  20-2:3976     0 AMB  20-1:3976   2.80    (#   3976:20  Double Ambig)
 &rst
  ixpk= 3976, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1=2475,2476,1304,1305,1304,1305,2472,2473,
 igr2=2469,2470,1298,1299,1298,1299,
 &end
#
#    0 AMB  20-2:3977     0 AMB  20-1:3977   4.50    (#   3977:20  Double Ambig)
 &rst
  ixpk= 3977, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1926,1927,2563,
 igr2=1929,1930,2582,2583,
 &end
#
#  133 VAL  MGX         141 ARG  HG-         5.50    (#   3978:20  Unique         2.59, 6.83 A)
 &rst
  ixpk= 3978, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2318,2319,
 &end
#
#  119 PRO  HB-         119 PRO  HG+         4.50    (#   3980:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3980, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1929,1930,
 igr2=1926,1927,
 &end
#
#    0 AMB  20-2:3981     0 AMB  20-1:3981   3.50    (#   3981:20  Double Ambig)
 &rst
  ixpk= 3981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 790, 791,1929,1930,2388,2389,2388,2389,
 igr2= 793, 794,1926,1927,2318,2319,
 &end
#
#  119 PRO  HB+         119 PRO  HG+         5.50    (#   3982:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,
 igr2=1926,1927,
 &end
#
#    0 AMB  20-2:3983     0 AMB  20-1:3983   5.50    (#   3983:20  Double Ambig)
 &rst
  ixpk= 3983, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1862,1863,1862,1863,1975,1976,
 igr2=1926,1927,1926,1927,1926,1927,
 &end
#
#    0 AMB  20-2:3984     0 AMB  20-1:3984   5.50    (#   3984:20  Double Ambig)
 &rst
  ixpk= 3984, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1287,1288,1862,1863,1862,1863,
 igr2=1323,1324,1926,1927,
 &end
#
#  119 PRO  HB+         119 PRO  HG-         5.50    (#   3985:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 3985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,
 igr2=1926,1927,
 &end
#
#    0 AMB  20-2:3986     0 AMB  20-1:3986   5.50    (#   3986:20  Double Ambig)
 &rst
  ixpk= 3986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1923,1924, 442, 443,
 igr2=1926,1927,1926,1927,
 &end
#
#    0 AMB  20-2:3987   119 PRO  HG-         5.50    (#   3987:20  Single Ambig)
 &rst
  ixpk= 3987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1923,1924, 442, 443,
 igr2=1926,1927,
 &end
#
#  119 PRO  HD+         119 PRO  HG+         4.50    (#   3988:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 3988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1923,1924,
 igr2=1926,1927,
 &end
#
#    0 AMB  20-2:3989     0 AMB  20-1:3989   4.50    (#   3989:20  Double Ambig)
 &rst
  ixpk= 3989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1318,1840,
 igr2=1323,1324,1926,1927,
 &end
#
#  114 GLN  HA          119 PRO  HG-         5.50    (#   3990:20  Unique         1.91, 3.16 A)
 &rst
  ixpk= 3990, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1926,1927,
 &end
#
#   28 PHE  HD          119 PRO  HG+         5.50    (#   3991:20  Unique         2.86, 6.55 A)
 &rst
  ixpk= 3991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2=1926,1927,
 &end
#
#    0 AMB  20-2:3992     0 AMB  20-1:3992   5.50    (#   3992:20  Double Ambig)
 &rst
  ixpk= 3992, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2198, 644, 645,
 igr2=2318,2319, 793, 794,
 &end
#
#  120 GLU  HN          119 PRO  HD+         5.50    (#   3993:20  Unique         2.75, 3.91 A)
 &rst
  ixpk= 3993, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1923,1924,
 &end
#
#  118 THR  HN          119 PRO  HD+         5.50    (#   3994:20  Unique         2.51, 3.26 A)
 &rst
  ixpk= 3994, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1923,1924,
 &end
#
#  118 THR  HN          119 PRO  HD-         5.50    (#   3995:20  Unique         2.51, 3.26 A)
 &rst
  ixpk= 3995, nxpk= 20, iat=1908,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1923,1924,
 &end
#
#   28 PHE  HD          119 PRO  HD-         5.50    (#   3996:20  Unique         2.82, 6.04 A)
 &rst
  ixpk= 3996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2=1923,1924,
 &end
#
#  114 GLN  HA          119 PRO  HD+         5.50    (#   3997:20  Unique         2.26, 2.99 A)
 &rst
  ixpk= 3997, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1923,1924,
 &end
#
#  114 GLN  HA          119 PRO  HD-         5.50    (#   3998:20  Unique         2.26, 2.99 A)
 &rst
  ixpk= 3998, nxpk= 20, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1923,1924,
 &end
#
#  118 THR  HA          119 PRO  HD-         3.50    (#   3999:20  Unique         2.01, 2.60 A)
 &rst
  ixpk= 3999, nxpk= 20, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1923,1924,
 &end
#
#  118 THR  HA          119 PRO  HD+         3.50    (#   4000:20  Unique         2.01, 2.60 A)
 &rst
  ixpk= 4000, nxpk= 20, iat=1910,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1923,1924,
 &end
#
#    0 AMB  20-2:4001     0 AMB  20-1:4001   5.50    (#   4001:20  Double Ambig)
 &rst
  ixpk= 4001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1912,1874,1876,
 igr2=1923,1924,1923,1924,1923,1924,
 &end
#
#    0 AMB  20-2:4002   119 PRO  HD-         5.50    (#   4002:20  Single Ambig)
 &rst
  ixpk= 4002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1912,1874,1876,
 igr2=1923,1924,
 &end
#
#  119 PRO  HB+         119 PRO  HD+         5.50    (#   4003:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,
 igr2=1923,1924,
 &end
#
#  119 PRO  HB+         119 PRO  HD-         5.50    (#   4004:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 4004, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,
 igr2=1923,1924,
 &end
#
#    0 AMB  20-2:4005     0 AMB  20-1:4005   5.50    (#   4005:20  Double Ambig)
 &rst
  ixpk= 4005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1859,1860,1929,1930,
 igr2=1923,1924,1923,1924,
 &end
#
#    0 AMB  20-2:4006   119 PRO  HD-         5.50    (#   4006:20  Single Ambig)
 &rst
  ixpk= 4006, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1859,1860,1929,1930,
 igr2=1923,1924,
 &end
#
#  119 PRO  HG+         119 PRO  HD+         4.50    (#   4007:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1926,1927,
 igr2=1923,1924,
 &end
#
#  119 PRO  HG+         119 PRO  HD-         5.50    (#   4008:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4008, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1926,1927,
 igr2=1923,1924,
 &end
#
#  119 PRO  HG-         119 PRO  HD-         5.50    (#   4009:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4009, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1926,1927,
 igr2=1923,1924,
 &end
#
#  119 PRO  HG-         119 PRO  HD+         5.50    (#   4010:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1926,1927,
 igr2=1923,1924,
 &end
#
#  118 THR  MG2         119 PRO  HD+         5.50    (#   4011:20  Unique         4.02, 5.33 A)
 &rst
  ixpk= 4011, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1914,1915,1916,
 igr2=1923,1924,
 &end
#
#  118 THR  MG2         119 PRO  HD-         5.50    (#   4012:20  Unique         4.02, 5.33 A)
 &rst
  ixpk= 4012, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1914,1915,1916,
 igr2=1923,1924,
 &end
#
#  120 GLU  HB-         120 GLU  HA          5.50    (#   4013:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 4013, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1940,1941,
 &end
#
#  120 GLU  HG+         120 GLU  HA          5.50    (#   4014:20  Unique         2.07, 3.26 A)
 &rst
  ixpk= 4014, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1943,1944,
 &end
#
#  120 GLU  HG-         120 GLU  HA          5.50    (#   4015:20  Unique         2.07, 3.26 A)
 &rst
  ixpk= 4015, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1943,1944,
 &end
#
#  120 GLU  HB+         120 GLU  HA          4.50    (#   4016:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 4016, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1940,1941,
 &end
#
#   28 PHE  HB-         120 GLU  HA          5.50    (#   4017:20  Unique         3.42, 6.07 A)
 &rst
  ixpk= 4017, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#  121 PHE  HB-         120 GLU  HA          5.50    (#   4018:20  Unique         4.31, 6.02 A)
 &rst
  ixpk= 4018, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#  119 PRO  HA          120 GLU  HA          5.50    (#   4019:20  Unique         4.33, 4.67 A)
 &rst
  ixpk= 4019, nxpk= 20, iat=1932,1938, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HD          120 GLU  HA          5.50    (#   4020:20  Unique         2.66, 5.30 A)
 &rst
  ixpk= 4020, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 446, 454,
 &end
#
#    0 AMB  20-2:4021   120 GLU  HA          5.50    (#   4021:20  Single Ambig)
 &rst
  ixpk= 4021, nxpk= 20, iat=  -1,1938, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1936, 458,
 &end
#
#  121 PHE  HN          120 GLU  HA          5.50    (#   4022:20  Unique         2.62, 3.49 A)
 &rst
  ixpk= 4022, nxpk= 20, iat=1951,1938, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HN          120 GLU  HB-         5.50    (#   4023:20  Unique         2.26, 3.22 A)
 &rst
  ixpk= 4023, nxpk= 20, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1940,1941,
 &end
#
#  121 PHE  HN          120 GLU  HB+         5.50    (#   4024:20  Unique         2.26, 3.22 A)
 &rst
  ixpk= 4024, nxpk= 20, iat=1951,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1940,1941,
 &end
#
#  120 GLU  HN          120 GLU  HB-         5.50    (#   4025:20  Unique         2.35, 3.41 A)
 &rst
  ixpk= 4025, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1940,1941,
 &end
#
#    0 AMB  20-2:4026     0 AMB  20-1:4026   4.50    (#   4026:20  Double Ambig)
 &rst
  ixpk= 4026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 482, 458,1936,
 igr2= 418, 419, 418, 419,1940,1941,
 &end
#
#   28 PHE  HD          120 GLU  HB-         5.50    (#   4028:20  Unique         4.85, 7.27 A)
 &rst
  ixpk= 4028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2=1940,1941,
 &end
#
#   28 PHE  HD            0 AMB  20-1:4029   5.50    (#   4029:20  Single Ambig)
 &rst
  ixpk= 4029, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 446, 454,
 igr2= 418, 419,1940,1941,
 &end
#
#  134 ARG  HN          134 ARG  HB-         5.50    (#   4030:20  Unique         2.46, 3.24 A)
 &rst
  ixpk= 4030, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2189,2190,
 &end
#
#  119 PRO  HA          120 GLU  HB-         5.50    (#   4031:20  Unique         4.22, 5.29 A)
 &rst
  ixpk= 4031, nxpk= 20, iat=1932,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1940,1941,
 &end
#
#  120 GLU  HA          120 GLU  HB-         5.50    (#   4032:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 4032, nxpk= 20, iat=1938,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1940,1941,
 &end
#
#  120 GLU  HA          120 GLU  HB+         4.50    (#   4033:20  Unique         2.31, 2.70 A)
 &rst
  ixpk= 4033, nxpk= 20, iat=1938,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1940,1941,
 &end
#
#    0 AMB  20-2:4034     0 AMB  20-1:4034   5.50    (#   4034:20  Double Ambig)
 &rst
  ixpk= 4034, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 467,1932,
 igr2= 418, 419,1940,1941,
 &end
#
#    0 AMB  20-2:4035   120 GLU  HB-         4.50    (#   4035:20  Single Ambig)
 &rst
  ixpk= 4035, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1943,1944, 418, 419,
 igr2=1940,1941,
 &end
#
#  120 GLU  HG-         120 GLU  HB-         5.50    (#   4036:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 4036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1943,1944,
 igr2=1940,1941,
 &end
#
#  120 GLU  HB-         120 GLU  HG+         4.50    (#   4037:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 4037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1940,1941,
 igr2=1943,1944,
 &end
#
#  120 GLU  HB-         120 GLU  HG-         4.50    (#   4038:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 4038, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1940,1941,
 igr2=1943,1944,
 &end
#
#  120 GLU  HB+         120 GLU  HG+         3.50    (#   4039:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 4039, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1940,1941,
 igr2=1943,1944,
 &end
#
#  120 GLU  HB+         120 GLU  HG-         5.50    (#   4040:20  Unique         2.21, 2.65 A)
 &rst
  ixpk= 4040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1940,1941,
 igr2=1943,1944,
 &end
#
#    0 AMB  20-2:4041     0 AMB  20-1:4041   5.50    (#   4041:20  Double Ambig)
 &rst
  ixpk= 4041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 424, 425, 881, 882,
 igr2=1943,1944,1943,1944,
 &end
#
#    0 AMB  20-2:4042   120 GLU  HG-         5.50    (#   4042:20  Single Ambig)
 &rst
  ixpk= 4042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 424, 425, 881, 882,
 igr2=1943,1944,
 &end
#
#   27 ARG  HD+         120 GLU  HG+         5.50    (#   4043:20  Unique         2.51, 5.74 A)
 &rst
  ixpk= 4043, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2=1943,1944,
 &end
#
#   27 ARG  HD+         120 GLU  HG-         5.50    (#   4044:20  Unique         2.51, 5.74 A)
 &rst
  ixpk= 4044, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2=1943,1944,
 &end
#
#  120 GLU  HA          120 GLU  HG-         5.50    (#   4045:20  Unique         2.07, 3.26 A)
 &rst
  ixpk= 4045, nxpk= 20, iat=1938,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1943,1944,
 &end
#
#  120 GLU  HA          120 GLU  HG+         5.50    (#   4046:20  Unique         2.07, 3.26 A)
 &rst
  ixpk= 4046, nxpk= 20, iat=1938,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1943,1944,
 &end
#
#    0 AMB  20-2:4047     0 AMB  20-1:4047   5.50    (#   4047:20  Double Ambig)
 &rst
  ixpk= 4047, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 369,2209,
 igr2=2162,2163,2162,2163,
 &end
#
#   28 PHE  HD          120 GLU  HG+         4.50    (#   4048:20  Unique         4.58, 7.92 A)
 &rst
  ixpk= 4048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 446, 454,
 igr2=1943,1944,
 &end
#
#  120 GLU  HN          120 GLU  HG+         5.50    (#   4049:20  Unique         2.14, 3.88 A)
 &rst
  ixpk= 4049, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1943,1944,
 &end
#
#  120 GLU  HN          120 GLU  HG-         5.50    (#   4050:20  Unique         2.14, 3.88 A)
 &rst
  ixpk= 4050, nxpk= 20, iat=1936,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1943,1944,
 &end
#
#  121 PHE  HN          121 PHE  HA          5.50    (#   4051:20  Unique         2.84, 2.93 A)
 &rst
  ixpk= 4051, nxpk= 20, iat=1951,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HN          121 PHE  HA          5.50    (#   4052:20  Unique         2.16, 2.35 A)
 &rst
  ixpk= 4052, nxpk= 20, iat=1971,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HN          121 PHE  HA          5.50    (#   4053:20  Unique         1.85, 2.31 A)
 &rst
  ixpk= 4053, nxpk= 20, iat= 438,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HN          121 PHE  HA          5.50    (#   4054:20  Unique         3.67, 4.16 A)
 &rst
  ixpk= 4054, nxpk= 20, iat=1983,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HA          121 PHE  HA          5.50    (#   4056:20  Unique         1.86, 2.16 A)
 &rst
  ixpk= 4056, nxpk= 20, iat= 416,1953, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HB+         121 PHE  HA          5.50    (#   4057:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 4057, nxpk= 20, iat=  -1,1953, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#  121 PHE  HB-         121 PHE  HA          5.50    (#   4058:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 4058, nxpk= 20, iat=  -1,1953, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#   25 ALA  MB          121 PHE  HB+         5.50    (#   4059:20  Unique         1.98, 3.31 A)
 &rst
  ixpk= 4059, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 384, 385, 386,
 igr2=1955,1956,
 &end
#
#  123 GLY  HN          121 PHE  HB+         5.50    (#   4061:20  Unique         2.34, 3.46 A)
 &rst
  ixpk= 4061, nxpk= 20, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1955,1956,
 &end
#
#  122 ASP  HN          121 PHE  HB+         5.50    (#   4062:20  Unique         2.14, 3.19 A)
 &rst
  ixpk= 4062, nxpk= 20, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1955,1956,
 &end
#
#  121 PHE  HA          121 PHE  HB+         5.50    (#   4064:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 4064, nxpk= 20, iat=1953,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1955,1956,
 &end
#
#    0 AMB  20-2:4065     0 AMB  20-1:4065   5.50    (#   4065:20  Double Ambig)
 &rst
  ixpk= 4065, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1842,1843,1842,1843,
 igr2=1955,1956,1955,1956,
 &end
#
#  122 ASP  HA          122 ASP  HB+         5.50    (#   4066:20  Unique         2.32, 2.72 A)
 &rst
  ixpk= 4066, nxpk= 20, iat=1973,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1975,1976,
 &end
#
#   28 PHE  HA          122 ASP  HB-         5.50    (#   4067:20  Unique         2.26, 3.73 A)
 &rst
  ixpk= 4067, nxpk= 20, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1975,1976,
 &end
#
#  122 ASP  HA          122 ASP  HB-         5.50    (#   4069:20  Unique         2.32, 2.72 A)
 &rst
  ixpk= 4069, nxpk= 20, iat=1973,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1975,1976,
 &end
#
#   28 PHE  HD          122 ASP  HB-         5.50    (#   4070:20  Unique         3.24, 5.21 A)
 &rst
  ixpk= 4070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 446, 454,
 igr2=1975,1976,
 &end
#
#   28 PHE  HE          122 ASP  HB-         5.50    (#   4071:20  Unique         3.28, 6.92 A)
 &rst
  ixpk= 4071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 448, 452,
 igr2=1975,1976,
 &end
#
#  122 ASP  HN          122 ASP  HB+         5.50    (#   4072:20  Unique         2.25, 2.98 A)
 &rst
  ixpk= 4072, nxpk= 20, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1975,1976,
 &end
#
#  122 ASP  HN          122 ASP  HB-         5.50    (#   4073:20  Unique         2.25, 2.98 A)
 &rst
  ixpk= 4073, nxpk= 20, iat=1971,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1975,1976,
 &end
#
#    0 AMB  20-2:4074   122 ASP  HB-         5.50    (#   4074:20  Single Ambig)
 &rst
  ixpk= 4074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 458,1936, 482,
 igr2=1975,1976,
 &end
#
#  124 TRP  HN          123 GLY  HA-         4.50    (#   4075:20  Unique         2.18, 2.58 A)
 &rst
  ixpk= 4075, nxpk= 20, iat=1990,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1985,1986,
 &end
#
#  124 TRP  HN          123 GLY  HA+         4.50    (#   4076:20  Unique         2.18, 2.58 A)
 &rst
  ixpk= 4076, nxpk= 20, iat=1990,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1985,1986,
 &end
#
#  123 GLY  HN          123 GLY  HA+         5.50    (#   4077:20  Unique         2.29, 2.57 A)
 &rst
  ixpk= 4077, nxpk= 20, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1985,1986,
 &end
#
#  123 GLY  HN          123 GLY  HA-         5.50    (#   4078:20  Unique         2.29, 2.57 A)
 &rst
  ixpk= 4078, nxpk= 20, iat=1983,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1985,1986,
 &end
#
#  125 ARG  HN          124 TRP  HA          5.50    (#   4081:20  Unique         2.49, 3.04 A)
 &rst
  ixpk= 4081, nxpk= 20, iat=2014,1992, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HN          124 TRP  HA          5.50    (#   4082:20  Unique         2.66, 2.77 A)
 &rst
  ixpk= 4082, nxpk= 20, iat=1990,1992, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HN          124 TRP  HA          5.50    (#   4083:20  Unique         3.89, 5.78 A)
 &rst
  ixpk= 4083, nxpk= 20, iat= 390,1992, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HA          124 TRP  HA          5.50    (#   4085:20  Unique         4.60, 4.97 A)
 &rst
  ixpk= 4085, nxpk= 20, iat= 382,1992, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HB-         124 TRP  HA          5.50    (#   4086:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 4086, nxpk= 20, iat=  -1,1992, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  124 TRP  HB+         124 TRP  HA          5.50    (#   4087:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 4087, nxpk= 20, iat=  -1,1992, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  113 MET  ME          124 TRP  HA          5.50    (#   4088:20  Unique         1.99, 3.80 A)
 &rst
  ixpk= 4088, nxpk= 20, iat=  -1,1992, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1849,1850,1851,
 &end
#
#   25 ALA  MB          124 TRP  HA          5.50    (#   4089:20  Unique         4.79, 6.15 A)
 &rst
  ixpk= 4089, nxpk= 20, iat=  -1,1992, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#   25 ALA  MB          124 TRP  HB+         5.50    (#   4090:20  Unique         3.38, 7.24 A)
 &rst
  ixpk= 4090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 384, 385, 386,
 igr2=1994,1995,
 &end
#
#   25 ALA  MB          124 TRP  HB-         5.50    (#   4091:20  Unique         3.38, 7.24 A)
 &rst
  ixpk= 4091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 384, 385, 386,
 igr2=1994,1995,
 &end
#
#    0 AMB  20-2:4092     0 AMB  20-1:4092   5.50    (#   4092:20  Double Ambig)
 &rst
  ixpk= 4092, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 igr2=1994,1995,1994,1995,1994,1995,
 &end
#
#    0 AMB  20-2:4093     0 AMB  20-1:4093   5.50    (#   4093:20  Double Ambig)
 &rst
  ixpk= 4093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=1849,1850,1851,1182,1842,1843,1842,1843,
 igr2=1994,1995,1620,1621,
 &end
#
#  124 TRP  HA          124 TRP  HB+         5.50    (#   4094:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 4094, nxpk= 20, iat=1992,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1994,1995,
 &end
#
#  124 TRP  HA          124 TRP  HB-         5.50    (#   4095:20  Unique         2.27, 2.52 A)
 &rst
  ixpk= 4095, nxpk= 20, iat=1992,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1994,1995,
 &end
#
#  124 TRP  HN          124 TRP  HB-         5.50    (#   4100:20  Unique         2.75, 3.73 A)
 &rst
  ixpk= 4100, nxpk= 20, iat=1990,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1994,1995,
 &end
#
#  125 ARG  HN          124 TRP  HB-         5.50    (#   4101:20  Unique         1.82, 4.03 A)
 &rst
  ixpk= 4101, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1994,1995,
 &end
#
#  125 ARG  HN          124 TRP  HB+         5.50    (#   4102:20  Unique         1.82, 4.03 A)
 &rst
  ixpk= 4102, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1994,1995,
 &end
#
#  127 VAL  MGY         125 ARG  HB+         5.50    (#   4105:20  Unique         4.14, 7.72 A)
 &rst
  ixpk= 4105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2018,2019,
 &end
#
#  127 VAL  MGY         125 ARG  HB-         5.50    (#   4106:20  Unique         4.14, 7.72 A)
 &rst
  ixpk= 4106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2018,2019,
 &end
#
#  125 ARG  HA          125 ARG  HB-         5.50    (#   4107:20  Unique         2.24, 2.64 A)
 &rst
  ixpk= 4107, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  125 ARG  HA          125 ARG  HB+         5.50    (#   4108:20  Unique         2.24, 2.64 A)
 &rst
  ixpk= 4108, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#   33 TRP  HH2         125 ARG  HB+         5.50    (#   4111:20  Unique         2.35, 4.27 A)
 &rst
  ixpk= 4111, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#   33 TRP  HH2         125 ARG  HB-         5.50    (#   4112:20  Unique         2.35, 4.27 A)
 &rst
  ixpk= 4112, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#    0 AMB  20-2:4113     0 AMB  20-1:4113   5.50    (#   4113:20  Double Ambig)
 &rst
  ixpk= 4113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2696,1594,
 igr2=2700,2701,1581,1582,
 &end
#
#  164 LYS  HN          164 LYS  HB-         5.50    (#   4114:20  Unique         2.06, 2.84 A)
 &rst
  ixpk= 4114, nxpk= 20, iat=2696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2700,2701,
 &end
#
#  126 TRP  HN          125 ARG  HB+         5.50    (#   4115:20  Unique         2.14, 3.71 A)
 &rst
  ixpk= 4115, nxpk= 20, iat=2038,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  126 TRP  HN          125 ARG  HB-         5.50    (#   4116:20  Unique         2.14, 3.71 A)
 &rst
  ixpk= 4116, nxpk= 20, iat=2038,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  125 ARG  HN          125 ARG  HB+         5.50    (#   4117:20  Unique         2.42, 3.29 A)
 &rst
  ixpk= 4117, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2018,2019,
 &end
#
#  125 ARG  HN          125 ARG  HG+         5.50    (#   4119:20  Unique         2.58, 4.15 A)
 &rst
  ixpk= 4119, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  125 ARG  HN          125 ARG  HG-         5.50    (#   4120:20  Unique         2.58, 4.15 A)
 &rst
  ixpk= 4120, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  126 TRP  HN          125 ARG  HG+         5.50    (#   4121:20  Unique         2.08, 3.30 A)
 &rst
  ixpk= 4121, nxpk= 20, iat=2038,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  126 TRP  HN          125 ARG  HG-         5.50    (#   4122:20  Unique         2.08, 3.30 A)
 &rst
  ixpk= 4122, nxpk= 20, iat=2038,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  125 ARG  HA          125 ARG  HG+         5.50    (#   4123:20  Unique         2.10, 3.24 A)
 &rst
  ixpk= 4123, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  125 ARG  HA          125 ARG  HG-         5.50    (#   4124:20  Unique         2.10, 3.24 A)
 &rst
  ixpk= 4124, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2021,2022,
 &end
#
#  125 ARG  HD-         125 ARG  HG+         5.50    (#   4125:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2024,2025,
 igr2=2021,2022,
 &end
#
#  125 ARG  HD+         125 ARG  HG-         5.50    (#   4126:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4126, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2024,2025,
 igr2=2021,2022,
 &end
#
#  125 ARG  HB+         125 ARG  HG-         5.50    (#   4127:20  Unique         2.21, 2.70 A)
 &rst
  ixpk= 4127, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2018,2019,
 igr2=2021,2022,
 &end
#
#  127 VAL  MGY         125 ARG  HG-         5.50    (#   4128:20  Unique         3.14, 6.68 A)
 &rst
  ixpk= 4128, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2021,2022,
 &end
#
#  127 VAL  MGY         125 ARG  HG+         5.50    (#   4129:20  Unique         3.14, 6.68 A)
 &rst
  ixpk= 4129, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2021,2022,
 &end
#
#  127 VAL  MGY         125 ARG  HD+         5.50    (#   4130:20  Unique         3.59, 7.44 A)
 &rst
  ixpk= 4130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2024,2025,
 &end
#
#  127 VAL  MGY         125 ARG  HD-         5.50    (#   4131:20  Unique         3.59, 7.44 A)
 &rst
  ixpk= 4131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2024,2025,
 &end
#
#  125 ARG  HG-         125 ARG  HD+         5.50    (#   4132:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2021,2022,
 igr2=2024,2025,
 &end
#
#  125 ARG  HG-         125 ARG  HD-         5.50    (#   4133:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2021,2022,
 igr2=2024,2025,
 &end
#
#  125 ARG  HB+         125 ARG  HD+         4.50    (#   4134:20  Unique         2.01, 2.99 A)
 &rst
  ixpk= 4134, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2018,2019,
 igr2=2024,2025,
 &end
#
#  125 ARG  HB+         125 ARG  HD-         4.50    (#   4135:20  Unique         2.01, 2.99 A)
 &rst
  ixpk= 4135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2018,2019,
 igr2=2024,2025,
 &end
#
#  125 ARG  HB-         125 ARG  HD+         4.50    (#   4136:20  Unique         2.01, 2.99 A)
 &rst
  ixpk= 4136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2018,2019,
 igr2=2024,2025,
 &end
#
#  125 ARG  HB-         125 ARG  HD-         4.50    (#   4137:20  Unique         2.01, 2.99 A)
 &rst
  ixpk= 4137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2018,2019,
 igr2=2024,2025,
 &end
#
#  125 ARG  HG+         125 ARG  HD+         5.50    (#   4138:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4138, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2021,2022,
 igr2=2024,2025,
 &end
#
#  125 ARG  HG+         125 ARG  HD-         4.50    (#   4139:20  Unique         2.22, 2.68 A)
 &rst
  ixpk= 4139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2021,2022,
 igr2=2024,2025,
 &end
#
#  125 ARG  HA          125 ARG  HD+         5.50    (#   4140:20  Unique         2.08, 4.43 A)
 &rst
  ixpk= 4140, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#  125 ARG  HA          125 ARG  HD-         5.50    (#   4141:20  Unique         2.08, 4.43 A)
 &rst
  ixpk= 4141, nxpk= 20, iat=2016,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#  125 ARG  HE          125 ARG  HD+         5.50    (#   4144:20  Unique         2.27, 2.73 A)
 &rst
  ixpk= 4144, nxpk= 20, iat=2027,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#  125 ARG  HE          125 ARG  HD-         5.50    (#   4145:20  Unique         2.27, 2.73 A)
 &rst
  ixpk= 4145, nxpk= 20, iat=2027,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#   33 TRP  HH2         125 ARG  HD+         5.50    (#   4146:20  Unique         2.12, 5.17 A)
 &rst
  ixpk= 4146, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#   33 TRP  HH2         125 ARG  HD-         5.50    (#   4147:20  Unique         2.12, 5.17 A)
 &rst
  ixpk= 4147, nxpk= 20, iat= 525,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#  125 ARG  HN          125 ARG  HD-         5.50    (#   4148:20  Unique         4.42, 5.32 A)
 &rst
  ixpk= 4148, nxpk= 20, iat=2014,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2024,2025,
 &end
#
#  127 VAL  HN          126 TRP  HA          4.50    (#   4149:20  Unique         2.41, 2.49 A)
 &rst
  ixpk= 4149, nxpk= 20, iat=2062,2040, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 TRP  HN          126 TRP  HA          5.50    (#   4150:20  Unique         2.42, 2.88 A)
 &rst
  ixpk= 4150, nxpk= 20, iat= 356,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 VAL  HN          126 TRP  HA          5.50    (#   4151:20  Unique         4.09, 5.02 A)
 &rst
  ixpk= 4151, nxpk= 20, iat= 323,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HN          126 TRP  HA          5.50    (#   4152:20  Unique         2.88, 2.92 A)
 &rst
  ixpk= 4152, nxpk= 20, iat=2038,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HD1         126 TRP  HA          5.50    (#   4154:20  Unique         4.42, 4.80 A)
 &rst
  ixpk= 4154, nxpk= 20, iat=2046,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  127 VAL  HA          126 TRP  HA          5.50    (#   4155:20  Unique         4.43, 4.51 A)
 &rst
  ixpk= 4155, nxpk= 20, iat=2064,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HA          126 TRP  HA          5.50    (#   4156:20  Unique         3.33, 3.91 A)
 &rst
  ixpk= 4156, nxpk= 20, iat= 341,2040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4157   126 TRP  HA          5.50    (#   4157:20  Single Ambig)
 &rst
  ixpk= 4157, nxpk= 20, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2042,2043,2042,2043,
 &end
#
#   21 GLN  HB+         126 TRP  HA          5.50    (#   4158:20  Unique         3.53, 5.23 A)
 &rst
  ixpk= 4158, nxpk= 20, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 310, 311,
 &end
#
#    0 AMB  20-2:4159   126 TRP  HA          5.50    (#   4159:20  Single Ambig)
 &rst
  ixpk= 4159, nxpk= 20, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 310, 311,2018,2019,
 &end
#
#  127 VAL  MGX         126 TRP  HA          5.50    (#   4160:20  Unique         3.22, 4.93 A)
 &rst
  ixpk= 4160, nxpk= 20, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY         126 TRP  HA          5.50    (#   4161:20  Unique         3.22, 4.93 A)
 &rst
  ixpk= 4161, nxpk= 20, iat=  -1,2040, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4162     0 AMB  20-1:4162   5.50    (#   4162:20  Double Ambig)
 &rst
  ixpk= 4162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 310, 311, 310, 311,
 igr2=2042,2043,2042,2043,
 &end
#
#  126 TRP  HA            0 AMB  20-1:4163   5.50    (#   4163:20  Single Ambig)
 &rst
  ixpk= 4163, nxpk= 20, iat=2040,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2042,2043,2042,2043,
 &end
#
#  126 TRP  HD1           0 AMB  20-1:4165   5.50    (#   4165:20  Single Ambig)
 &rst
  ixpk= 4165, nxpk= 20, iat=2046,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2042,2043,2042,2043,
 &end
#
#  126 TRP  HN            0 AMB  20-1:4166   5.50    (#   4166:20  Single Ambig)
 &rst
  ixpk= 4166, nxpk= 20, iat=2038,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2042,2043,2042,2043,
 &end
#
#  127 VAL  HN          127 VAL  HB          5.50    (#   4167:20  Unique         3.12, 3.69 A)
 &rst
  ixpk= 4167, nxpk= 20, iat=2062,2066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 SER  HN          127 VAL  HB          5.50    (#   4168:20  Unique         1.90, 2.81 A)
 &rst
  ixpk= 4168, nxpk= 20, iat=2078,2066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4169   127 VAL  HB          5.50    (#   4169:20  Single Ambig)
 &rst
  ixpk= 4169, nxpk= 20, iat=  -1,2066, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2142,2151, 364,
 &end
#
#  127 VAL  HA          127 VAL  HB          5.50    (#   4170:20  Unique         2.40, 2.51 A)
 &rst
  ixpk= 4170, nxpk= 20, iat=2064,2066, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4171   127 VAL  HB          5.50    (#   4171:20  Single Ambig)
 &rst
  ixpk= 4171, nxpk= 20, iat=  -1,2066, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2082,2083,2082,2083,
 &end
#
#    0 AMB  20-2:4172   127 VAL  HB          5.50    (#   4172:20  Single Ambig)
 &rst
  ixpk= 4172, nxpk= 20, iat=  -1,2066, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2138,2139,2138,2139,
 &end
#
#  127 VAL  MGX         127 VAL  HB          5.50    (#   4173:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4173, nxpk= 20, iat=  -1,2066, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY         127 VAL  HB          5.50    (#   4174:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4174, nxpk= 20, iat=  -1,2066, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   22 VAL  MGX         127 VAL  MGX         4.50    (#   4176:20  Unique         1.99, 6.61 A)
 &rst
  ixpk= 4176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  132 PRO  HB+         127 VAL  MGX         5.50    (#   4177:20  Unique         1.93, 5.09 A)
 &rst
  ixpk= 4177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2162,2163,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4178   127 VAL  MGX         4.50    (#   4178:20  Single Ambig)
 &rst
  ixpk= 4178, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2159,2160,2066,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4179   127 VAL  MGX         5.50    (#   4179:20  Single Ambig)
 &rst
  ixpk= 4179, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2138,2139,2138,2139,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HB-         127 VAL  MGX         5.50    (#   4180:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 4180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 360, 361,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HB+         127 VAL  MGX         5.50    (#   4181:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 4181, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 360, 361,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  HA          127 VAL  MGX         5.50    (#   4182:20  Unique         2.06, 3.45 A)
 &rst
  ixpk= 4182, nxpk= 20, iat=2064,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4183   127 VAL  MGX         5.50    (#   4183:20  Single Ambig)
 &rst
  ixpk= 4183, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2142,2151, 364,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  131 TYR  HN          127 VAL  MGX         5.50    (#   4184:20  Unique         3.30, 6.11 A)
 &rst
  ixpk= 4184, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  128 SER  HN          127 VAL  MGX         5.50    (#   4185:20  Unique         1.94, 4.11 A)
 &rst
  ixpk= 4185, nxpk= 20, iat=2078,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  HN          127 VAL  MGX         5.50    (#   4186:20  Unique         2.13, 3.70 A)
 &rst
  ixpk= 4186, nxpk= 20, iat=2062,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HE1         127 VAL  MGY         5.50    (#   4187:20  Unique         3.28, 5.19 A)
 &rst
  ixpk= 4187, nxpk= 20, iat= 366,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  HN          127 VAL  MGY         5.50    (#   4188:20  Unique         2.13, 3.70 A)
 &rst
  ixpk= 4188, nxpk= 20, iat=2062,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HN          127 VAL  MGY         5.50    (#   4189:20  Unique         3.93, 6.13 A)
 &rst
  ixpk= 4189, nxpk= 20, iat= 356,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  128 SER  HN          127 VAL  MGY         5.50    (#   4190:20  Unique         1.94, 4.11 A)
 &rst
  ixpk= 4190, nxpk= 20, iat=2078,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4191   127 VAL  MGY         4.50    (#   4191:20  Single Ambig)
 &rst
  ixpk= 4191, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2142,2151, 364,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4192   127 VAL  MGY         4.50    (#   4192:20  Single Ambig)
 &rst
  ixpk= 4192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2144,2149,2027,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4193   127 VAL  MGY         5.50    (#   4193:20  Single Ambig)
 &rst
  ixpk= 4193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2040, 358,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  HA          127 VAL  MGY         4.50    (#   4194:20  Unique         2.06, 3.45 A)
 &rst
  ixpk= 4194, nxpk= 20, iat=2064,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HB+         127 VAL  MGY         5.50    (#   4195:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 4195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 360, 361,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HB-         127 VAL  MGY         5.50    (#   4196:20  Unique         1.98, 4.43 A)
 &rst
  ixpk= 4196, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 360, 361,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4197   127 VAL  MGY         5.50    (#   4197:20  Single Ambig)
 &rst
  ixpk= 4197, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2138,2139,2138,2139,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4198   127 VAL  MGY         3.50    (#   4198:20  Single Ambig)
 &rst
  ixpk= 4198, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2159,2160,2066,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#    0 AMB  20-2:4199   127 VAL  MGY         4.50    (#   4199:20  Single Ambig)
 &rst
  ixpk= 4199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=2021,2022,2459,2460,2461,
 igr2=2068,2069,2070,2072,2073,2074,
 &end
#
#   22 VAL  MGY          14 VAL  MGY         3.50    (#   4201:20  Unique         2.08, 6.17 A)
 &rst
  ixpk= 4201, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2= 204, 205, 206, 208, 209, 210,
 &end
#
#  129 TYR  HA          128 SER  HA          5.50    (#   4202:20  Unique         4.29, 4.35 A)
 &rst
  ixpk= 4202, nxpk= 20, iat=2091,2080, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4203   128 SER  HA          4.50    (#   4203:20  Single Ambig)
 &rst
  ixpk= 4203, nxpk= 20, iat=  -1,2080, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2082,2083,2082,2083,
 &end
#
#  128 SER  HN          128 SER  HA          5.50    (#   4205:20  Unique         2.72, 2.77 A)
 &rst
  ixpk= 4205, nxpk= 20, iat=2078,2080, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HN          128 SER  HA          4.50    (#   4206:20  Unique         2.20, 2.46 A)
 &rst
  ixpk= 4206, nxpk= 20, iat=2089,2080, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 TYR  HN            0 AMB  20-1:4207   4.50    (#   4207:20  Single Ambig)
 &rst
  ixpk= 4207, nxpk= 20, iat=2089,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2082,2083,2082,2083,
 &end
#
#  128 SER  HN            0 AMB  20-1:4208   3.50    (#   4208:20  Single Ambig)
 &rst
  ixpk= 4208, nxpk= 20, iat=2078,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2082,2083,2082,2083,
 &end
#
#  131 TYR  HN            0 AMB  20-1:4209   5.50    (#   4209:20  Single Ambig)
 &rst
  ixpk= 4209, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2082,2083,2082,2083,
 &end
#
#  130 TRP  HN            0 AMB  20-1:4210   5.50    (#   4210:20  Single Ambig)
 &rst
  ixpk= 4210, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2082,2083,2082,2083,
 &end
#
#  128 SER  HA            0 AMB  20-1:4212   3.50    (#   4212:20  Single Ambig)
 &rst
  ixpk= 4212, nxpk= 20, iat=2080,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2082,2083,2082,2083,
 &end
#
#  130 TRP  HB-           0 AMB  20-1:4213   5.50    (#   4213:20  Single Ambig)
 &rst
  ixpk= 4213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2114,2115,
 igr2=2082,2083,2082,2083,
 &end
#
#  131 TYR  HB-           0 AMB  20-1:4214   5.50    (#   4214:20  Single Ambig)
 &rst
  ixpk= 4214, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2138,2139,
 igr2=2082,2083,2082,2083,
 &end
#
#    0 AMB  20-2:4215     0 AMB  20-1:4215   5.50    (#   4215:20  Double Ambig)
 &rst
  ixpk= 4215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2066,2159,2160,
 igr2=2082,2083,2082,2083,
 &end
#
#  127 VAL  MGX           0 AMB  20-1:4216   5.50    (#   4216:20  Single Ambig)
 &rst
  ixpk= 4216, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2082,2083,2082,2083,
 &end
#
#  127 VAL  MGY           0 AMB  20-1:4217   5.50    (#   4217:20  Single Ambig)
 &rst
  ixpk= 4217, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2082,2083,2082,2083,
 &end
#
#   22 VAL  MGX         129 TYR  HA          4.50    (#   4218:20  Unique         2.00, 4.72 A)
 &rst
  ixpk= 4218, nxpk= 20, iat=  -1,2091, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  148 MET  ME          129 TYR  HA          5.50    (#   4219:20  Unique         2.60, 4.32 A)
 &rst
  ixpk= 4219, nxpk= 20, iat=  -1,2091, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2459,2460,2461,
 &end
#
#  129 TYR  HB-         129 TYR  HA          5.50    (#   4220:20  Unique         2.59, 2.83 A)
 &rst
  ixpk= 4220, nxpk= 20, iat=  -1,2091, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#  129 TYR  HB+         129 TYR  HA          5.50    (#   4221:20  Unique         2.59, 2.83 A)
 &rst
  ixpk= 4221, nxpk= 20, iat=  -1,2091, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#  129 TYR  HD          129 TYR  HA          5.50    (#   4222:20  Unique         1.85, 3.28 A)
 &rst
  ixpk= 4222, nxpk= 20, iat=  -1,2091, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2097,2106,
 &end
#
#  130 TRP  HN          129 TYR  HA          5.50    (#   4223:20  Unique         2.20, 2.94 A)
 &rst
  ixpk= 4223, nxpk= 20, iat=2110,2091, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HN          129 TYR  HA          4.50    (#   4224:20  Unique         2.27, 2.84 A)
 &rst
  ixpk= 4224, nxpk= 20, iat=2089,2091, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 TYR  HB-         128 SER  HA          5.50    (#   4225:20  Unique         3.87, 4.81 A)
 &rst
  ixpk= 4225, nxpk= 20, iat=  -1,2080, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#  131 TYR  HD            0 AMB  20-1:4226   5.50    (#   4226:20  Single Ambig)
 &rst
  ixpk= 4226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2142,2151,
 igr2=2082,2083,2082,2083,
 &end
#
#  129 TYR  HN          129 TYR  HB+         5.50    (#   4227:20  Unique         2.08, 2.68 A)
 &rst
  ixpk= 4227, nxpk= 20, iat=2089,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#  129 TYR  HN          129 TYR  HB-         5.50    (#   4228:20  Unique         2.08, 2.68 A)
 &rst
  ixpk= 4228, nxpk= 20, iat=2089,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#  130 TRP  HN          129 TYR  HB-         5.50    (#   4229:20  Unique         2.11, 3.58 A)
 &rst
  ixpk= 4229, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#  130 TRP  HN          129 TYR  HB+         5.50    (#   4230:20  Unique         2.11, 3.58 A)
 &rst
  ixpk= 4230, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#  129 TYR  HD          129 TYR  HB+         5.50    (#   4231:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 4231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2097,2106,
 igr2=2093,2094,
 &end
#
#  129 TYR  HD          129 TYR  HB-         5.50    (#   4232:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 4232, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2097,2106,
 igr2=2093,2094,
 &end
#
#  129 TYR  HA          129 TYR  HB+         5.50    (#   4233:20  Unique         2.59, 2.83 A)
 &rst
  ixpk= 4233, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#  129 TYR  HA          129 TYR  HB-         5.50    (#   4234:20  Unique         2.59, 2.83 A)
 &rst
  ixpk= 4234, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2093,2094,
 &end
#
#   22 VAL  MGY         129 TYR  HB-         5.50    (#   4235:20  Unique         4.19, 7.00 A)
 &rst
  ixpk= 4235, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2093,2094,
 &end
#
#    0 AMB  20-2:4236     0 AMB  20-1:4236   5.50    (#   4236:20  Double Ambig)
 &rst
  ixpk= 4236, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.21, r4=12.71,
 igr1= 329, 330, 331, 333, 334, 335, 329, 330, 331, 333,
       334, 335, 949, 950,1006,1007,1008,1010,1011,1012,
      
 igr2=2093,2094,2093,2094, 843, 844,
 &end
#
#  130 TRP  HB-         130 TRP  HA          5.50    (#   4237:20  Unique         2.31, 2.68 A)
 &rst
  ixpk= 4237, nxpk= 20, iat=  -1,2112, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2114,2115,
 &end
#
#    0 AMB  20-2:4238   130 TRP  HA          5.50    (#   4238:20  Single Ambig)
 &rst
  ixpk= 4238, nxpk= 20, iat=  -1,2112, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2114,2115,2156,2157,
 &end
#
#  129 TYR  HD          130 TRP  HA          5.50    (#   4239:20  Unique         3.39, 5.71 A)
 &rst
  ixpk= 4239, nxpk= 20, iat=  -1,2112, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2097,2106,
 &end
#
#  130 TRP  HN          130 TRP  HA          5.50    (#   4240:20  Unique         2.28, 2.67 A)
 &rst
  ixpk= 4240, nxpk= 20, iat=2110,2112, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 ILE  HN            7 TYR  HA          5.50    (#   4241:20  Unique         3.66, 4.12 A)
 &rst
  ixpk= 4241, nxpk= 20, iat=1512,  85, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HN          130 TRP  HB+         5.50    (#   4242:20  Unique         2.70, 3.55 A)
 &rst
  ixpk= 4242, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  130 TRP  HN          130 TRP  HB-         5.50    (#   4243:20  Unique         2.70, 3.55 A)
 &rst
  ixpk= 4243, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  130 TRP  HD1         130 TRP  HB-         5.50    (#   4244:20  Unique         2.55, 3.16 A)
 &rst
  ixpk= 4244, nxpk= 20, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  130 TRP  HD1         130 TRP  HB+         5.50    (#   4245:20  Unique         2.55, 3.16 A)
 &rst
  ixpk= 4245, nxpk= 20, iat=2118,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  130 TRP  HA          130 TRP  HB+         5.50    (#   4248:20  Unique         2.31, 2.68 A)
 &rst
  ixpk= 4248, nxpk= 20, iat=2112,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  130 TRP  HA          130 TRP  HB-         5.50    (#   4249:20  Unique         2.31, 2.68 A)
 &rst
  ixpk= 4249, nxpk= 20, iat=2112,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2114,2115,
 &end
#
#  133 VAL  MGY         130 TRP  HB+         5.50    (#   4250:20  Unique         1.94, 5.26 A)
 &rst
  ixpk= 4250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2114,2115,
 &end
#
#  131 TYR  HB-         131 TYR  HA          4.50    (#   4251:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 4251, nxpk= 20, iat=  -1,2136, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2138,2139,
 &end
#
#    0 AMB  20-2:4252     0 AMB  20-1:4252   5.50    (#   4252:20  Double Ambig)
 &rst
  ixpk= 4252, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1=2273,2274,1281,1282,2195,2196,2195,2196,
 igr2=2262,2263,2262,2263,2262,2263,2262,2263,
 &end
#
#    0 AMB  20-2:4253   131 TYR  HA          5.50    (#   4253:20  Single Ambig)
 &rst
  ixpk= 4253, nxpk= 20, iat=  -1,2136, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,2114,2115,
 &end
#
#  132 PRO  HD+         131 TYR  HA          5.50    (#   4254:20  Unique         3.71, 3.90 A)
 &rst
  ixpk= 4254, nxpk= 20, iat=  -1,2136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2156,2157,
 &end
#
#  131 TYR  HD          131 TYR  HA          5.50    (#   4255:20  Unique         3.06, 3.66 A)
 &rst
  ixpk= 4255, nxpk= 20, iat=  -1,2136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2142,2151,
 &end
#
#  131 TYR  HN          131 TYR  HA          5.50    (#   4256:20  Unique         2.83, 2.86 A)
 &rst
  ixpk= 4256, nxpk= 20, iat=2134,2136, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  131 TYR  HN          131 TYR  HB+         5.50    (#   4257:20  Unique         2.26, 2.58 A)
 &rst
  ixpk= 4257, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2138,2139,
 &end
#
#  131 TYR  HN          131 TYR  HB-         5.50    (#   4258:20  Unique         2.26, 2.58 A)
 &rst
  ixpk= 4258, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2138,2139,
 &end
#
#  131 TYR  HD          131 TYR  HB+         5.50    (#   4259:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 4259, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2142,2151,
 igr2=2138,2139,
 &end
#
#  131 TYR  HD          131 TYR  HB-         5.50    (#   4260:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 4260, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2142,2151,
 igr2=2138,2139,
 &end
#
#  131 TYR  HA          131 TYR  HB+         5.50    (#   4261:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 4261, nxpk= 20, iat=2136,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2138,2139,
 &end
#
#  131 TYR  HA          131 TYR  HB-         5.50    (#   4262:20  Unique         2.34, 2.70 A)
 &rst
  ixpk= 4262, nxpk= 20, iat=2136,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2138,2139,
 &end
#
#  132 PRO  HD-         131 TYR  HB+         5.50    (#   4263:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2138,2139,
 &end
#
#  132 PRO  HD-         131 TYR  HB-         5.50    (#   4264:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4264, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2138,2139,
 &end
#
#  132 PRO  HD+         131 TYR  HB+         5.50    (#   4265:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4265, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2138,2139,
 &end
#
#  132 PRO  HD+         131 TYR  HB-         5.50    (#   4266:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2138,2139,
 &end
#
#  127 VAL  HB          131 TYR  HB-         5.50    (#   4267:20  Unique         2.14, 3.96 A)
 &rst
  ixpk= 4267, nxpk= 20, iat=2066,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2138,2139,
 &end
#
#  127 VAL  MGX         131 TYR  HB+         5.50    (#   4268:20  Unique         1.98, 4.98 A)
 &rst
  ixpk= 4268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2138,2139,
 &end
#
#  127 VAL  MGX         131 TYR  HB-         5.50    (#   4269:20  Unique         1.98, 4.98 A)
 &rst
  ixpk= 4269, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2138,2139,
 &end
#
#  127 VAL  MGY           0 AMB  20-1:4270   5.50    (#   4270:20  Single Ambig)
 &rst
  ixpk= 4270, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2138,2139,2138,2139,
 &end
#
#  127 VAL  MGY         132 PRO  HA          5.50    (#   4271:20  Unique         3.20, 5.58 A)
 &rst
  ixpk= 4271, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  132 PRO  HB-         132 PRO  HA          5.50    (#   4272:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4272, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2162,2163,
 &end
#
#    0 AMB  20-2:4273   132 PRO  HA          5.50    (#   4273:20  Single Ambig)
 &rst
  ixpk= 4273, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2216,2217,2162,2163,
 &end
#
#    0 AMB  20-2:4274   132 PRO  HA          5.50    (#   4274:20  Single Ambig)
 &rst
  ixpk= 4274, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=2159,2160,2066,2189,2190,
 &end
#
#  135 GLN  HB+         132 PRO  HA          5.50    (#   4275:20  Unique         1.87, 2.56 A)
 &rst
  ixpk= 4275, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2213,2214,
 &end
#
#  131 TYR  HD          132 PRO  HA          5.50    (#   4276:20  Unique         2.67, 4.57 A)
 &rst
  ixpk= 4276, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2142,2151,
 &end
#
#  133 VAL  HN          132 PRO  HA          5.50    (#   4277:20  Unique         3.23, 3.35 A)
 &rst
  ixpk= 4277, nxpk= 20, iat=2169,2165, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4278   132 PRO  HA          5.50    (#   4278:20  Single Ambig)
 &rst
  ixpk= 4278, nxpk= 20, iat=  -1,2165, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2209, 369,
 &end
#
#  136 VAL  HN          132 PRO  HA          5.50    (#   4279:20  Unique         2.62, 3.87 A)
 &rst
  ixpk= 4279, nxpk= 20, iat=2226,2165, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4280   132 PRO  HB-         5.50    (#   4280:20  Single Ambig)
 &rst
  ixpk= 4280, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2169,2373,2378,
 igr2=2162,2163,
 &end
#
#    0 AMB  20-2:4281     0 AMB  20-1:4281   5.50    (#   4281:20  Double Ambig)
 &rst
  ixpk= 4281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2169,2373,2378,
 igr2=2162,2163,2162,2163,2216,2217,
 &end
#
#    0 AMB  20-2:4282   132 PRO  HB-         5.50    (#   4282:20  Single Ambig)
 &rst
  ixpk= 4282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 360, 361,2171,
 igr2=2162,2163,
 &end
#
#  132 PRO  HA            0 AMB  20-1:4283   5.50    (#   4283:20  Single Ambig)
 &rst
  ixpk= 4283, nxpk= 20, iat=2165,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2216,2217,2162,2163,
 &end
#
#  132 PRO  HA          132 PRO  HB-         5.50    (#   4284:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 4284, nxpk= 20, iat=2165,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2162,2163,
 &end
#
#  132 PRO  HG-         132 PRO  HB-         5.50    (#   4285:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 4285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2159,2160,
 igr2=2162,2163,
 &end
#
#  127 VAL  MGY         132 PRO  HB+         5.50    (#   4286:20  Unique         1.93, 5.09 A)
 &rst
  ixpk= 4286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2162,2163,
 &end
#
#  127 VAL  MGX         132 PRO  HG-         5.50    (#   4287:20  Unique         1.96, 5.11 A)
 &rst
  ixpk= 4287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2159,2160,
 &end
#
#  127 VAL  MGX         132 PRO  HG+         5.50    (#   4288:20  Unique         1.96, 5.11 A)
 &rst
  ixpk= 4288, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2159,2160,
 &end
#
#   22 VAL  MGX         132 PRO  HG-         5.50    (#   4289:20  Unique         1.97, 4.15 A)
 &rst
  ixpk= 4289, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,
 igr2=2159,2160,
 &end
#
#    0 AMB  20-2:4290   132 PRO  HG-         5.50    (#   4290:20  Single Ambig)
 &rst
  ixpk= 4290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2162,2163,2175,2176,2177,2179,2180,2181,
 igr2=2159,2160,
 &end
#
#    0 AMB  20-2:4291     0 AMB  20-1:4291   5.50    (#   4291:20  Double Ambig)
 &rst
  ixpk= 4291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=2162,2163,2175,2176,2177,2179,2180,2181,
 igr2=2159,2160,2159,2160,
 &end
#
#    0 AMB  20-2:4292   132 PRO  HG-         5.50    (#   4292:20  Single Ambig)
 &rst
  ixpk= 4292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2459,2460,2461,2162,2163,
 igr2=2159,2160,
 &end
#
#  132 PRO  HA          132 PRO  HG-         5.50    (#   4293:20  Unique         3.85, 3.94 A)
 &rst
  ixpk= 4293, nxpk= 20, iat=2165,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2159,2160,
 &end
#
#  132 PRO  HD-         132 PRO  HG-         5.50    (#   4294:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4294, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2159,2160,
 &end
#
#  132 PRO  HD+         132 PRO  HG+         5.50    (#   4295:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2159,2160,
 &end
#
#  132 PRO  HD+         132 PRO  HG-         5.50    (#   4296:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,
 igr2=2159,2160,
 &end
#
#    0 AMB  20-2:4297   132 PRO  HG-         5.50    (#   4297:20  Single Ambig)
 &rst
  ixpk= 4297, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 369,2209,
 igr2=2159,2160,
 &end
#
#  131 TYR  HN          132 PRO  HD-         5.50    (#   4298:20  Unique         1.64, 2.26 A)
 &rst
  ixpk= 4298, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2156,2157,
 &end
#
#  131 TYR  HN          132 PRO  HD+         5.50    (#   4299:20  Unique         1.64, 2.26 A)
 &rst
  ixpk= 4299, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2156,2157,
 &end
#
#  131 TYR  HB-         132 PRO  HD-         5.50    (#   4300:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4300, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2138,2139,
 igr2=2156,2157,
 &end
#
#  131 TYR  HB-         132 PRO  HD+         5.50    (#   4301:20  Unique         1.79, 2.97 A)
 &rst
  ixpk= 4301, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2138,2139,
 igr2=2156,2157,
 &end
#
#    0 AMB  20-2:4302     0 AMB  20-1:4302   5.50    (#   4302:20  Double Ambig)
 &rst
  ixpk= 4302, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2066,2159,2160,
 igr2=2156,2157,2156,2157,
 &end
#
#    0 AMB  20-2:4303     0 AMB  20-1:4303   5.50    (#   4303:20  Double Ambig)
 &rst
  ixpk= 4303, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=2459,2460,2461,2162,2163,
 igr2=2156,2157,2156,2157,
 &end
#
#    0 AMB  20-2:4304     0 AMB  20-1:4304   5.50    (#   4304:20  Double Ambig)
 &rst
  ixpk= 4304, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.80, r4=10.30,
 igr1=2162,2163,2175,2176,2177,2179,2180,2181,
 igr2=2156,2157,2156,2157,
 &end
#
#    0 AMB  20-2:4305   132 PRO  HD-         5.50    (#   4305:20  Single Ambig)
 &rst
  ixpk= 4305, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2459,2460,2461,2162,2163,
 igr2=2156,2157,
 &end
#
#    0 AMB  20-2:4306   132 PRO  HD-         5.50    (#   4306:20  Single Ambig)
 &rst
  ixpk= 4306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2162,2163,2175,2176,2177,2179,2180,2181,
 igr2=2156,2157,
 &end
#
#  127 VAL  MGX         132 PRO  HD-         5.50    (#   4307:20  Unique         1.98, 4.64 A)
 &rst
  ixpk= 4307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2156,2157,
 &end
#
#  127 VAL  MGX         132 PRO  HD+         5.50    (#   4308:20  Unique         1.98, 4.64 A)
 &rst
  ixpk= 4308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2156,2157,
 &end
#
#  127 VAL  MGY         132 PRO  HD+         5.50    (#   4309:20  Unique         1.98, 4.64 A)
 &rst
  ixpk= 4309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,
 igr2=2156,2157,
 &end
#
#  132 PRO  HG-         132 PRO  HD-         5.50    (#   4310:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 4310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2159,2160,
 igr2=2156,2157,
 &end
#
#  136 VAL  MGX         133 VAL  HA          5.50    (#   4311:20  Unique         2.87, 5.59 A)
 &rst
  ixpk= 4311, nxpk= 20, iat=  -1,2171, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  MGY         133 VAL  HA          5.50    (#   4312:20  Unique         2.87, 5.59 A)
 &rst
  ixpk= 4312, nxpk= 20, iat=  -1,2171, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  133 VAL  MGY         133 VAL  HA          3.50    (#   4313:20  Unique         2.22, 3.16 A)
 &rst
  ixpk= 4313, nxpk= 20, iat=  -1,2171, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  MGX         133 VAL  HA          3.50    (#   4314:20  Unique         2.22, 3.16 A)
 &rst
  ixpk= 4314, nxpk= 20, iat=  -1,2171, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  HB          133 VAL  HA          5.50    (#   4315:20  Unique         2.40, 2.94 A)
 &rst
  ixpk= 4315, nxpk= 20, iat=2173,2171, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HB-         133 VAL  HA          5.50    (#   4316:20  Unique         2.28, 3.35 A)
 &rst
  ixpk= 4316, nxpk= 20, iat=  -1,2171, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#  133 VAL  HN          133 VAL  HA          5.50    (#   4317:20  Unique         2.73, 2.81 A)
 &rst
  ixpk= 4317, nxpk= 20, iat=2169,2171, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  134 ARG  HN          133 VAL  HA          5.50    (#   4318:20  Unique         3.31, 3.41 A)
 &rst
  ixpk= 4318, nxpk= 20, iat=2185,2171, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  134 ARG  HN          133 VAL  HB          5.50    (#   4320:20  Unique         2.86, 3.30 A)
 &rst
  ixpk= 4320, nxpk= 20, iat=2185,2173, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  HN          133 VAL  HB          5.50    (#   4321:20  Unique         2.28, 2.57 A)
 &rst
  ixpk= 4321, nxpk= 20, iat=2169,2173, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  HA          133 VAL  HB          5.50    (#   4322:20  Unique         2.40, 2.94 A)
 &rst
  ixpk= 4322, nxpk= 20, iat=2171,2173, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  MGX         133 VAL  HB          3.50    (#   4323:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 4323, nxpk= 20, iat=  -1,2173, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  MGY         133 VAL  HB          3.50    (#   4324:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 4324, nxpk= 20, iat=  -1,2173, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  HB          133 VAL  MGX         4.50    (#   4325:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 4325, nxpk= 20, iat=2173,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:4326   133 VAL  MGX         4.50    (#   4326:20  Single Ambig)
 &rst
  ixpk= 4326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2114,2115,2171,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  HN          133 VAL  MGX         4.50    (#   4327:20  Unique         2.03, 3.75 A)
 &rst
  ixpk= 4327, nxpk= 20, iat=2169,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:4328     0 AMB  20-1:4328   5.50    (#   4328:20  Double Ambig)
 &rst
  ixpk= 4328, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1=2421,1629,2289,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#    0 AMB  20-2:4329     0 AMB  20-1:4329   5.50    (#   4329:20  Double Ambig)
 &rst
  ixpk= 4329, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2125,1166,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#  133 VAL  HN          133 VAL  MGY         4.50    (#   4330:20  Unique         2.03, 3.75 A)
 &rst
  ixpk= 4330, nxpk= 20, iat=2169,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  HA          133 VAL  MGY         4.50    (#   4331:20  Unique         2.22, 3.16 A)
 &rst
  ixpk= 4331, nxpk= 20, iat=2171,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#  148 MET  HG+         133 VAL  MGY         5.50    (#   4332:20  Unique         1.98, 4.72 A)
 &rst
  ixpk= 4332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2455,2456,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:4333     0 AMB  20-1:4333   4.50    (#   4333:20  Double Ambig)
 &rst
  ixpk= 4333, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.79, r4= 8.29,
 igr1=2173,2494,2495,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#  148 MET  ME          133 VAL  MGY         5.50    (#   4334:20  Unique         2.31, 5.93 A)
 &rst
  ixpk= 4334, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2459,2460,2461,
 igr2=2175,2176,2177,2179,2180,2181,
 &end
#
#  133 VAL  MGX         134 ARG  HA          5.50    (#   4335:20  Unique         3.80, 5.76 A)
 &rst
  ixpk= 4335, nxpk= 20, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:4336   134 ARG  HA          3.50    (#   4336:20  Single Ambig)
 &rst
  ixpk= 4336, nxpk= 20, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2318,2319,2192,2193,
 &end
#
#    0 AMB  20-2:4337   134 ARG  HA          5.50    (#   4337:20  Single Ambig)
 &rst
  ixpk= 4337, nxpk= 20, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2195,2196,2195,2196,2321,2322,
 &end
#
#  141 ARG  HD+         134 ARG  HA          5.50    (#   4338:20  Unique         2.00, 3.66 A)
 &rst
  ixpk= 4338, nxpk= 20, iat=  -1,2187, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2321,2322,
 &end
#
#  141 ARG  HA          134 ARG  HA          5.50    (#   4339:20  Unique         3.82, 4.56 A)
 &rst
  ixpk= 4339, nxpk= 20, iat=2313,2187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 GLN  HN          134 ARG  HA          5.50    (#   4340:20  Unique         2.91, 3.14 A)
 &rst
  ixpk= 4340, nxpk= 20, iat=2209,2187, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  134 ARG  HN          134 ARG  HA          4.50    (#   4341:20  Unique         2.90, 2.94 A)
 &rst
  ixpk= 4341, nxpk= 20, iat=2185,2187, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 ARG  HN          134 ARG  HB-         5.50    (#   4342:20  Unique         2.46, 3.24 A)
 &rst
  ixpk= 4342, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2189,2190,
 &end
#
#  134 ARG  HA          134 ARG  HB-         5.50    (#   4343:20  Unique         2.33, 2.76 A)
 &rst
  ixpk= 4343, nxpk= 20, iat=2187,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2189,2190,
 &end
#
#    0 AMB  20-2:4344     0 AMB  20-1:4344   4.50    (#   4344:20  Double Ambig)
 &rst
  ixpk= 4344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 424, 425,2195,2196,2195,2196,
 igr2=1940,1941,2189,2190,
 &end
#
#    0 AMB  20-2:4345     0 AMB  20-1:4345   3.50    (#   4345:20  Double Ambig)
 &rst
  ixpk= 4345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1123,1124,1123,1124,1123,1124,
 igr2=1117,1118,1117,1118,1117,1118,
 &end
#
#  134 ARG  HN          134 ARG  HG-         5.50    (#   4346:20  Unique         2.39, 3.70 A)
 &rst
  ixpk= 4346, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2192,2193,
 &end
#
#  134 ARG  HN          134 ARG  HG+         5.50    (#   4347:20  Unique         2.39, 3.70 A)
 &rst
  ixpk= 4347, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2192,2193,
 &end
#
#  134 ARG  HN            0 AMB  20-1:4348   4.50    (#   4348:20  Single Ambig)
 &rst
  ixpk= 4348, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2195,2196,2195,2196,
 &end
#
#  135 GLN  HG+         135 GLN  HA          5.50    (#   4349:20  Unique         2.17, 3.17 A)
 &rst
  ixpk= 4349, nxpk= 20, iat=  -1,2211, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2216,2217,
 &end
#
#    0 AMB  20-2:4350     1 MET  HA          3.50    (#   4350:20  Single Ambig)
 &rst
  ixpk= 4350, nxpk= 20, iat=  -1,   6, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=   8,   9,   8,   9,
 &end
#
#    0 AMB  20-2:4351     0 AMB  20-1:4351   4.50    (#   4351:20  Double Ambig)
 &rst
  ixpk= 4351, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2209, 847, 855,
 igr2=2211, 812,
 &end
#
#  135 GLN  HE2-        135 GLN  HA          5.50    (#   4352:20  Unique         2.27, 3.53 A)
 &rst
  ixpk= 4352, nxpk= 20, iat=  -1,2211, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2221,2222,
 &end
#
#  135 GLN  HE2+        135 GLN  HA          5.50    (#   4353:20  Unique         2.27, 3.53 A)
 &rst
  ixpk= 4353, nxpk= 20, iat=  -1,2211, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2221,2222,
 &end
#
#  135 GLN  HG+         135 GLN  HB-         5.50    (#   4355:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4355, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2216,2217,
 igr2=2213,2214,
 &end
#
#  135 GLN  HG+         135 GLN  HB+         5.50    (#   4356:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2216,2217,
 igr2=2213,2214,
 &end
#
#  135 GLN  HA          135 GLN  HB-         5.50    (#   4357:20  Unique         2.31, 2.79 A)
 &rst
  ixpk= 4357, nxpk= 20, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2213,2214,
 &end
#
#  135 GLN  HA          135 GLN  HB+         5.50    (#   4358:20  Unique         2.31, 2.79 A)
 &rst
  ixpk= 4358, nxpk= 20, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2213,2214,
 &end
#
#    0 AMB  20-2:4359     0 AMB  20-1:4359   5.50    (#   4359:20  Double Ambig)
 &rst
  ixpk= 4359, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 369,2209,
 igr2=2213,2214,2213,2214,
 &end
#
#    0 AMB  20-2:4360   135 GLN  HB-         5.50    (#   4360:20  Single Ambig)
 &rst
  ixpk= 4360, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 369,2209,
 igr2=2213,2214,
 &end
#
#  136 VAL  HN          135 GLN  HB-         5.50    (#   4361:20  Unique         2.45, 3.39 A)
 &rst
  ixpk= 4361, nxpk= 20, iat=2226,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2213,2214,
 &end
#
#  136 VAL  HN          135 GLN  HB+         5.50    (#   4362:20  Unique         2.45, 3.39 A)
 &rst
  ixpk= 4362, nxpk= 20, iat=2226,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2213,2214,
 &end
#
#  135 GLN  HE2+        135 GLN  HB-         5.50    (#   4363:20  Unique         1.95, 3.91 A)
 &rst
  ixpk= 4363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2221,2222,
 igr2=2213,2214,
 &end
#
#    0 AMB  20-2:4364     0 AMB  20-1:4364   5.50    (#   4364:20  Double Ambig)
 &rst
  ixpk= 4364, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 369,2209,
 igr2=2216,2217,2162,2163,
 &end
#
#    0 AMB  20-2:4365     0 AMB  20-1:4365   3.50    (#   4365:20  Double Ambig)
 &rst
  ixpk= 4365, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 369,1359,
 igr2=2216,2217,1363,
 &end
#
#  135 GLN  HE2+        135 GLN  HG+         5.50    (#   4366:20  Unique         2.13, 3.37 A)
 &rst
  ixpk= 4366, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2221,2222,
 igr2=2216,2217,
 &end
#
#    0 AMB  20-2:4367     0 AMB  20-1:4367   5.50    (#   4367:20  Double Ambig)
 &rst
  ixpk= 4367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2221,2222,2221,2222,
 igr2=2216,2217,2162,2163,
 &end
#
#  135 GLN  HE2-          0 AMB  20-1:4368   5.50    (#   4368:20  Single Ambig)
 &rst
  ixpk= 4368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2221,2222,
 igr2=2216,2217,2162,2163,
 &end
#
#  135 GLN  HE2-        135 GLN  HG+         5.50    (#   4369:20  Unique         2.13, 3.37 A)
 &rst
  ixpk= 4369, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2221,2222,
 igr2=2216,2217,
 &end
#
#  131 TYR  HE          135 GLN  HG-         5.50    (#   4370:20  Unique         1.95, 4.52 A)
 &rst
  ixpk= 4370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2144,2149,
 igr2=2216,2217,
 &end
#
#  135 GLN  HA          135 GLN  HG+         5.50    (#   4371:20  Unique         2.17, 3.17 A)
 &rst
  ixpk= 4371, nxpk= 20, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2216,2217,
 &end
#
#  135 GLN  HA          135 GLN  HG-         5.50    (#   4372:20  Unique         2.17, 3.17 A)
 &rst
  ixpk= 4372, nxpk= 20, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2216,2217,
 &end
#
#    0 AMB  20-2:4373     0 AMB  20-1:4373   4.50    (#   4373:20  Double Ambig)
 &rst
  ixpk= 4373, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2213,2214,2213,2214,
 igr2=2216,2217,2162,2163,
 &end
#
#  135 GLN  HB+         135 GLN  HG+         4.50    (#   4374:20  Unique         2.21, 2.60 A)
 &rst
  ixpk= 4374, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2213,2214,
 igr2=2216,2217,
 &end
#
#  136 VAL  MGX         136 VAL  HA          4.50    (#   4375:20  Unique         1.99, 3.43 A)
 &rst
  ixpk= 4375, nxpk= 20, iat=  -1,2228, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  MGY         136 VAL  HA          3.50    (#   4376:20  Unique         1.99, 3.43 A)
 &rst
  ixpk= 4376, nxpk= 20, iat=  -1,2228, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  137 VAL  MGY         136 VAL  HA          5.50    (#   4377:20  Unique         3.22, 5.48 A)
 &rst
  ixpk= 4377, nxpk= 20, iat=  -1,2228, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  136 VAL  HB          136 VAL  HA          4.50    (#   4378:20  Unique         2.38, 2.53 A)
 &rst
  ixpk= 4378, nxpk= 20, iat=2230,2228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 TRP  HZ2         136 VAL  HA          5.50    (#   4379:20  Unique         2.61, 3.69 A)
 &rst
  ixpk= 4379, nxpk= 20, iat= 369,2228, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  136 VAL  HN          136 VAL  HA          4.50    (#   4380:20  Unique         2.71, 2.85 A)
 &rst
  ixpk= 4380, nxpk= 20, iat=2226,2228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 VAL  HN          136 VAL  HA          3.50    (#   4381:20  Unique         2.19, 2.70 A)
 &rst
  ixpk= 4381, nxpk= 20, iat=2242,2228, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:4382   136 VAL  HB          4.50    (#   4382:20  Single Ambig)
 &rst
  ixpk= 4382, nxpk= 20, iat=  -1,2230, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2226,2311,
 &end
#
#  136 VAL  HA          136 VAL  HB          5.50    (#   4384:20  Unique         2.38, 2.53 A)
 &rst
  ixpk= 4384, nxpk= 20, iat=2228,2230, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  136 VAL  MGX         136 VAL  HB          5.50    (#   4385:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4385, nxpk= 20, iat=  -1,2230, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4386   136 VAL  HB          3.50    (#   4386:20  Single Ambig)
 &rst
  ixpk= 4386, nxpk= 20, iat=  -1,2230, r1= 1.30, r2= 1.80, r3= 5.43, r4= 5.93,
 igr1=2296,2297,2248,2249,2250,2252,2253,2254,2232,2233,
      2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4387   136 VAL  MGX         5.50    (#   4387:20  Single Ambig)
 &rst
  ixpk= 4387, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2363, 510,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  137 VAL  HN          136 VAL  MGX         5.50    (#   4388:20  Unique         1.89, 4.20 A)
 &rst
  ixpk= 4388, nxpk= 20, iat=2242,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4389   136 VAL  MGX         5.50    (#   4389:20  Single Ambig)
 &rst
  ixpk= 4389, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2289,1629,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HN          136 VAL  MGX         4.50    (#   4390:20  Unique         1.77, 3.39 A)
 &rst
  ixpk= 4390, nxpk= 20, iat=2226,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4391   136 VAL  MGX         5.50    (#   4391:20  Single Ambig)
 &rst
  ixpk= 4391, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 369,2209,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  144 TYR  HD          136 VAL  MGX         5.50    (#   4392:20  Unique         1.95, 4.75 A)
 &rst
  ixpk= 4392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2371,2380,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4393   136 VAL  MGX         5.50    (#   4393:20  Single Ambig)
 &rst
  ixpk= 4393, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 371,2373,2378,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HA          136 VAL  MGX         5.50    (#   4394:20  Unique         1.99, 3.43 A)
 &rst
  ixpk= 4394, nxpk= 20, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4395   136 VAL  MGX         5.50    (#   4395:20  Single Ambig)
 &rst
  ixpk= 4395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2187,2244,2211,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  141 ARG  HA          136 VAL  MGX         4.50    (#   4396:20  Unique         1.98, 3.92 A)
 &rst
  ixpk= 4396, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  144 TYR  HB+         136 VAL  MGX         5.50    (#   4397:20  Unique         2.07, 4.56 A)
 &rst
  ixpk= 4397, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2367,2368,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4398   136 VAL  MGX         5.50    (#   4398:20  Single Ambig)
 &rst
  ixpk= 4398, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 555, 556,2367,2368,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HB          136 VAL  MGX         4.50    (#   4399:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4399, nxpk= 20, iat=2230,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  135 GLN  HB+         136 VAL  MGX         5.50    (#   4400:20  Unique         3.59, 5.96 A)
 &rst
  ixpk= 4400, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2213,2214,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  141 ARG  HB+         136 VAL  MGX         5.50    (#   4401:20  Unique         2.12, 5.40 A)
 &rst
  ixpk= 4401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2315,2316,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4402   136 VAL  MGX         4.50    (#   4402:20  Single Ambig)
 &rst
  ixpk= 4402, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2318,2319,2315,2316,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  141 ARG  HG-         136 VAL  MGX         5.50    (#   4403:20  Unique         1.95, 5.95 A)
 &rst
  ixpk= 4403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2318,2319,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4404   136 VAL  MGX         5.50    (#   4404:20  Single Ambig)
 &rst
  ixpk= 4404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 514, 515,2299,2300,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  140 LYS  HB-         136 VAL  MGX         5.50    (#   4405:20  Unique         1.94, 4.78 A)
 &rst
  ixpk= 4405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2293,2294,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  132 PRO  HB-         136 VAL  MGX         5.50    (#   4406:20  Unique         2.54, 5.69 A)
 &rst
  ixpk= 4406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2162,2163,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4407   136 VAL  MGX         5.50    (#   4407:20  Single Ambig)
 &rst
  ixpk= 4407, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.59, r4=13.09,
 igr1= 329, 330, 331, 333, 334, 335, 329, 330, 331, 333,
       334, 335,1349,1350,1351,1353,1354,1355,1349,1350,
      1351,1353,1354,1355,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  137 VAL  HN          136 VAL  MGY         3.50    (#   4408:20  Unique         1.89, 4.20 A)
 &rst
  ixpk= 4408, nxpk= 20, iat=2242,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4409   136 VAL  MGY         5.50    (#   4409:20  Single Ambig)
 &rst
  ixpk= 4409, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2289,1629,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HN          136 VAL  MGY         4.50    (#   4410:20  Unique         1.77, 3.39 A)
 &rst
  ixpk= 4410, nxpk= 20, iat=2226,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4411   136 VAL  MGY         5.50    (#   4411:20  Single Ambig)
 &rst
  ixpk= 4411, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 369,2209,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  144 TYR  HE          136 VAL  MGY         4.50    (#   4412:20  Unique         2.14, 5.48 A)
 &rst
  ixpk= 4412, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2373,2378,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  144 TYR  HD          136 VAL  MGY         4.50    (#   4413:20  Unique         1.95, 4.75 A)
 &rst
  ixpk= 4413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2371,2380,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HA          136 VAL  MGY         4.50    (#   4414:20  Unique         1.99, 3.43 A)
 &rst
  ixpk= 4414, nxpk= 20, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  137 VAL  HA          136 VAL  MGY         5.50    (#   4415:20  Unique         4.21, 6.07 A)
 &rst
  ixpk= 4415, nxpk= 20, iat=2244,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  141 ARG  HA          136 VAL  MGY         5.50    (#   4416:20  Unique         1.98, 3.92 A)
 &rst
  ixpk= 4416, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4417   136 VAL  MGY         5.50    (#   4417:20  Single Ambig)
 &rst
  ixpk= 4417, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2260, 503, 504,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  20-2:4418   136 VAL  MGY         5.50    (#   4418:20  Single Ambig)
 &rst
  ixpk= 4418, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2321,2322,2195,2196,2195,2196,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HB          136 VAL  MGY         3.50    (#   4419:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4419, nxpk= 20, iat=2230,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2232,2233,2234,2236,2237,2238,
 &end
#
#  137 VAL  MGY         137 VAL  HA          4.50    (#   4420:20  Unique         2.02, 3.13 A)
 &rst
  ixpk= 4420, nxpk= 20, iat=  -1,2244, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  MGX         137 VAL  HA          4.50    (#   4421:20  Unique         2.02, 3.13 A)
 &rst
  ixpk= 4421, nxpk= 20, iat=  -1,2244, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  HB          137 VAL  HA          3.50    (#   4422:20  Unique         2.91, 2.99 A)
 &rst
  ixpk= 4422, nxpk= 20, iat=2246,2244, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  137 VAL  HN          137 VAL  HA          5.50    (#   4423:20  Unique         2.28, 2.60 A)
 &rst
  ixpk= 4423, nxpk= 20, iat=2242,2244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  138 SER  HN          137 VAL  HA          3.50    (#   4424:20  Unique         2.17, 2.42 A)
 &rst
  ixpk= 4424, nxpk= 20, iat=2258,2244, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-2:4425     0 AMB  20-1:4425   3.50    (#   4425:20  Double Ambig)
 &rst
  ixpk= 4425, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1=2296,2297,2248,2249,2250,2252,2253,2254,2232,2233,
      2234,2236,2237,2238,
 igr2=2230,2246,
 &end
#
#  137 VAL  HA          137 VAL  HB          4.50    (#   4426:20  Unique         2.91, 2.99 A)
 &rst
  ixpk= 4426, nxpk= 20, iat=2244,2246, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  141 ARG  HN            0 AMB  20-1:4427   4.50    (#   4427:20  Single Ambig)
 &rst
  ixpk= 4427, nxpk= 20, iat=2311,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2246,2230,
 &end
#
#  137 VAL  HN          136 VAL  HB          4.50    (#   4428:20  Unique         1.92, 3.26 A)
 &rst
  ixpk= 4428, nxpk= 20, iat=2242,2230, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 VAL  MGY           0 AMB  20-1:4429   4.50    (#   4429:20  Single Ambig)
 &rst
  ixpk= 4429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2230,2246,
 &end
#
#  138 SER  HN          137 VAL  MGX         5.50    (#   4430:20  Unique         1.93, 3.77 A)
 &rst
  ixpk= 4430, nxpk= 20, iat=2258,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  138 SER  HN          137 VAL  MGY         4.50    (#   4431:20  Unique         1.93, 3.77 A)
 &rst
  ixpk= 4431, nxpk= 20, iat=2258,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  HN          137 VAL  MGY         4.50    (#   4432:20  Unique         1.94, 3.89 A)
 &rst
  ixpk= 4432, nxpk= 20, iat=2242,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  HN          137 VAL  MGX         4.50    (#   4433:20  Unique         1.94, 3.89 A)
 &rst
  ixpk= 4433, nxpk= 20, iat=2242,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  140 LYS  HN          137 VAL  MGX         5.50    (#   4435:20  Unique         1.99, 4.15 A)
 &rst
  ixpk= 4435, nxpk= 20, iat=2289,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  139 PHE  HD          137 VAL  MGX         5.50    (#   4436:20  Unique         1.98, 5.95 A)
 &rst
  ixpk= 4436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2277,2285,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  139 PHE  HE          137 VAL  MGX         4.50    (#   4437:20  Unique         2.01, 6.31 A)
 &rst
  ixpk= 4437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2279,2283,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  139 PHE  HD          137 VAL  MGY         5.50    (#   4438:20  Unique         1.98, 5.95 A)
 &rst
  ixpk= 4438, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2277,2285,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  139 PHE  HE          137 VAL  MGY         3.50    (#   4439:20  Unique         2.01, 6.31 A)
 &rst
  ixpk= 4439, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2279,2283,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  136 VAL  HA          137 VAL  MGY         5.50    (#   4440:20  Unique         3.22, 5.48 A)
 &rst
  ixpk= 4440, nxpk= 20, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  136 VAL  HA          137 VAL  MGX         5.50    (#   4441:20  Unique         3.22, 5.48 A)
 &rst
  ixpk= 4441, nxpk= 20, iat=2228,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  HA          137 VAL  MGX         4.50    (#   4442:20  Unique         2.02, 3.13 A)
 &rst
  ixpk= 4442, nxpk= 20, iat=2244,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  HA          137 VAL  MGY         3.50    (#   4443:20  Unique         2.02, 3.13 A)
 &rst
  ixpk= 4443, nxpk= 20, iat=2244,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4444   137 VAL  MGX         5.50    (#   4444:20  Single Ambig)
 &rst
  ixpk= 4444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2260, 503, 504,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4445   137 VAL  MGY         5.50    (#   4445:20  Single Ambig)
 &rst
  ixpk= 4445, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2260, 503, 504,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4446   137 VAL  MGX         5.50    (#   4446:20  Single Ambig)
 &rst
  ixpk= 4446, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2302,2303,2302,2303,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4447   137 VAL  MGY         5.50    (#   4447:20  Single Ambig)
 &rst
  ixpk= 4447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2302,2303,2302,2303,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4450   137 VAL  MGX         2.80    (#   4450:20  Single Ambig)
 &rst
  ixpk= 4450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2230,2246,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4451   137 VAL  MGY         3.50    (#   4451:20  Single Ambig)
 &rst
  ixpk= 4451, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2230,2246,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4452   137 VAL  MGY         5.50    (#   4452:20  Single Ambig)
 &rst
  ixpk= 4452, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2293,2294,2299,2300,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  20-2:4453   137 VAL  MGX         5.50    (#   4453:20  Single Ambig)
 &rst
  ixpk= 4453, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2293,2294,2299,2300,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  140 LYS  HD-         137 VAL  MGX         5.50    (#   4455:20  Unique         2.05, 5.29 A)
 &rst
  ixpk= 4455, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2299,2300,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#  140 LYS  HB-         137 VAL  MGX         5.50    (#   4456:20  Unique         1.93, 3.85 A)
 &rst
  ixpk= 4456, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2293,2294,
 igr2=2248,2249,2250,2252,2253,2254,
 &end
#
#   22 VAL  MGX          14 VAL  HA          5.50    (#   4457:20  Unique         2.78, 5.86 A)
 &rst
  ixpk= 4457, nxpk= 20, iat=  -1, 200, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  20-2:4458     0 AMB  20-1:4458   5.50    (#   4458:20  Double Ambig)
 &rst
  ixpk= 4458, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2315,2316, 218,
 igr2=2260, 200,
 &end
#
#  141 ARG  HG-         138 SER  HA          5.50    (#   4459:20  Unique         2.34, 4.21 A)
 &rst
  ixpk= 4459, nxpk= 20, iat=  -1,2260, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2318,2319,
 &end
#
#    0 AMB  20-2:4460   138 SER  HA          5.50    (#   4460:20  Single Ambig)
 &rst
  ixpk= 4460, nxpk= 20, iat=  -1,2260, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2318,2319,2315,2316,
 &end
#
#  141 ARG  HD-         138 SER  HA          5.50    (#   4461:20  Unique         1.93, 3.30 A)
 &rst
  ixpk= 4461, nxpk= 20, iat=  -1,2260, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2321,2322,
 &end
#
#  138 SER  HB-         138 SER  HA          4.50    (#   4463:20  Unique         2.26, 2.59 A)
 &rst
  ixpk= 4463, nxpk= 20, iat=  -1,2260, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2262,2263,
 &end
#
#  138 SER  HN          138 SER  HA          5.50    (#   4465:20  Unique         2.74, 2.85 A)
 &rst
  ixpk= 4465, nxpk= 20, iat=2258,2260, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  138 SER  HN          138 SER  HB+         5.50    (#   4466:20  Unique         2.09, 3.02 A)
 &rst
  ixpk= 4466, nxpk= 20, iat=2258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2262,2263,
 &end
#
#  138 SER  HN          138 SER  HB-         5.50    (#   4467:20  Unique         2.09, 3.02 A)
 &rst
  ixpk= 4467, nxpk= 20, iat=2258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2262,2263,
 &end
#
#  138 SER  HA          138 SER  HB+         5.50    (#   4468:20  Unique         2.26, 2.59 A)
 &rst
  ixpk= 4468, nxpk= 20, iat=2260,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2262,2263,
 &end
#
#  138 SER  HA          138 SER  HB-         4.50    (#   4469:20  Unique         2.26, 2.59 A)
 &rst
  ixpk= 4469, nxpk= 20, iat=2260,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2262,2263,
 &end
#
#    0 AMB  20-2:4470   138 SER  HB-         5.50    (#   4470:20  Single Ambig)
 &rst
  ixpk= 4470, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2321,2322,2273,2274,
 igr2=2262,2263,
 &end
#
#    0 AMB  20-2:4471     0 AMB  20-1:4471   5.50    (#   4471:20  Double Ambig)
 &rst
  ixpk= 4471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2321,2322,2273,2274,
 igr2=2262,2263,2262,2263,
 &end
#
#    0 AMB  20-2:4472   139 PHE  HA          5.50    (#   4472:20  Single Ambig)
 &rst
  ixpk= 4472, nxpk= 20, iat=  -1,2271, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2273,2274,2321,2322,
 &end
#
#  139 PHE  HB+         139 PHE  HA          5.50    (#   4473:20  Unique         2.23, 2.50 A)
 &rst
  ixpk= 4473, nxpk= 20, iat=  -1,2271, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2273,2274,
 &end
#
#  139 PHE  HD          139 PHE  HA          5.50    (#   4474:20  Unique         2.97, 4.05 A)
 &rst
  ixpk= 4474, nxpk= 20, iat=  -1,2271, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2277,2285,
 &end
#
#  139 PHE  HN          139 PHE  HA          5.50    (#   4475:20  Unique         2.82, 2.91 A)
 &rst
  ixpk= 4475, nxpk= 20, iat=2269,2271, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  139 PHE  HN          139 PHE  HB+         5.50    (#   4477:20  Unique         2.20, 2.98 A)
 &rst
  ixpk= 4477, nxpk= 20, iat=2269,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2273,2274,
 &end
#
#  139 PHE  HN          139 PHE  HB-         5.50    (#   4478:20  Unique         2.20, 2.98 A)
 &rst
  ixpk= 4478, nxpk= 20, iat=2269,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2273,2274,
 &end
#
#  139 PHE  HD          139 PHE  HB+         4.50    (#   4479:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 4479, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2277,2285,
 igr2=2273,2274,
 &end
#
#  139 PHE  HD          139 PHE  HB-         4.50    (#   4480:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 4480, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2277,2285,
 igr2=2273,2274,
 &end
#
#  139 PHE  HA          139 PHE  HB+         4.50    (#   4481:20  Unique         2.23, 2.50 A)
 &rst
  ixpk= 4481, nxpk= 20, iat=2271,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2273,2274,
 &end
#
#  139 PHE  HA          139 PHE  HB-         4.50    (#   4482:20  Unique         2.23, 2.50 A)
 &rst
  ixpk= 4482, nxpk= 20, iat=2271,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2273,2274,
 &end
#
#   80 PRO  HG+         139 PHE  HB+         5.50    (#   4483:20  Unique         2.87, 4.77 A)
 &rst
  ixpk= 4483, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1284,1285,
 igr2=2273,2274,
 &end
#
#  137 VAL  MGY         139 PHE  HB+         5.50    (#   4484:20  Unique         2.76, 6.49 A)
 &rst
  ixpk= 4484, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2273,2274,
 &end
#
#  137 VAL  MGY         139 PHE  HB-         5.50    (#   4485:20  Unique         2.76, 6.49 A)
 &rst
  ixpk= 4485, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2273,2274,
 &end
#
#  137 VAL  MGX         139 PHE  HB-         5.50    (#   4486:20  Unique         2.76, 6.49 A)
 &rst
  ixpk= 4486, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2273,2274,
 &end
#
#  137 VAL  MGX         139 PHE  HB+         5.50    (#   4487:20  Unique         2.76, 6.49 A)
 &rst
  ixpk= 4487, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2248,2249,2250,2252,2253,2254,
 igr2=2273,2274,
 &end
#
#  140 LYS  HG-         140 LYS  HA          4.50    (#   4488:20  Unique         2.20, 2.94 A)
 &rst
  ixpk= 4488, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2296,2297,
 &end
#
#  140 LYS  HG+         140 LYS  HA          4.50    (#   4489:20  Unique         2.20, 2.94 A)
 &rst
  ixpk= 4489, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2296,2297,
 &end
#
#    0 AMB  20-2:4490   140 LYS  HA          5.50    (#   4490:20  Single Ambig)
 &rst
  ixpk= 4490, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  140 LYS  HB-         140 LYS  HA          5.50    (#   4491:20  Unique         2.45, 2.81 A)
 &rst
  ixpk= 4491, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2293,2294,
 &end
#
#    0 AMB  20-2:4492   140 LYS  HA          4.50    (#   4492:20  Single Ambig)
 &rst
  ixpk= 4492, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2299,2300,2293,2294,
 &end
#
#  143 VAL  HB          140 LYS  HA          5.50    (#   4493:20  Unique         2.89, 3.87 A)
 &rst
  ixpk= 4493, nxpk= 20, iat=2351,2291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4494   140 LYS  HA          5.50    (#   4494:20  Single Ambig)
 &rst
  ixpk= 4494, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2302,2303,2302,2303,
 &end
#
#    0 AMB  20-2:4495   140 LYS  HA          5.50    (#   4495:20  Single Ambig)
 &rst
  ixpk= 4495, nxpk= 20, iat=  -1,2291, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2311,2279,2283,
 &end
#
#  140 LYS  HN          140 LYS  HA          5.50    (#   4496:20  Unique         2.78, 2.86 A)
 &rst
  ixpk= 4496, nxpk= 20, iat=2289,2291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HN          140 LYS  HA          5.50    (#   4497:20  Unique         3.35, 3.59 A)
 &rst
  ixpk= 4497, nxpk= 20, iat=2347,2291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  142 ASP  HN          140 LYS  HA          5.50    (#   4498:20  Unique         3.60, 4.03 A)
 &rst
  ixpk= 4498, nxpk= 20, iat=2335,2291, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  140 LYS  HN          140 LYS  HB+         5.50    (#   4499:20  Unique         2.07, 2.61 A)
 &rst
  ixpk= 4499, nxpk= 20, iat=2289,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2293,2294,
 &end
#
#  140 LYS  HN          140 LYS  HB-         5.50    (#   4500:20  Unique         2.07, 2.61 A)
 &rst
  ixpk= 4500, nxpk= 20, iat=2289,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2293,2294,
 &end
#
#    0 AMB  20-2:4501     0 AMB  20-1:4501   5.50    (#   4501:20  Double Ambig)
 &rst
  ixpk= 4501, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2311,2279,2283,
 igr2=2293,2294,2293,2294,
 &end
#
#    0 AMB  20-2:4502   140 LYS  HB-         5.50    (#   4502:20  Single Ambig)
 &rst
  ixpk= 4502, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2311,2279,2283,
 igr2=2293,2294,
 &end
#
#  140 LYS  HA          140 LYS  HB-         5.50    (#   4503:20  Unique         2.45, 2.81 A)
 &rst
  ixpk= 4503, nxpk= 20, iat=2291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2293,2294,
 &end
#
#  140 LYS  HA          140 LYS  HB+         5.50    (#   4504:20  Unique         2.45, 2.81 A)
 &rst
  ixpk= 4504, nxpk= 20, iat=2291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2293,2294,
 &end
#
#    0 AMB  20-2:4506     0 AMB  20-1:4506   4.50    (#   4506:20  Double Ambig)
 &rst
  ixpk= 4506, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.42, r4= 9.92,
 igr1=2248,2249,2250,2252,2253,2254,2232,2233,2234,2236,
      2237,2238,2296,2297,
 igr2=2293,2294,2293,2294,2293,2294,
 &end
#
#    0 AMB  20-2:4507   140 LYS  HB-         4.50    (#   4507:20  Single Ambig)
 &rst
  ixpk= 4507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1=2248,2249,2250,2252,2253,2254,2232,2233,2234,2236,
      2237,2238,2296,2297,
 igr2=2293,2294,
 &end
#
#    0 AMB  20-2:4508     0 AMB  20-1:4508   5.50    (#   4508:20  Double Ambig)
 &rst
  ixpk= 4508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2302,2303,2302,2303,
 igr2=2296,2297,2296,2297,
 &end
#
#    0 AMB  20-2:4509     0 AMB  20-1:4509   5.50    (#   4509:20  Double Ambig)
 &rst
  ixpk= 4509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2302,2303,2302,2303,2302,2303,
 igr2=2296,2297,2296,2297,2296,2297,
 &end
#
#    0 AMB  20-2:4510     0 AMB  20-1:4510   5.50    (#   4510:20  Double Ambig)
 &rst
  ixpk= 4510, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1754,1755,2291,1763,1764,
 igr2= 921, 922, 923, 925, 926, 927,2296,2297,
 &end
#
#    0 AMB  20-2:4511     0 AMB  20-1:4511   5.50    (#   4511:20  Double Ambig)
 &rst
  ixpk= 4511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.17, r4=10.67,
 igr1=1754,1755,2291,1763,1764,
 igr2= 921, 922, 923, 925, 926, 927,2296,2297,
 &end
#
#    0 AMB  20-2:4512   140 LYS  HG-         5.50    (#   4512:20  Single Ambig)
 &rst
  ixpk= 4512, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2289,1629,
 igr2=2296,2297,
 &end
#
#    0 AMB  20-2:4513   140 LYS  HD-         5.50    (#   4513:20  Single Ambig)
 &rst
  ixpk= 4513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1629,2289,
 igr2=2299,2300,
 &end
#
#    0 AMB  20-2:4514     0 AMB  20-1:4514   5.50    (#   4514:20  Double Ambig)
 &rst
  ixpk= 4514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1629,2289,
 igr2=2299,2300,2299,2300,
 &end
#
#  140 LYS  HA          140 LYS  HD+         5.50    (#   4515:20  Unique         1.99, 3.73 A)
 &rst
  ixpk= 4515, nxpk= 20, iat=2291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2299,2300,
 &end
#
#  140 LYS  HA          140 LYS  HD-         5.50    (#   4516:20  Unique         1.99, 3.73 A)
 &rst
  ixpk= 4516, nxpk= 20, iat=2291,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2299,2300,
 &end
#
#    0 AMB  20-2:4519     0 AMB  20-1:4519   5.50    (#   4519:20  Double Ambig)
 &rst
  ixpk= 4519, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2302,2303,2302,2303,
 igr2=2299,2300,2299,2300,
 &end
#
#    0 AMB  20-2:4520   140 LYS  HD-         5.50    (#   4520:20  Single Ambig)
 &rst
  ixpk= 4520, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2302,2303,2302,2303,
 igr2=2299,2300,
 &end
#
#  140 LYS  HG-         140 LYS  HD-         5.50    (#   4521:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 4521, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2296,2297,
 igr2=2299,2300,
 &end
#
#  140 LYS  HG-         140 LYS  HD+         4.50    (#   4522:20  Unique         2.22, 2.64 A)
 &rst
  ixpk= 4522, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2296,2297,
 igr2=2299,2300,
 &end
#
#    0 AMB  20-2:4523     0 AMB  20-1:4523   4.50    (#   4523:20  Double Ambig)
 &rst
  ixpk= 4523, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,
 igr2=2299,2300,2299,2300,
 &end
#
#    0 AMB  20-2:4524   140 LYS  HD-         4.50    (#   4524:20  Single Ambig)
 &rst
  ixpk= 4524, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,
 igr2=2299,2300,
 &end
#
#  139 PHE  HE            0 AMB  20-1:4525   5.50    (#   4525:20  Single Ambig)
 &rst
  ixpk= 4525, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2279,2283,
 igr2=2302,2303,2302,2303,
 &end
#
#   80 PRO  HD-           0 AMB  20-1:4527   4.50    (#   4527:20  Single Ambig)
 &rst
  ixpk= 4527, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1281,1282,
 igr2=2302,2303,2302,2303,
 &end
#
#    0 AMB  20-2:4528     0 AMB  20-1:4528   5.50    (#   4528:20  Double Ambig)
 &rst
  ixpk= 4528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2293,2294,2293,2294,2299,2300,2299,2300,
 igr2=2302,2303,2302,2303,2302,2303,
 &end
#
#  140 LYS  HD-           0 AMB  20-1:4529   5.50    (#   4529:20  Single Ambig)
 &rst
  ixpk= 4529, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2299,2300,
 igr2=2302,2303,2302,2303,
 &end
#
#    0 AMB  20-2:4530     0 AMB  20-1:4530   5.50    (#   4530:20  Double Ambig)
 &rst
  ixpk= 4530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=2248,2249,2250,2252,2253,2254,1349,1350,1351,1353,
      1354,1355,
 igr2=2302,2303,2302,2303,2302,2303,
 &end
#
#    0 AMB  20-2:4531     0 AMB  20-1:4531   4.50    (#   4531:20  Double Ambig)
 &rst
  ixpk= 4531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,2296,2297,
      
 igr2=2302,2303,2302,2303,2302,2303,
 &end
#
#  136 VAL  MGY         141 ARG  HA          5.50    (#   4532:20  Unique         1.98, 3.92 A)
 &rst
  ixpk= 4532, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  MGX         141 ARG  HA          5.50    (#   4533:20  Unique         1.98, 3.92 A)
 &rst
  ixpk= 4533, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  133 VAL  MGY         141 ARG  HA          5.50    (#   4534:20  Unique         2.81, 6.37 A)
 &rst
  ixpk= 4534, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  141 ARG  HG-         141 ARG  HA          5.50    (#   4535:20  Unique         2.42, 3.37 A)
 &rst
  ixpk= 4535, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2318,2319,
 &end
#
#  141 ARG  HB+         141 ARG  HA          5.50    (#   4536:20  Unique         2.23, 2.59 A)
 &rst
  ixpk= 4536, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2315,2316,
 &end
#
#    0 AMB  20-2:4537   141 ARG  HA          4.50    (#   4537:20  Single Ambig)
 &rst
  ixpk= 4537, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2315,2316,2318,2319,
 &end
#
#  144 TYR  HB-         141 ARG  HA          5.50    (#   4538:20  Unique         1.98, 3.23 A)
 &rst
  ixpk= 4538, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#  141 ARG  HD-         141 ARG  HA          5.50    (#   4539:20  Unique         3.74, 4.54 A)
 &rst
  ixpk= 4539, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2321,2322,
 &end
#
#  144 TYR  HB+         141 ARG  HA          5.50    (#   4540:20  Unique         1.98, 3.23 A)
 &rst
  ixpk= 4540, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#  144 TYR  HA          141 ARG  HA          5.50    (#   4541:20  Unique         4.74, 5.39 A)
 &rst
  ixpk= 4541, nxpk= 20, iat=2365,2313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4542   141 ARG  HA          5.50    (#   4542:20  Single Ambig)
 &rst
  ixpk= 4542, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2386,2260,
 &end
#
#    0 AMB  20-2:4544   141 ARG  HA          5.50    (#   4544:20  Single Ambig)
 &rst
  ixpk= 4544, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2373,2378,2169,
 &end
#
#    0 AMB  20-2:4545   141 ARG  HA          5.50    (#   4545:20  Single Ambig)
 &rst
  ixpk= 4545, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2311,2226,
 &end
#
#    0 AMB  20-2:4546   141 ARG  HA          5.50    (#   4546:20  Single Ambig)
 &rst
  ixpk= 4546, nxpk= 20, iat=  -1,2313, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2289,1629,
 &end
#
#  144 TYR  HN          141 ARG  HA          5.50    (#   4547:20  Unique         2.98, 3.48 A)
 &rst
  ixpk= 4547, nxpk= 20, iat=2363,2313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 ARG  HN          141 ARG  HA          5.50    (#   4548:20  Unique         3.57, 4.05 A)
 &rst
  ixpk= 4548, nxpk= 20, iat=2384,2313, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HA          141 ARG  HB+         5.50    (#   4549:20  Unique         2.23, 2.59 A)
 &rst
  ixpk= 4549, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2315,2316,
 &end
#
#  141 ARG  HA          141 ARG  HB-         5.50    (#   4550:20  Unique         2.23, 2.59 A)
 &rst
  ixpk= 4550, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2315,2316,
 &end
#
#    0 AMB  20-2:4551     0 AMB  20-1:4551   5.50    (#   4551:20  Double Ambig)
 &rst
  ixpk= 4551, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2260,2386,
 igr2=2315,2316,2452,2453,
 &end
#
#    0 AMB  20-2:4552   141 ARG  HB-         5.50    (#   4552:20  Single Ambig)
 &rst
  ixpk= 4552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2311,2226,
 igr2=2315,2316,
 &end
#
#  141 ARG  HN          141 ARG  HB+         5.50    (#   4553:20  Unique         2.06, 2.95 A)
 &rst
  ixpk= 4553, nxpk= 20, iat=2311,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2315,2316,
 &end
#
#  141 ARG  HN          141 ARG  HG+         5.50    (#   4554:20  Unique         1.91, 3.30 A)
 &rst
  ixpk= 4554, nxpk= 20, iat=2311,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2318,2319,
 &end
#
#    0 AMB  20-2:4555     0 AMB  20-1:4555   5.50    (#   4555:20  Double Ambig)
 &rst
  ixpk= 4555, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2311, 448, 452,2226,
 igr2=2318,2319,1926,1927,
 &end
#
#  141 ARG  HA          141 ARG  HG+         5.50    (#   4556:20  Unique         2.42, 3.37 A)
 &rst
  ixpk= 4556, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2318,2319,
 &end
#
#  141 ARG  HA          141 ARG  HG-         5.50    (#   4557:20  Unique         2.42, 3.37 A)
 &rst
  ixpk= 4557, nxpk= 20, iat=2313,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2318,2319,
 &end
#
#  133 VAL  MGX           0 AMB  20-1:4558   4.50    (#   4558:20  Single Ambig)
 &rst
  ixpk= 4558, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2394,2395,2394,2395,
 &end
#
#  133 VAL  MGX           0 AMB  20-1:4559   5.50    (#   4559:20  Single Ambig)
 &rst
  ixpk= 4559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2195,2196,2195,2196,
 &end
#
#    0 AMB  20-2:4560     0 AMB  20-1:4560   5.50    (#   4560:20  Double Ambig)
 &rst
  ixpk= 4560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2260,2386,
 igr2=2321,2322,2394,2395,2394,2395,
 &end
#
#  134 ARG  HE          141 ARG  HD+         4.50    (#   4561:20  Unique         1.91, 3.13 A)
 &rst
  ixpk= 4561, nxpk= 20, iat=2198,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2321,2322,
 &end
#
#    0 AMB  20-2:4562     0 AMB  20-1:4562   5.50    (#   4562:20  Double Ambig)
 &rst
  ixpk= 4562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2311,2397,
 igr2=2321,2322,2394,2395,2394,2395,
 &end
#
#  142 ASP  HN          141 ARG  HD+         5.50    (#   4563:20  Unique         1.91, 4.20 A)
 &rst
  ixpk= 4563, nxpk= 20, iat=2335,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2321,2322,
 &end
#
#  145 ARG  HN          142 ASP  HA          5.50    (#   4564:20  Unique         3.56, 3.81 A)
 &rst
  ixpk= 4564, nxpk= 20, iat=2384,2337, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  142 ASP  HN          142 ASP  HA          4.50    (#   4565:20  Unique         2.68, 2.75 A)
 &rst
  ixpk= 4565, nxpk= 20, iat=2335,2337, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  143 VAL  HN          142 ASP  HA          5.50    (#   4566:20  Unique         3.51, 3.54 A)
 &rst
  ixpk= 4566, nxpk= 20, iat=2347,2337, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HN          142 ASP  HA          5.50    (#   4567:20  Unique         4.93, 5.24 A)
 &rst
  ixpk= 4567, nxpk= 20, iat=2408,2337, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4569   142 ASP  HA          5.50    (#   4569:20  Single Ambig)
 &rst
  ixpk= 4569, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2394,2395,2394,2395,2321,2322,
 &end
#
#    0 AMB  20-2:4570   142 ASP  HA          3.50    (#   4570:20  Single Ambig)
 &rst
  ixpk= 4570, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2339,2340,2339,2340,
 &end
#
#    0 AMB  20-2:4571   142 ASP  HA          4.50    (#   4571:20  Single Ambig)
 &rst
  ixpk= 4571, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2388,2389,2388,2389,
 &end
#
#    0 AMB  20-2:4572   142 ASP  HA          5.50    (#   4572:20  Single Ambig)
 &rst
  ixpk= 4572, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2391,2392,2318,2319,
 &end
#
#  145 ARG  HG-         142 ASP  HA          5.50    (#   4573:20  Unique         1.99, 4.50 A)
 &rst
  ixpk= 4573, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2391,2392,
 &end
#
#    0 AMB  20-2:4574   142 ASP  HA          5.50    (#   4574:20  Single Ambig)
 &rst
  ixpk= 4574, nxpk= 20, iat=  -1,2337, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2175,2176,2177,2179,2180,2181,2353,2354,2355,2357,
      2358,2359,2353,2354,2355,2357,2358,2359,
 &end
#
#  142 ASP  HA            0 AMB  20-1:4575   3.50    (#   4575:20  Single Ambig)
 &rst
  ixpk= 4575, nxpk= 20, iat=2337,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=2339,2340,2339,2340,
 &end
#
#    0 AMB  20-2:4576     0 AMB  20-1:4576   5.50    (#   4576:20  Double Ambig)
 &rst
  ixpk= 4576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2384,1207,
 igr2=2339,2340,2339,2340,  68,  69,
 &end
#
#  144 TYR  HN          143 VAL  HA          5.50    (#   4577:20  Unique         3.52, 3.56 A)
 &rst
  ixpk= 4577, nxpk= 20, iat=2363,2349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  147 VAL  HN          143 VAL  HA          5.50    (#   4578:20  Unique         4.45, 4.79 A)
 &rst
  ixpk= 4578, nxpk= 20, iat=2432,2349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HN          143 VAL  HA          5.50    (#   4579:20  Unique         2.76, 2.83 A)
 &rst
  ixpk= 4579, nxpk= 20, iat=2347,2349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HN          143 VAL  HA          5.50    (#   4580:20  Unique         3.40, 3.66 A)
 &rst
  ixpk= 4580, nxpk= 20, iat=2408,2349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4582   143 VAL  HA          5.50    (#   4582:20  Single Ambig)
 &rst
  ixpk= 4582, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2339,2340,2339,2340,
 &end
#
#  143 VAL  HB          143 VAL  HA          5.50    (#   4583:20  Unique         2.42, 2.97 A)
 &rst
  ixpk= 4583, nxpk= 20, iat=2351,2349, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4584   143 VAL  HA          4.50    (#   4584:20  Single Ambig)
 &rst
  ixpk= 4584, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2412,2413,2412,2413,2415,2416,
 &end
#
#    0 AMB  20-2:4585   143 VAL  HA          5.50    (#   4585:20  Single Ambig)
 &rst
  ixpk= 4585, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2391,2392,2318,2319,2315,2316,2475,2476,
 &end
#
#    0 AMB  20-2:4586   143 VAL  HA          3.50    (#   4586:20  Single Ambig)
 &rst
  ixpk= 4586, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#    0 AMB  20-2:4587   143 VAL  HA          5.50    (#   4587:20  Single Ambig)
 &rst
  ixpk= 4587, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#  147 VAL  MGY         143 VAL  HA          5.50    (#   4588:20  Unique         4.20, 6.87 A)
 &rst
  ixpk= 4588, nxpk= 20, iat=  -1,2349, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4589   143 VAL  HB          2.80    (#   4589:20  Single Ambig)
 &rst
  ixpk= 4589, nxpk= 20, iat=  -1,2351, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  143 VAL  HA          143 VAL  HB          5.50    (#   4590:20  Unique         2.42, 2.97 A)
 &rst
  ixpk= 4590, nxpk= 20, iat=2349,2351, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HN          143 VAL  HB          3.50    (#   4591:20  Unique         2.35, 2.52 A)
 &rst
  ixpk= 4591, nxpk= 20, iat=2347,2351, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   99 TRP  HE1         143 VAL  MGX         5.50    (#   4592:20  Unique         2.39, 4.71 A)
 &rst
  ixpk= 4592, nxpk= 20, iat=1626,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  144 TYR  HN          143 VAL  MGX         5.50    (#   4593:20  Unique         1.94, 4.18 A)
 &rst
  ixpk= 4593, nxpk= 20, iat=2363,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  147 VAL  HN          143 VAL  MGX         5.50    (#   4594:20  Unique         3.97, 6.15 A)
 &rst
  ixpk= 4594, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HN          143 VAL  MGX         5.50    (#   4595:20  Unique         1.87, 3.79 A)
 &rst
  ixpk= 4595, nxpk= 20, iat=2347,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   99 TRP  HZ2         143 VAL  MGX         5.50    (#   4596:20  Unique         2.08, 4.50 A)
 &rst
  ixpk= 4596, nxpk= 20, iat=1629,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HD          143 VAL  MGX         5.50    (#   4597:20  Unique         2.00, 4.99 A)
 &rst
  ixpk= 4597, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1226,1235,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HE          143 VAL  MGX         5.50    (#   4598:20  Unique         1.99, 5.04 A)
 &rst
  ixpk= 4598, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1228,1233,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4599   143 VAL  MGX         4.50    (#   4599:20  Single Ambig)
 &rst
  ixpk= 4599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2371,2380,1624,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HA          143 VAL  MGX         4.50    (#   4600:20  Unique         2.22, 3.15 A)
 &rst
  ixpk= 4600, nxpk= 20, iat=2349,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4601   143 VAL  MGX         5.50    (#   4601:20  Single Ambig)
 &rst
  ixpk= 4601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2418,2419,2418,2419,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4602   143 VAL  MGX         5.50    (#   4602:20  Single Ambig)
 &rst
  ixpk= 4602, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2302,2303,2302,2303,2339,2340,2339,2340,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HB          143 VAL  MGX         3.50    (#   4603:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4603, nxpk= 20, iat=2351,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4604   143 VAL  MGX         4.50    (#   4604:20  Single Ambig)
 &rst
  ixpk= 4604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2412,2413,2412,2413,2415,2416,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   75 LEU  HB-         143 VAL  MGX         5.50    (#   4605:20  Unique         2.75, 5.31 A)
 &rst
  ixpk= 4605, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1179,1180,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  147 VAL  MGX         143 VAL  MGX         5.50    (#   4606:20  Unique         2.18, 6.90 A)
 &rst
  ixpk= 4606, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  147 VAL  MGY         143 VAL  MGX         4.50    (#   4607:20  Unique         2.18, 6.90 A)
 &rst
  ixpk= 4607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   75 LEU  HB-         143 VAL  MGY         5.50    (#   4608:20  Unique         2.75, 5.31 A)
 &rst
  ixpk= 4608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1179,1180,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4609   143 VAL  MGY         5.50    (#   4609:20  Single Ambig)
 &rst
  ixpk= 4609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2412,2413,2412,2413,2415,2416,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HB          143 VAL  MGY         3.50    (#   4610:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4610, nxpk= 20, iat=2351,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4611   143 VAL  MGY         5.50    (#   4611:20  Single Ambig)
 &rst
  ixpk= 4611, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2302,2303,2302,2303,2339,2340,2339,2340,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HB-         143 VAL  MGY         5.50    (#   4612:20  Unique         2.21, 5.34 A)
 &rst
  ixpk= 4612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1222,1223,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HB+         143 VAL  MGY         5.50    (#   4613:20  Unique         2.21, 5.34 A)
 &rst
  ixpk= 4613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1222,1223,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HA          143 VAL  MGY         4.50    (#   4614:20  Unique         2.22, 3.15 A)
 &rst
  ixpk= 4614, nxpk= 20, iat=2349,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  140 LYS  HA          143 VAL  MGY         5.50    (#   4615:20  Unique         2.27, 5.13 A)
 &rst
  ixpk= 4615, nxpk= 20, iat=2291,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4616   143 VAL  MGY         5.50    (#   4616:20  Single Ambig)
 &rst
  ixpk= 4616, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1177,2271,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HA          143 VAL  MGY         5.50    (#   4617:20  Unique         4.54, 6.90 A)
 &rst
  ixpk= 4617, nxpk= 20, iat=1220,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HD          143 VAL  MGY         4.50    (#   4618:20  Unique         2.00, 4.99 A)
 &rst
  ixpk= 4618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1226,1235,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   77 TYR  HE          143 VAL  MGY         5.50    (#   4619:20  Unique         1.99, 5.04 A)
 &rst
  ixpk= 4619, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1228,1233,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4620   143 VAL  MGY         5.50    (#   4620:20  Single Ambig)
 &rst
  ixpk= 4620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2277,2285,1635,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4621   143 VAL  MGY         5.50    (#   4621:20  Single Ambig)
 &rst
  ixpk= 4621, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2279,2283,2311,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   99 TRP  HZ2         143 VAL  MGY         5.50    (#   4622:20  Unique         2.08, 4.50 A)
 &rst
  ixpk= 4622, nxpk= 20, iat=1629,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  146 ARG  HN          143 VAL  MGY         5.50    (#   4623:20  Unique         4.35, 5.90 A)
 &rst
  ixpk= 4623, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  143 VAL  HN          143 VAL  MGY         4.50    (#   4624:20  Unique         1.87, 3.79 A)
 &rst
  ixpk= 4624, nxpk= 20, iat=2347,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  144 TYR  HN          143 VAL  MGY         5.50    (#   4625:20  Unique         1.94, 4.18 A)
 &rst
  ixpk= 4625, nxpk= 20, iat=2363,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#    0 AMB  20-2:4626   143 VAL  MGY         5.50    (#   4626:20  Single Ambig)
 &rst
  ixpk= 4626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1194,1239,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#   99 TRP  HE1         143 VAL  MGY         5.50    (#   4627:20  Unique         2.39, 4.71 A)
 &rst
  ixpk= 4627, nxpk= 20, iat=1626,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2353,2354,2355,2357,2358,2359,
 &end
#
#  145 ARG  HN          144 TYR  HA          5.50    (#   4628:20  Unique         3.45, 3.51 A)
 &rst
  ixpk= 4628, nxpk= 20, iat=2384,2365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HN          144 TYR  HA          5.50    (#   4629:20  Unique         2.74, 2.76 A)
 &rst
  ixpk= 4629, nxpk= 20, iat=2363,2365, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4630   144 TYR  HA          5.50    (#   4630:20  Single Ambig)
 &rst
  ixpk= 4630, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2432,2448,
 &end
#
#  144 TYR  HE          144 TYR  HA          5.50    (#   4631:20  Unique         4.30, 4.96 A)
 &rst
  ixpk= 4631, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2373,2378,
 &end
#
#  144 TYR  HD          144 TYR  HA          5.50    (#   4632:20  Unique         2.24, 3.28 A)
 &rst
  ixpk= 4632, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  144 TYR  HB+         144 TYR  HA          5.50    (#   4633:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 4633, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#  144 TYR  HB-         144 TYR  HA          5.50    (#   4634:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 4634, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#    0 AMB  20-2:4635   144 TYR  HA          5.50    (#   4635:20  Single Ambig)
 &rst
  ixpk= 4635, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  147 VAL  MGX         144 TYR  HA          5.50    (#   4636:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 4636, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         144 TYR  HA          5.50    (#   4637:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 4637, nxpk= 20, iat=  -1,2365, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  136 VAL  MGX         144 TYR  HB-         5.50    (#   4638:20  Unique         2.07, 4.56 A)
 &rst
  ixpk= 4638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2232,2233,2234,2236,2237,2238,
 igr2=2367,2368,
 &end
#
#  136 VAL  MGX         144 TYR  HB+         5.50    (#   4639:20  Unique         2.07, 4.56 A)
 &rst
  ixpk= 4639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2232,2233,2234,2236,2237,2238,
 igr2=2367,2368,
 &end
#
#  133 VAL  MGY         144 TYR  HB-         5.50    (#   4640:20  Unique         1.98, 5.49 A)
 &rst
  ixpk= 4640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2367,2368,
 &end
#
#  133 VAL  MGY         144 TYR  HB+         5.50    (#   4641:20  Unique         1.98, 5.49 A)
 &rst
  ixpk= 4641, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2367,2368,
 &end
#
#  144 TYR  HA          144 TYR  HB+         5.50    (#   4642:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 4642, nxpk= 20, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2367,2368,
 &end
#
#  144 TYR  HA          144 TYR  HB-         5.50    (#   4643:20  Unique         2.78, 2.85 A)
 &rst
  ixpk= 4643, nxpk= 20, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2367,2368,
 &end
#
#  144 TYR  HD          144 TYR  HB+         5.50    (#   4644:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 4644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2371,2380,
 igr2=2367,2368,
 &end
#
#  144 TYR  HD          144 TYR  HB-         5.50    (#   4645:20  Unique         2.30, 3.06 A)
 &rst
  ixpk= 4645, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2371,2380,
 igr2=2367,2368,
 &end
#
#  144 TYR  HN          144 TYR  HB+         5.50    (#   4646:20  Unique         2.07, 2.71 A)
 &rst
  ixpk= 4646, nxpk= 20, iat=2363,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2367,2368,
 &end
#
#  144 TYR  HN          144 TYR  HB-         5.50    (#   4647:20  Unique         2.07, 2.71 A)
 &rst
  ixpk= 4647, nxpk= 20, iat=2363,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2367,2368,
 &end
#
#  145 ARG  HN          144 TYR  HB-         5.50    (#   4648:20  Unique         2.85, 3.16 A)
 &rst
  ixpk= 4648, nxpk= 20, iat=2384,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2367,2368,
 &end
#
#  145 ARG  HN          145 ARG  HA          5.50    (#   4650:20  Unique         2.73, 2.77 A)
 &rst
  ixpk= 4650, nxpk= 20, iat=2384,2386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4651   145 ARG  HA          5.50    (#   4651:20  Single Ambig)
 &rst
  ixpk= 4651, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2448,2432,
 &end
#
#  146 ARG  HN          145 ARG  HA          5.50    (#   4652:20  Unique         3.40, 3.48 A)
 &rst
  ixpk= 4652, nxpk= 20, iat=2408,2386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4654   145 ARG  HA          5.50    (#   4654:20  Single Ambig)
 &rst
  ixpk= 4654, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2394,2395,2394,2395,
 &end
#
#    0 AMB  20-2:4655   145 ARG  HA          4.50    (#   4655:20  Single Ambig)
 &rst
  ixpk= 4655, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2388,2389,2388,2389,
 &end
#
#  145 ARG  HG+         145 ARG  HA          4.50    (#   4656:20  Unique         2.17, 3.15 A)
 &rst
  ixpk= 4656, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2391,2392,
 &end
#
#  145 ARG  HG-         145 ARG  HA          5.50    (#   4657:20  Unique         2.17, 3.15 A)
 &rst
  ixpk= 4657, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2391,2392,
 &end
#
#  133 VAL  MGY         145 ARG  HA          4.50    (#   4658:20  Unique         1.98, 3.58 A)
 &rst
  ixpk= 4658, nxpk= 20, iat=  -1,2386, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#    0 AMB  20-2:4659     0 AMB  20-1:4659   4.50    (#   4659:20  Double Ambig)
 &rst
  ixpk= 4659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2394,2395,2394,2395,2394,2395,
 igr2=2388,2389,2388,2389,2388,2389,
 &end
#
#   38 GLY  HA-          56 GLU  HB-         5.50    (#   4660:20  Unique         4.72, 6.53 A)
 &rst
  ixpk= 4660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 604, 605,
 igr2= 863, 864,
 &end
#
#  160 GLU  HA          160 GLU  HB-         4.50    (#   4661:20  Unique         2.54, 2.80 A)
 &rst
  ixpk= 4661, nxpk= 20, iat=2641,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2643,2644,
 &end
#
#   54 LEU  HN           56 GLU  HB-         5.50    (#   4662:20  Unique         4.47, 6.03 A)
 &rst
  ixpk= 4662, nxpk= 20, iat= 820,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 863, 864,
 &end
#
#  145 ARG  HN          145 ARG  HG+         5.50    (#   4663:20  Unique         1.94, 3.90 A)
 &rst
  ixpk= 4663, nxpk= 20, iat=2384,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2391,2392,
 &end
#
#  145 ARG  HN          145 ARG  HG-         5.50    (#   4664:20  Unique         1.94, 3.90 A)
 &rst
  ixpk= 4664, nxpk= 20, iat=2384,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2391,2392,
 &end
#
#    0 AMB  20-2:4665     0 AMB  20-1:4665   3.50    (#   4665:20  Double Ambig)
 &rst
  ixpk= 4665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1326,1327,1326,1327,2394,2395,2394,2395,
 igr2=1284,1285,2391,2392,2391,2392,
 &end
#
#    0 AMB  20-2:4666     0 AMB  20-1:4666   2.80    (#   4666:20  Double Ambig)
 &rst
  ixpk= 4666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=2321,2322,2394,2395,2394,2395, 708, 538, 539,
 igr2=2192,2193,2391,2392, 752, 753, 421, 422,
 &end
#
#  145 ARG  HA          145 ARG  HG+         5.50    (#   4667:20  Unique         2.17, 3.15 A)
 &rst
  ixpk= 4667, nxpk= 20, iat=2386,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2391,2392,
 &end
#
#    0 AMB  20-2:4668     0 AMB  20-1:4668   5.50    (#   4668:20  Double Ambig)
 &rst
  ixpk= 4668, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2386, 460, 461,
 igr2=2391,2392, 421, 422,
 &end
#
#  145 ARG  HN            0 AMB  20-1:4669   5.50    (#   4669:20  Single Ambig)
 &rst
  ixpk= 4669, nxpk= 20, iat=2384,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2394,2395,2394,2395,
 &end
#
#  145 ARG  HA            0 AMB  20-1:4670   5.50    (#   4670:20  Single Ambig)
 &rst
  ixpk= 4670, nxpk= 20, iat=2386,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2394,2395,2394,2395,
 &end
#
#    0 AMB  20-2:4671     0 AMB  20-1:4671   2.80    (#   4671:20  Double Ambig)
 &rst
  ixpk= 4671, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.60, r4= 6.10,
 igr1=2388,2389,2388,2389,2388,2389, 111, 112,
 igr2=2394,2395,2394,2395,2394,2395, 114, 115,
 &end
#
#  147 VAL  MGY         146 ARG  HA          5.50    (#   4672:20  Unique         5.06, 6.77 A)
 &rst
  ixpk= 4672, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4673   146 ARG  HA          5.50    (#   4673:20  Single Ambig)
 &rst
  ixpk= 4673, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#  146 ARG  HG-         146 ARG  HA          4.50    (#   4674:20  Unique         2.20, 3.14 A)
 &rst
  ixpk= 4674, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2415,2416,
 &end
#
#    0 AMB  20-2:4675   146 ARG  HA          2.80    (#   4675:20  Single Ambig)
 &rst
  ixpk= 4675, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2415,2416,2412,2413,2412,2413,
 &end
#
#  149 LYS  HB-         146 ARG  HA          4.50    (#   4676:20  Unique         2.24, 3.59 A)
 &rst
  ixpk= 4676, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2469,2470,
 &end
#
#    0 AMB  20-2:4677   146 ARG  HA          5.50    (#   4677:20  Single Ambig)
 &rst
  ixpk= 4677, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2418,2419,2418,2419,
 &end
#
#  146 ARG  HN          146 ARG  HA          4.50    (#   4678:20  Unique         2.88, 2.91 A)
 &rst
  ixpk= 4678, nxpk= 20, iat=2408,2410, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:4679   146 ARG  HA          5.50    (#   4679:20  Single Ambig)
 &rst
  ixpk= 4679, nxpk= 20, iat=  -1,2410, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2432,2448,
 &end
#
#  149 LYS  HN          146 ARG  HA          5.50    (#   4680:20  Unique         3.11, 3.51 A)
 &rst
  ixpk= 4680, nxpk= 20, iat=2465,2410, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  147 VAL  HN            0 AMB  20-1:4681   5.50    (#   4681:20  Single Ambig)
 &rst
  ixpk= 4681, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2412,2413,2412,2413,
 &end
#
#  146 ARG  HN            0 AMB  20-1:4682   4.50    (#   4682:20  Single Ambig)
 &rst
  ixpk= 4682, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2412,2413,2412,2413,
 &end
#
#  146 ARG  HA            0 AMB  20-1:4683   4.50    (#   4683:20  Single Ambig)
 &rst
  ixpk= 4683, nxpk= 20, iat=2410,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2412,2413,2412,2413,
 &end
#
#    0 AMB  20-2:4684     0 AMB  20-1:4684   4.50    (#   4684:20  Double Ambig)
 &rst
  ixpk= 4684, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2418,2419,2418,2419,2418,2419,
 igr2=2412,2413,2412,2413,2412,2413,
 &end
#
#    0 AMB  20-2:4685     0 AMB  20-1:4685   5.50    (#   4685:20  Double Ambig)
 &rst
  ixpk= 4685, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=2412,2413,2412,2413,2412,2413,
 &end
#
#  146 ARG  HA          146 ARG  HG+         5.50    (#   4686:20  Unique         2.20, 3.14 A)
 &rst
  ixpk= 4686, nxpk= 20, iat=2410,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2415,2416,
 &end
#
#  146 ARG  HN          146 ARG  HG+         5.50    (#   4687:20  Unique         2.30, 3.37 A)
 &rst
  ixpk= 4687, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2415,2416,
 &end
#
#  146 ARG  HN          146 ARG  HG-         4.50    (#   4688:20  Unique         2.30, 3.37 A)
 &rst
  ixpk= 4688, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2415,2416,
 &end
#
#  147 VAL  HN          146 ARG  HG+         5.50    (#   4689:20  Unique         2.03, 4.17 A)
 &rst
  ixpk= 4689, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2415,2416,
 &end
#
#  147 VAL  HN          146 ARG  HG-         5.50    (#   4690:20  Unique         2.03, 4.17 A)
 &rst
  ixpk= 4690, nxpk= 20, iat=2432,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2415,2416,
 &end
#
#  146 ARG  HN            0 AMB  20-1:4691   5.50    (#   4691:20  Single Ambig)
 &rst
  ixpk= 4691, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2418,2419,2418,2419,
 &end
#
#  146 ARG  HE            0 AMB  20-1:4692   4.50    (#   4692:20  Single Ambig)
 &rst
  ixpk= 4692, nxpk= 20, iat=2421,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2418,2419,2418,2419,
 &end
#
#  146 ARG  HA            0 AMB  20-1:4693   5.50    (#   4693:20  Single Ambig)
 &rst
  ixpk= 4693, nxpk= 20, iat=2410,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2418,2419,2418,2419,
 &end
#
#  147 VAL  MGY         147 VAL  HA          4.50    (#   4694:20  Unique         2.31, 3.13 A)
 &rst
  ixpk= 4694, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGX         147 VAL  HA          4.50    (#   4695:20  Unique         2.31, 3.13 A)
 &rst
  ixpk= 4695, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4696   147 VAL  HA          5.50    (#   4696:20  Single Ambig)
 &rst
  ixpk= 4696, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  20-2:4697   147 VAL  HA          5.50    (#   4697:20  Single Ambig)
 &rst
  ixpk= 4697, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1=1105,1106,1107,2353,2354,2355,2357,2358,2359,2353,
      2354,2355,2357,2358,2359,
 &end
#
#  147 VAL  HB          147 VAL  HA          5.50    (#   4698:20  Unique         2.38, 2.99 A)
 &rst
  ixpk= 4698, nxpk= 20, iat=2436,2434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4699   147 VAL  HA          5.50    (#   4699:20  Single Ambig)
 &rst
  ixpk= 4699, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2491,2492,2415,2416,
 &end
#
#    0 AMB  20-2:4700   147 VAL  HA          5.50    (#   4700:20  Single Ambig)
 &rst
  ixpk= 4700, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2491,2492,2415,2416,
 &end
#
#  150 GLU  HG-         147 VAL  HA          5.50    (#   4701:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 4701, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2494,2495,
 &end
#
#  150 GLU  HG+         147 VAL  HA          5.50    (#   4702:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 4702, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2494,2495,
 &end
#
#  144 TYR  HD          147 VAL  HA          5.50    (#   4703:20  Unique         5.04, 7.12 A)
 &rst
  ixpk= 4703, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  150 GLU  HN          147 VAL  HA          5.50    (#   4704:20  Unique         3.48, 3.79 A)
 &rst
  ixpk= 4704, nxpk= 20, iat=2487,2434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4705   147 VAL  HA          5.50    (#   4705:20  Single Ambig)
 &rst
  ixpk= 4705, nxpk= 20, iat=  -1,2434, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2432,2448,
 &end
#
#  149 LYS  HN          147 VAL  HA          5.50    (#   4706:20  Unique         4.49, 5.00 A)
 &rst
  ixpk= 4706, nxpk= 20, iat=2465,2434, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4707   147 VAL  HB          4.50    (#   4707:20  Single Ambig)
 &rst
  ixpk= 4707, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2448,2432,
 &end
#
#    0 AMB  20-2:4708   147 VAL  HB          5.50    (#   4708:20  Single Ambig)
 &rst
  ixpk= 4708, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2363,2465,
 &end
#
#  146 ARG  HN          147 VAL  HB          5.50    (#   4709:20  Unique         4.44, 4.58 A)
 &rst
  ixpk= 4709, nxpk= 20, iat=2408,2436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HD          147 VAL  HB          5.50    (#   4710:20  Unique         2.04, 4.31 A)
 &rst
  ixpk= 4710, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  144 TYR  HA          147 VAL  HB          5.50    (#   4711:20  Unique         1.97, 2.57 A)
 &rst
  ixpk= 4711, nxpk= 20, iat=2365,2436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  147 VAL  HA          147 VAL  HB          5.50    (#   4712:20  Unique         2.38, 2.99 A)
 &rst
  ixpk= 4712, nxpk= 20, iat=2434,2436, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  148 MET  HG+         147 VAL  HB          5.50    (#   4713:20  Unique         2.97, 4.45 A)
 &rst
  ixpk= 4713, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2455,2456,
 &end
#
#    0 AMB  20-2:4714   147 VAL  HB          5.50    (#   4714:20  Single Ambig)
 &rst
  ixpk= 4714, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2415,2416,2412,2413,2412,2413,2452,2453,2491,2492,
      
 &end
#
#  147 VAL  MGX         147 VAL  HB          4.50    (#   4715:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4715, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         147 VAL  HB          4.50    (#   4716:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4716, nxpk= 20, iat=  -1,2436, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#   14 VAL  MGX         147 VAL  MGX         4.50    (#   4718:20  Unique         1.98, 5.15 A)
 &rst
  ixpk= 4718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4719   147 VAL  MGX         5.50    (#   4719:20  Single Ambig)
 &rst
  ixpk= 4719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1669,1670,1671,1673,1674,1675,2296,2297,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4720   147 VAL  MGX         5.50    (#   4720:20  Single Ambig)
 &rst
  ixpk= 4720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  HB          147 VAL  MGX         3.50    (#   4721:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4721, nxpk= 20, iat=2436,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  148 MET  ME          147 VAL  MGX         5.50    (#   4722:20  Unique         3.27, 6.70 A)
 &rst
  ixpk= 4722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2459,2460,2461,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  146 ARG  HG-         147 VAL  MGX         5.50    (#   4723:20  Unique         2.25, 6.96 A)
 &rst
  ixpk= 4723, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2415,2416,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4724   147 VAL  MGX         5.50    (#   4724:20  Single Ambig)
 &rst
  ixpk= 4724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2415,2416,2412,2413,2412,2413,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  148 MET  HG-         147 VAL  MGX         5.50    (#   4725:20  Unique         2.22, 6.29 A)
 &rst
  ixpk= 4725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2455,2456,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  148 MET  HG+         147 VAL  MGX         5.50    (#   4726:20  Unique         2.22, 6.29 A)
 &rst
  ixpk= 4726, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2455,2456,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  HA          147 VAL  MGX         4.50    (#   4727:20  Unique         2.31, 3.13 A)
 &rst
  ixpk= 4727, nxpk= 20, iat=2434,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HB-         147 VAL  MGX         5.50    (#   4728:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 4728, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HB+         147 VAL  MGX         5.50    (#   4729:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 4729, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4730   147 VAL  MGX         5.50    (#   4730:20  Single Ambig)
 &rst
  ixpk= 4730, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2418,2419,2418,2419,2367,2368,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  144 TYR  HA          147 VAL  MGX         5.50    (#   4731:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 4731, nxpk= 20, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  148 MET  HA          147 VAL  MGX         5.50    (#   4732:20  Unique         3.53, 5.57 A)
 &rst
  ixpk= 4732, nxpk= 20, iat=2450,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  144 TYR  HD          147 VAL  MGX         3.50    (#   4733:20  Unique         2.09, 5.64 A)
 &rst
  ixpk= 4733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2371,2380,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HE3         147 VAL  MGX         5.50    (#   4734:20  Unique         1.99, 3.52 A)
 &rst
  ixpk= 4734, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  150 GLU  HN          147 VAL  MGX         5.50    (#   4735:20  Unique         4.48, 6.27 A)
 &rst
  ixpk= 4735, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4736   147 VAL  MGX         4.50    (#   4736:20  Single Ambig)
 &rst
  ixpk= 4736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2432,2448,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4737   147 VAL  MGX         5.50    (#   4737:20  Single Ambig)
 &rst
  ixpk= 4737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2363,2465,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  100 PHE  HN          147 VAL  MGX         5.50    (#   4738:20  Unique         5.25, 7.06 A)
 &rst
  ixpk= 4738, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4739   147 VAL  MGX         5.50    (#   4739:20  Single Ambig)
 &rst
  ixpk= 4739, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 198, 323,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HE1         147 VAL  MGY         5.50    (#   4740:20  Unique         3.30, 5.73 A)
 &rst
  ixpk= 4740, nxpk= 20, iat=1626,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  100 PHE  HN          147 VAL  MGY         5.50    (#   4741:20  Unique         5.25, 7.06 A)
 &rst
  ixpk= 4741, nxpk= 20, iat=1640,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4742   147 VAL  MGY         5.50    (#   4742:20  Single Ambig)
 &rst
  ixpk= 4742, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2363,2465,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4743   147 VAL  MGY         3.50    (#   4743:20  Single Ambig)
 &rst
  ixpk= 4743, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2432,2448,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4744   147 VAL  MGY         5.50    (#   4744:20  Single Ambig)
 &rst
  ixpk= 4744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1616,2347,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  146 ARG  HN          147 VAL  MGY         5.50    (#   4745:20  Unique         3.25, 5.72 A)
 &rst
  ixpk= 4745, nxpk= 20, iat=2408,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4746   147 VAL  MGY         5.50    (#   4746:20  Single Ambig)
 &rst
  ixpk= 4746, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1629,2421,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HE3         147 VAL  MGY         5.50    (#   4747:20  Unique         1.99, 3.52 A)
 &rst
  ixpk= 4747, nxpk= 20, iat=1635,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  144 TYR  HD          147 VAL  MGY         4.50    (#   4748:20  Unique         2.09, 5.64 A)
 &rst
  ixpk= 4748, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2371,2380,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  144 TYR  HA          147 VAL  MGY         5.50    (#   4749:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 4749, nxpk= 20, iat=2365,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4750   147 VAL  MGY         5.50    (#   4750:20  Single Ambig)
 &rst
  ixpk= 4750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2418,2419,2418,2419,2367,2368,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HB+         147 VAL  MGY         5.50    (#   4751:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 4751, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   99 TRP  HB-         147 VAL  MGY         5.50    (#   4752:20  Unique         1.97, 4.03 A)
 &rst
  ixpk= 4752, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1620,1621,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  HA          147 VAL  MGY         3.50    (#   4753:20  Unique         2.31, 3.13 A)
 &rst
  ixpk= 4753, nxpk= 20, iat=2434,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  148 MET  HG-         147 VAL  MGY         5.50    (#   4754:20  Unique         2.22, 6.29 A)
 &rst
  ixpk= 4754, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2455,2456,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4755   147 VAL  MGY         4.50    (#   4755:20  Single Ambig)
 &rst
  ixpk= 4755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=2415,2416,2412,2413,2412,2413,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  146 ARG  HG-         147 VAL  MGY         5.50    (#   4756:20  Unique         2.25, 6.96 A)
 &rst
  ixpk= 4756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2415,2416,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  HB          147 VAL  MGY         2.80    (#   4757:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4757, nxpk= 20, iat=2436,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4758   147 VAL  MGY         2.80    (#   4758:20  Single Ambig)
 &rst
  ixpk= 4758, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4759   147 VAL  MGY         2.80    (#   4759:20  Single Ambig)
 &rst
  ixpk= 4759, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#   14 VAL  MGX         147 VAL  MGY         5.50    (#   4760:20  Unique         1.98, 5.15 A)
 &rst
  ixpk= 4760, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGX         148 MET  HA          5.50    (#   4762:20  Unique         3.53, 5.57 A)
 &rst
  ixpk= 4762, nxpk= 20, iat=  -1,2450, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  20-2:4763     0 AMB  20-1:4763   5.50    (#   4763:20  Double Ambig)
 &rst
  ixpk= 4763, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2459,2460,2461,2703,2704,
 igr2=2450,2641,
 &end
#
#  160 GLU  HB-         160 GLU  HA          2.80    (#   4764:20  Unique         2.54, 2.80 A)
 &rst
  ixpk= 4764, nxpk= 20, iat=  -1,2641, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2643,2644,
 &end
#
#    0 AMB  20-2:4765     0 AMB  20-1:4765   3.50    (#   4765:20  Double Ambig)
 &rst
  ixpk= 4765, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2626,2627,2643,2644,
 igr2=2624,2641,
 &end
#
#    0 AMB  20-2:4766     0 AMB  20-1:4766   2.80    (#   4766:20  Double Ambig)
 &rst
  ixpk= 4766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=2646,2647,2629,2630,
 igr2=2641,2624,
 &end
#
#  148 MET  HG+         148 MET  HA          5.50    (#   4767:20  Unique         2.17, 3.39 A)
 &rst
  ixpk= 4767, nxpk= 20, iat=  -1,2450, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2455,2456,
 &end
#
#  144 TYR  HD          148 MET  HA          5.50    (#   4768:20  Unique         4.48, 7.25 A)
 &rst
  ixpk= 4768, nxpk= 20, iat=  -1,2450, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#    0 AMB  20-2:4769     0 AMB  20-1:4769   3.50    (#   4769:20  Double Ambig)
 &rst
  ixpk= 4769, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2622,2522,
 igr2=2624,2450,
 &end
#
#  160 GLU  HN            0 AMB  20-1:4770   2.80    (#   4770:20  Single Ambig)
 &rst
  ixpk= 4770, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=2641,2624,
 &end
#
#  161 ASN  HN          160 GLU  HA          3.50    (#   4771:20  Unique         2.90, 3.04 A)
 &rst
  ixpk= 4771, nxpk= 20, iat=2654,2641, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  148 MET  HN          148 MET  HB-         5.50    (#   4772:20  Unique         2.20, 3.09 A)
 &rst
  ixpk= 4772, nxpk= 20, iat=2448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2452,2453,
 &end
#
#  148 MET  HN          148 MET  HB+         5.50    (#   4773:20  Unique         2.20, 3.09 A)
 &rst
  ixpk= 4773, nxpk= 20, iat=2448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2452,2453,
 &end
#
#  148 MET  HG+         148 MET  HB-         5.50    (#   4774:20  Unique         2.20, 2.59 A)
 &rst
  ixpk= 4774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2455,2456,
 igr2=2452,2453,
 &end
#
#    0 AMB  20-2:4775     0 AMB  20-1:4775   5.50    (#   4775:20  Double Ambig)
 &rst
  ixpk= 4775, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2455,2456, 728, 729, 728, 729,
 igr2=2452,2453, 710, 711,
 &end
#
#  148 MET  HG-         148 MET  HB-         5.50    (#   4776:20  Unique         2.20, 2.59 A)
 &rst
  ixpk= 4776, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2455,2456,
 igr2=2452,2453,
 &end
#
#  148 MET  HN          148 MET  HG-         5.50    (#   4778:20  Unique         1.92, 3.02 A)
 &rst
  ixpk= 4778, nxpk= 20, iat=2448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2455,2456,
 &end
#
#  148 MET  HN          148 MET  HG+         5.50    (#   4779:20  Unique         1.92, 3.02 A)
 &rst
  ixpk= 4779, nxpk= 20, iat=2448,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2455,2456,
 &end
#
#  148 MET  ME          148 MET  HG+         5.50    (#   4780:20  Unique         2.04, 3.36 A)
 &rst
  ixpk= 4780, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2459,2460,2461,
 igr2=2455,2456,
 &end
#
#  148 MET  ME          148 MET  HG-         4.50    (#   4781:20  Unique         2.04, 3.36 A)
 &rst
  ixpk= 4781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2459,2460,2461,
 igr2=2455,2456,
 &end
#
#  133 VAL  MGY         148 MET  HG+         5.50    (#   4782:20  Unique         1.98, 4.72 A)
 &rst
  ixpk= 4782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2455,2456,
 &end
#
#  133 VAL  MGY         148 MET  HG-         4.50    (#   4783:20  Unique         1.98, 4.72 A)
 &rst
  ixpk= 4783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2175,2176,2177,2179,2180,2181,
 igr2=2455,2456,
 &end
#
#  147 VAL  MGX         148 MET  HG+         5.50    (#   4784:20  Unique         2.22, 6.29 A)
 &rst
  ixpk= 4784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=2455,2456,
 &end
#
#  147 VAL  MGX         148 MET  HG-         5.50    (#   4785:20  Unique         2.22, 6.29 A)
 &rst
  ixpk= 4785, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=2455,2456,
 &end
#
#    0 AMB  20-2:4786   148 MET  ME          5.50    (#   4786:20  Single Ambig)
 &rst
  ixpk= 4786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2448,2432,
 igr2=2459,2460,2461,
 &end
#
#  131 TYR  HN          148 MET  ME          5.50    (#   4787:20  Unique         3.49, 5.56 A)
 &rst
  ixpk= 4787, nxpk= 20, iat=2134,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#  130 TRP  HN          148 MET  ME          5.50    (#   4788:20  Unique         2.03, 5.15 A)
 &rst
  ixpk= 4788, nxpk= 20, iat=2110,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#  134 ARG  HN          148 MET  ME          5.50    (#   4790:20  Unique         5.01, 7.21 A)
 &rst
  ixpk= 4790, nxpk= 20, iat=2185,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#  144 TYR  HD          148 MET  ME          5.50    (#   4791:20  Unique         1.99, 5.01 A)
 &rst
  ixpk= 4791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2371,2380,
 igr2=2459,2460,2461,
 &end
#
#  135 GLN  HN          148 MET  ME          5.50    (#   4792:20  Unique         5.55, 7.70 A)
 &rst
  ixpk= 4792, nxpk= 20, iat=2209,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#    0 AMB  20-2:4793   148 MET  ME          4.50    (#   4793:20  Single Ambig)
 &rst
  ixpk= 4793, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2097,2106,2099,2104,
 igr2=2459,2460,2461,
 &end
#
#  148 MET  HA          148 MET  ME          5.50    (#   4794:20  Unique         1.97, 4.69 A)
 &rst
  ixpk= 4794, nxpk= 20, iat=2450,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#  129 TYR  HA          148 MET  ME          5.50    (#   4795:20  Unique         2.60, 4.32 A)
 &rst
  ixpk= 4795, nxpk= 20, iat=2091,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#  132 PRO  HD-         148 MET  ME          5.50    (#   4796:20  Unique         2.55, 4.73 A)
 &rst
  ixpk= 4796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2156,2157,
 igr2=2459,2460,2461,
 &end
#
#  148 MET  HG+         148 MET  ME          5.50    (#   4798:20  Unique         2.04, 3.36 A)
 &rst
  ixpk= 4798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2455,2456,
 igr2=2459,2460,2461,
 &end
#
#  148 MET  HG-         148 MET  ME          4.50    (#   4799:20  Unique         2.04, 3.36 A)
 &rst
  ixpk= 4799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2455,2456,
 igr2=2459,2460,2461,
 &end
#
#  148 MET  HB+         148 MET  ME          5.50    (#   4800:20  Unique         1.98, 4.70 A)
 &rst
  ixpk= 4800, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2452,2453,
 igr2=2459,2460,2461,
 &end
#
#    0 AMB  20-2:4802   148 MET  ME          4.50    (#   4802:20  Single Ambig)
 &rst
  ixpk= 4802, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1=2175,2176,2177,2179,2180,2181,2175,2176,2177,2179,
      2180,2181,2162,2163,
 igr2=2459,2460,2461,
 &end
#
#    0 AMB  20-2:4803   148 MET  ME          2.80    (#   4803:20  Single Ambig)
 &rst
  ixpk= 4803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 329, 330, 331, 333, 334, 335, 329, 330, 331, 333,
       334, 335,
 igr2=2459,2460,2461,
 &end
#
#  132 PRO  HG-         148 MET  ME          4.50    (#   4804:20  Unique         1.97, 3.24 A)
 &rst
  ixpk= 4804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2159,2160,
 igr2=2459,2460,2461,
 &end
#
#   14 VAL  MGY         148 MET  ME          4.50    (#   4805:20  Unique         3.94, 7.14 A)
 &rst
  ixpk= 4805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2459,2460,2461,
 &end
#
#  147 VAL  MGX         148 MET  ME          5.50    (#   4806:20  Unique         3.27, 6.70 A)
 &rst
  ixpk= 4806, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2438,2439,2440,2442,2443,2444,
 igr2=2459,2460,2461,
 &end
#
#    0 AMB  20-2:4807   157 SER  HA          3.50    (#   4807:20  Single Ambig)
 &rst
  ixpk= 4807, nxpk= 20, iat=  -1,2594, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2663,2664,2592,
 &end
#
#  130 TRP  HH2         149 LYS  HA          5.50    (#   4808:20  Unique         1.97, 2.25 A)
 &rst
  ixpk= 4808, nxpk= 20, iat=2125,2467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HN          149 LYS  HA          5.50    (#   4809:20  Unique         3.30, 3.43 A)
 &rst
  ixpk= 4809, nxpk= 20, iat=2487,2467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HN          149 LYS  HA          5.50    (#   4810:20  Unique         2.73, 2.80 A)
 &rst
  ixpk= 4810, nxpk= 20, iat=2465,2467, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HN          149 LYS  HB-         4.50    (#   4811:20  Unique         2.14, 2.55 A)
 &rst
  ixpk= 4811, nxpk= 20, iat=2465,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2469,2470,
 &end
#
#    0 AMB  20-2:4812     0 AMB  20-1:4812   5.50    (#   4812:20  Double Ambig)
 &rst
  ixpk= 4812, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2478,2479,2478,2479,
 igr2=2472,2473,2472,2473,
 &end
#
#  149 LYS  HA          149 LYS  HG+         5.50    (#   4813:20  Unique         2.22, 3.08 A)
 &rst
  ixpk= 4813, nxpk= 20, iat=2467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#  130 TRP  HH2         149 LYS  HG+         5.50    (#   4814:20  Unique         3.25, 4.36 A)
 &rst
  ixpk= 4814, nxpk= 20, iat=2125,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#    0 AMB  20-2:4815     0 AMB  20-1:4815   5.50    (#   4815:20  Double Ambig)
 &rst
  ixpk= 4815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2125,1359,
 igr2=2472,2473,1301,1302,
 &end
#
#  150 GLU  HN          149 LYS  HG+         5.50    (#   4816:20  Unique         2.38, 4.84 A)
 &rst
  ixpk= 4816, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#  150 GLU  HN          149 LYS  HG-         5.50    (#   4817:20  Unique         2.38, 4.84 A)
 &rst
  ixpk= 4817, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#  149 LYS  HN          149 LYS  HG+         5.50    (#   4818:20  Unique         3.03, 4.41 A)
 &rst
  ixpk= 4818, nxpk= 20, iat=2465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#  149 LYS  HN          149 LYS  HG-         5.50    (#   4819:20  Unique         3.03, 4.41 A)
 &rst
  ixpk= 4819, nxpk= 20, iat=2465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2472,2473,
 &end
#
#    0 AMB  20-2:4820     0 AMB  20-1:4820   4.50    (#   4820:20  Double Ambig)
 &rst
  ixpk= 4820, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2478,2479,2478,2479,
 igr2=2475,2476,2475,2476,
 &end
#
#    0 AMB  20-2:4821   149 LYS  HD-         3.50    (#   4821:20  Single Ambig)
 &rst
  ixpk= 4821, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2478,2479,2478,2479,
 igr2=2475,2476,
 &end
#
#  150 GLU  HB-         150 GLU  HA          4.50    (#   4822:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 4822, nxpk= 20, iat=  -1,2489, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2491,2492,
 &end
#
#  150 GLU  HB+         150 GLU  HA          4.50    (#   4823:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 4823, nxpk= 20, iat=  -1,2489, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2491,2492,
 &end
#
#  150 GLU  HG-         150 GLU  HA          3.50    (#   4824:20  Unique         2.12, 2.94 A)
 &rst
  ixpk= 4824, nxpk= 20, iat=  -1,2489, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2494,2495,
 &end
#
#  150 GLU  HG+         150 GLU  HA          4.50    (#   4825:20  Unique         2.12, 2.94 A)
 &rst
  ixpk= 4825, nxpk= 20, iat=  -1,2489, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2494,2495,
 &end
#
#  150 GLU  HN          150 GLU  HA          4.50    (#   4826:20  Unique         2.74, 2.80 A)
 &rst
  ixpk= 4826, nxpk= 20, iat=2487,2489, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  150 GLU  HA          150 GLU  HB+         5.50    (#   4827:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 4827, nxpk= 20, iat=2489,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2491,2492,
 &end
#
#  150 GLU  HA          150 GLU  HB-         4.50    (#   4828:20  Unique         2.47, 2.81 A)
 &rst
  ixpk= 4828, nxpk= 20, iat=2489,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2491,2492,
 &end
#
#    0 AMB  20-2:4829     0 AMB  20-1:4829   5.50    (#   4829:20  Double Ambig)
 &rst
  ixpk= 4829, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2494,2495,2494,2495,
 igr2=2491,2492,2415,2416,
 &end
#
#    0 AMB  20-2:4830     0 AMB  20-1:4830   5.50    (#   4830:20  Double Ambig)
 &rst
  ixpk= 4830, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2494,2495,2494,2495,
 igr2=2491,2492,2415,2416,
 &end
#
#  150 GLU  HG-           0 AMB  20-1:4831   5.50    (#   4831:20  Single Ambig)
 &rst
  ixpk= 4831, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2494,2495,
 igr2=2491,2492,2415,2416,
 &end
#
#  150 GLU  HG-           0 AMB  20-1:4832   4.50    (#   4832:20  Single Ambig)
 &rst
  ixpk= 4832, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2494,2495,
 igr2=2491,2492,2415,2416,
 &end
#
#   71 THR  MG2         150 GLU  HG-         5.50    (#   4833:20  Unique         2.56, 5.75 A)
 &rst
  ixpk= 4833, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1105,1106,1107,
 igr2=2494,2495,
 &end
#
#    0 AMB  20-2:4834     0 AMB  20-1:4834   4.50    (#   4834:20  Double Ambig)
 &rst
  ixpk= 4834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=2491,2492,2415,2416,2159,2160,
 igr2=2494,2495,2494,2495, 327,
 &end
#
#    0 AMB  20-2:4835   150 GLU  HG-         4.50    (#   4835:20  Single Ambig)
 &rst
  ixpk= 4835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2491,2492,2415,2416,
 igr2=2494,2495,
 &end
#
#    0 AMB  20-2:4836     0 AMB  20-1:4836   4.50    (#   4836:20  Double Ambig)
 &rst
  ixpk= 4836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2491,2492,2412,2413,
 igr2=2494,2495,2494,2495,
 &end
#
#    0 AMB  20-2:4837   150 GLU  HG-         4.50    (#   4837:20  Single Ambig)
 &rst
  ixpk= 4837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2491,2492,2412,2413,
 igr2=2494,2495,
 &end
#
#  150 GLU  HA          150 GLU  HG+         4.50    (#   4838:20  Unique         2.12, 2.94 A)
 &rst
  ixpk= 4838, nxpk= 20, iat=2489,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2494,2495,
 &end
#
#  150 GLU  HA          150 GLU  HG-         5.50    (#   4839:20  Unique         2.12, 2.94 A)
 &rst
  ixpk= 4839, nxpk= 20, iat=2489,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2494,2495,
 &end
#
#  150 GLU  HN          150 GLU  HG+         5.50    (#   4842:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 4842, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2494,2495,
 &end
#
#  150 GLU  HN          150 GLU  HG-         5.50    (#   4843:20  Unique         2.29, 3.20 A)
 &rst
  ixpk= 4843, nxpk= 20, iat=2487,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2494,2495,
 &end
#
#  151 PHE  HN          151 PHE  HB+         5.50    (#   4844:20  Unique         2.60, 3.36 A)
 &rst
  ixpk= 4844, nxpk= 20, iat=2502,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2506,2507,
 &end
#
#  151 PHE  HN          151 PHE  HB-         5.50    (#   4845:20  Unique         2.60, 3.36 A)
 &rst
  ixpk= 4845, nxpk= 20, iat=2502,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2506,2507,
 &end
#
#  103 GLN  HE2-        151 PHE  HB-         5.50    (#   4847:20  Unique         5.26, 6.90 A)
 &rst
  ixpk= 4847, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1710,1711,
 igr2=2506,2507,
 &end
#
#  151 PHE  HA          151 PHE  HB+         5.50    (#   4848:20  Unique         2.24, 2.65 A)
 &rst
  ixpk= 4848, nxpk= 20, iat=2504,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2506,2507,
 &end
#
#  151 PHE  HA          151 PHE  HB-         5.50    (#   4849:20  Unique         2.24, 2.65 A)
 &rst
  ixpk= 4849, nxpk= 20, iat=2504,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2506,2507,
 &end
#
#    0 AMB  20-2:4850     0 AMB  20-1:4850   5.50    (#   4850:20  Double Ambig)
 &rst
  ixpk= 4850, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=1667,2549,2550,2551,2553,2554,2555,1664,1665,
 igr2=2506,2507,2506,2507,2506,2507,
 &end
#
#    0 AMB  20-2:4851   151 PHE  HB-         5.50    (#   4851:20  Single Ambig)
 &rst
  ixpk= 4851, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1667,2549,2550,2551,2553,2554,2555,1664,1665,
 igr2=2506,2507,
 &end
#
#  101 LEU  MDX         151 PHE  HB+         5.50    (#   4852:20  Unique         1.99, 4.13 A)
 &rst
  ixpk= 4852, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=2506,2507,
 &end
#
#  101 LEU  MDY         151 PHE  HB+         5.50    (#   4853:20  Unique         1.99, 4.13 A)
 &rst
  ixpk= 4853, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=2506,2507,
 &end
#
#  101 LEU  MDY         151 PHE  HB-         5.50    (#   4854:20  Unique         1.99, 4.13 A)
 &rst
  ixpk= 4854, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=2506,2507,
 &end
#
#   14 VAL  MGY         151 PHE  HB-         5.50    (#   4855:20  Unique         3.71, 7.36 A)
 &rst
  ixpk= 4855, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 204, 205, 206, 208, 209, 210,
 igr2=2506,2507,
 &end
#
#  155 VAL  MGX         152 ALA  HA          5.50    (#   4856:20  Unique         2.32, 5.24 A)
 &rst
  ixpk= 4856, nxpk= 20, iat=  -1,2524, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#  155 VAL  MGY         152 ALA  HA          5.50    (#   4857:20  Unique         2.32, 5.24 A)
 &rst
  ixpk= 4857, nxpk= 20, iat=  -1,2524, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#  152 ALA  MB          152 ALA  HA          3.50    (#   4858:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4858, nxpk= 20, iat=  -1,2524, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2526,2527,2528,
 &end
#
#  129 TYR  HE          152 ALA  HA          5.50    (#   4859:20  Unique         2.06, 3.60 A)
 &rst
  ixpk= 4859, nxpk= 20, iat=  -1,2524, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2104,
 &end
#
#    0 AMB  20-2:4860   152 ALA  HA          4.50    (#   4860:20  Single Ambig)
 &rst
  ixpk= 4860, nxpk= 20, iat=  -1,2524, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2522,2123,
 &end
#
#  151 PHE  HN          152 ALA  HA          5.50    (#   4861:20  Unique         4.16, 4.33 A)
 &rst
  ixpk= 4861, nxpk= 20, iat=2502,2524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HN          152 ALA  HA          5.50    (#   4862:20  Unique         4.07, 4.53 A)
 &rst
  ixpk= 4862, nxpk= 20, iat=2575,2524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  153 SER  HN          152 ALA  HA          5.50    (#   4863:20  Unique         3.45, 3.53 A)
 &rst
  ixpk= 4863, nxpk= 20, iat=2532,2524, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4864   152 ALA  MB          5.50    (#   4864:20  Single Ambig)
 &rst
  ixpk= 4864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1669,1670,1671,1673,1674,1675, 204, 205, 206, 208,
       209, 210,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4865   152 ALA  MB          5.50    (#   4865:20  Single Ambig)
 &rst
  ixpk= 4865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4866   152 ALA  MB          5.50    (#   4866:20  Single Ambig)
 &rst
  ixpk= 4866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,2175,2176,2177,2179,2180,2181,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4867   152 ALA  MB          5.50    (#   4867:20  Single Ambig)
 &rst
  ixpk= 4867, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2469,2470,2579,2580,2579,2580,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4868   152 ALA  MB          5.50    (#   4868:20  Single Ambig)
 &rst
  ixpk= 4868, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1=2547, 313, 314,2643,2644,2388,2389,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4869   152 ALA  MB          5.50    (#   4869:20  Single Ambig)
 &rst
  ixpk= 4869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2582,2583,2455,2456,2093,2094,
 igr2=2526,2527,2528,
 &end
#
#  156 MET  HG+         152 ALA  MB          5.50    (#   4870:20  Unique         3.28, 5.90 A)
 &rst
  ixpk= 4870, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2582,2583,
 igr2=2526,2527,2528,
 &end
#
#  152 ALA  HA          152 ALA  MB          3.50    (#   4871:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4871, nxpk= 20, iat=2524,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4872   152 ALA  MB          5.50    (#   4872:20  Single Ambig)
 &rst
  ixpk= 4872, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2536,2537,2536,2537,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4873   152 ALA  MB          5.50    (#   4873:20  Single Ambig)
 &rst
  ixpk= 4873, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2534,2489,
 igr2=2526,2527,2528,
 &end
#
#  148 MET  HA          152 ALA  MB          5.50    (#   4874:20  Unique         3.30, 5.13 A)
 &rst
  ixpk= 4874, nxpk= 20, iat=2450,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2526,2527,2528,
 &end
#
#  149 LYS  HA          152 ALA  MB          4.50    (#   4875:20  Unique         1.98, 3.05 A)
 &rst
  ixpk= 4875, nxpk= 20, iat=2467,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4876   152 ALA  MB          4.50    (#   4876:20  Single Ambig)
 &rst
  ixpk= 4876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2099,2104,2097,2106,
 igr2=2526,2527,2528,
 &end
#
#  130 TRP  HH2         152 ALA  MB          5.50    (#   4878:20  Unique         1.99, 2.69 A)
 &rst
  ixpk= 4878, nxpk= 20, iat=2125,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4879   152 ALA  MB          5.50    (#   4879:20  Single Ambig)
 &rst
  ixpk= 4879, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2543,2118,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4880   152 ALA  MB          2.80    (#   4880:20  Single Ambig)
 &rst
  ixpk= 4880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2123,2522,
 igr2=2526,2527,2528,
 &end
#
#  151 PHE  HN          152 ALA  MB          5.50    (#   4881:20  Unique         3.90, 5.08 A)
 &rst
  ixpk= 4881, nxpk= 20, iat=2502,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2526,2527,2528,
 &end
#
#    0 AMB  20-2:4882   152 ALA  MB          5.50    (#   4882:20  Single Ambig)
 &rst
  ixpk= 4882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2575,2089,
 igr2=2526,2527,2528,
 &end
#
#  149 LYS  HN          152 ALA  MB          5.50    (#   4883:20  Unique         3.95, 5.10 A)
 &rst
  ixpk= 4883, nxpk= 20, iat=2465,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2526,2527,2528,
 &end
#
#  153 SER  HN          152 ALA  MB          4.50    (#   4884:20  Unique         2.39, 3.43 A)
 &rst
  ixpk= 4884, nxpk= 20, iat=2532,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2526,2527,2528,
 &end
#
#  130 TRP  HE1         152 ALA  MB          5.50    (#   4885:20  Unique         4.23, 5.51 A)
 &rst
  ixpk= 4885, nxpk= 20, iat=2120,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2526,2527,2528,
 &end
#
#  153 SER  HN          153 SER  HA          5.50    (#   4886:20  Unique         2.84, 2.89 A)
 &rst
  ixpk= 4886, nxpk= 20, iat=2532,2534, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HN          153 SER  HA          5.50    (#   4887:20  Unique         2.97, 3.47 A)
 &rst
  ixpk= 4887, nxpk= 20, iat=2575,2534, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4888   153 SER  HA          5.50    (#   4888:20  Single Ambig)
 &rst
  ixpk= 4888, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2592,2522,
 &end
#
#  154 VAL  HN          153 SER  HA          5.50    (#   4889:20  Unique         3.31, 3.41 A)
 &rst
  ixpk= 4889, nxpk= 20, iat=2543,2534, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4890   153 SER  HA          3.50    (#   4890:20  Single Ambig)
 &rst
  ixpk= 4890, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2536,2537,2536,2537,
 &end
#
#  156 MET  HG+         153 SER  HA          5.50    (#   4891:20  Unique         1.96, 3.03 A)
 &rst
  ixpk= 4891, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#  156 MET  HG-         153 SER  HA          5.50    (#   4892:20  Unique         1.96, 3.03 A)
 &rst
  ixpk= 4892, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#    0 AMB  20-2:4893   153 SER  HA          4.50    (#   4893:20  Single Ambig)
 &rst
  ixpk= 4893, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2579,2580,2579,2580,
 &end
#
#    0 AMB  20-2:4894   153 SER  HA          5.50    (#   4894:20  Single Ambig)
 &rst
  ixpk= 4894, nxpk= 20, iat=  -1,2534, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2526,2527,2528,2563,
 &end
#
#  154 VAL  MGX           0 AMB  20-1:4895   5.50    (#   4895:20  Single Ambig)
 &rst
  ixpk= 4895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2549,2550,2551,2553,2554,2555,
 igr2=2536,2537,2536,2537,
 &end
#
#  154 VAL  MGY           0 AMB  20-1:4896   5.50    (#   4896:20  Single Ambig)
 &rst
  ixpk= 4896, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2549,2550,2551,2553,2554,2555,
 igr2=2536,2537,2536,2537,
 &end
#
#  152 ALA  MB            0 AMB  20-1:4897   5.50    (#   4897:20  Single Ambig)
 &rst
  ixpk= 4897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2526,2527,2528,
 igr2=2536,2537,2536,2537,
 &end
#
#    0 AMB  20-2:4898     0 AMB  20-1:4898   5.50    (#   4898:20  Double Ambig)
 &rst
  ixpk= 4898, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=2579,2580,2579,2580,2579,2580,
 igr2=2536,2537,2536,2537,2536,2537,
 &end
#
#    0 AMB  20-2:4899     0 AMB  20-1:4899   5.50    (#   4899:20  Double Ambig)
 &rst
  ixpk= 4899, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2643,2644,2626,2627,
 igr2=2536,2537,2536,2537,
 &end
#
#  154 VAL  HN            0 AMB  20-1:4901   5.50    (#   4901:20  Single Ambig)
 &rst
  ixpk= 4901, nxpk= 20, iat=2543,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2536,2537,2536,2537,
 &end
#
#    0 AMB  20-2:4902     0 AMB  20-1:4902   5.50    (#   4902:20  Double Ambig)
 &rst
  ixpk= 4902, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2522,2123,
 igr2=2536,2537,2536,2537,2536,2537,
 &end
#
#  153 SER  HN            0 AMB  20-1:4903   4.50    (#   4903:20  Single Ambig)
 &rst
  ixpk= 4903, nxpk= 20, iat=2532,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2536,2537,2536,2537,
 &end
#
#  157 SER  HN          154 VAL  HA          5.50    (#   4904:20  Unique         3.57, 3.90 A)
 &rst
  ixpk= 4904, nxpk= 20, iat=2592,2545, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  154 VAL  HN          154 VAL  HA          4.50    (#   4905:20  Unique         2.74, 2.83 A)
 &rst
  ixpk= 4905, nxpk= 20, iat=2543,2545, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  154 VAL  HB          154 VAL  HA          5.50    (#   4906:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 4906, nxpk= 20, iat=2547,2545, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-2:4907   154 VAL  HA          5.50    (#   4907:20  Single Ambig)
 &rst
  ixpk= 4907, nxpk= 20, iat=  -1,2545, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2563,2607,2608,
 &end
#
#   68 LEU  HB+         154 VAL  HA          5.50    (#   4908:20  Unique         5.57, 6.50 A)
 &rst
  ixpk= 4908, nxpk= 20, iat=  -1,2545, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#  154 VAL  MGX         154 VAL  HA          3.50    (#   4909:20  Unique         2.29, 3.11 A)
 &rst
  ixpk= 4909, nxpk= 20, iat=  -1,2545, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  MGY         154 VAL  HA          3.50    (#   4910:20  Unique         2.29, 3.11 A)
 &rst
  ixpk= 4910, nxpk= 20, iat=  -1,2545, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  MGY         154 VAL  HB          4.50    (#   4912:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4912, nxpk= 20, iat=  -1,2547, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#    0 AMB  20-2:4913   154 VAL  HB          4.50    (#   4913:20  Single Ambig)
 &rst
  ixpk= 4913, nxpk= 20, iat=  -1,2547, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=2549,2550,2551,2553,2554,2555,1667,2565,2566,2567,
      2569,2570,2571,
 &end
#
#  151 PHE  HA          154 VAL  MGX         5.50    (#   4914:20  Unique         2.00, 4.25 A)
 &rst
  ixpk= 4914, nxpk= 20, iat=2504,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  HA          154 VAL  MGX         2.80    (#   4915:20  Unique         2.29, 3.11 A)
 &rst
  ixpk= 4915, nxpk= 20, iat=2545,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  HB          154 VAL  MGY         3.50    (#   4916:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4916, nxpk= 20, iat=2547,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  HA          154 VAL  MGY         3.50    (#   4917:20  Unique         2.29, 3.11 A)
 &rst
  ixpk= 4917, nxpk= 20, iat=2545,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  HN          154 VAL  MGY         4.50    (#   4918:20  Unique         2.08, 3.85 A)
 &rst
  ixpk= 4918, nxpk= 20, iat=2543,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#  156 MET  HN          155 VAL  HA          5.50    (#   4919:20  Unique         3.49, 3.54 A)
 &rst
  ixpk= 4919, nxpk= 20, iat=2575,2561, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  155 VAL  HN          155 VAL  HA          4.50    (#   4921:20  Unique         2.77, 2.88 A)
 &rst
  ixpk= 4921, nxpk= 20, iat=2559,2561, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:4922   155 VAL  HA          5.50    (#   4922:20  Single Ambig)
 &rst
  ixpk= 4922, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2577,2605,
 &end
#
#    0 AMB  20-2:4923   155 VAL  HA          5.50    (#   4923:20  Single Ambig)
 &rst
  ixpk= 4923, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2596,2597,2596,2597, 301, 302,
 &end
#
#    0 AMB  20-2:4924   155 VAL  HA          5.50    (#   4924:20  Single Ambig)
 &rst
  ixpk= 4924, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1705,1706,1705,1706,2579,2580,2579,2580,
 &end
#
#    0 AMB  20-2:4925   155 VAL  HA          5.50    (#   4925:20  Single Ambig)
 &rst
  ixpk= 4925, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2547, 262, 263,
 &end
#
#    0 AMB  20-2:4926   155 VAL  HA          4.50    (#   4926:20  Single Ambig)
 &rst
  ixpk= 4926, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2610,2607,2608,
 &end
#
#    0 AMB  20-2:4927   155 VAL  HA          4.50    (#   4927:20  Single Ambig)
 &rst
  ixpk= 4927, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2563,2607,2608,
 &end
#
#    0 AMB  20-2:4928   155 VAL  HA          3.50    (#   4928:20  Single Ambig)
 &rst
  ixpk= 4928, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 &end
#
#    0 AMB  20-2:4929   155 VAL  HA          3.50    (#   4929:20  Single Ambig)
 &rst
  ixpk= 4929, nxpk= 20, iat=  -1,2561, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2612,2613,2614,2616,2617,2618,2565,2566,2567,2569,
      2570,2571,
 &end
#
#  155 VAL  MGX         155 VAL  HB          3.50    (#   4930:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 4930, nxpk= 20, iat=  -1,2563, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:4931   155 VAL  HB          4.50    (#   4931:20  Single Ambig)
 &rst
  ixpk= 4931, nxpk= 20, iat=  -1,2563, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1=2565,2566,2567,2569,2570,2571,1667,
 &end
#
#  155 VAL  HA          155 VAL  HB          5.50    (#   4932:20  Unique         2.41, 2.68 A)
 &rst
  ixpk= 4932, nxpk= 20, iat=2561,2563, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  HA          155 VAL  HB          5.50    (#   4933:20  Unique         3.65, 4.75 A)
 &rst
  ixpk= 4933, nxpk= 20, iat=2524,2563, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HE          155 VAL  HB          5.50    (#   4934:20  Unique         1.95, 4.64 A)
 &rst
  ixpk= 4934, nxpk= 20, iat=  -1,2563, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2104,
 &end
#
#  155 VAL  HN          155 VAL  HB          4.50    (#   4935:20  Unique         2.47, 2.71 A)
 &rst
  ixpk= 4935, nxpk= 20, iat=2559,2563, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  156 MET  HN          155 VAL  HB          5.50    (#   4936:20  Unique         2.07, 3.27 A)
 &rst
  ixpk= 4936, nxpk= 20, iat=2575,2563, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HN          155 VAL  MGX         4.50    (#   4937:20  Unique         1.91, 3.95 A)
 &rst
  ixpk= 4937, nxpk= 20, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#  101 LEU  MDY         155 VAL  MGY         3.50    (#   4939:20  Unique         1.99, 5.47 A)
 &rst
  ixpk= 4939, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:4940   155 VAL  MGY         5.50    (#   4940:20  Single Ambig)
 &rst
  ixpk= 4940, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1082,1083,1084,2459,2460,2461,1063,1064,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:4941   155 VAL  MGY         3.50    (#   4941:20  Single Ambig)
 &rst
  ixpk= 4941, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2563,2607,2608,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#  155 VAL  HA          155 VAL  MGY         3.50    (#   4942:20  Unique         2.21, 3.33 A)
 &rst
  ixpk= 4942, nxpk= 20, iat=2561,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:4943   155 VAL  MGY         4.50    (#   4943:20  Single Ambig)
 &rst
  ixpk= 4943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2099,2104,2097,2106,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  20-2:4944   155 VAL  MGY         3.50    (#   4944:20  Single Ambig)
 &rst
  ixpk= 4944, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2559, 306,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#  156 MET  HN          155 VAL  MGY         5.50    (#   4945:20  Unique         1.91, 3.95 A)
 &rst
  ixpk= 4945, nxpk= 20, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2565,2566,2567,2569,2570,2571,
 &end
#
#  156 MET  HN          156 MET  HA          4.50    (#   4946:20  Unique         2.75, 2.82 A)
 &rst
  ixpk= 4946, nxpk= 20, iat=2575,2577, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:4947   156 MET  HA          4.50    (#   4947:20  Single Ambig)
 &rst
  ixpk= 4947, nxpk= 20, iat=  -1,2577, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2622,2592,
 &end
#
#  156 MET  HG-         156 MET  HA          5.50    (#   4948:20  Unique         2.14, 3.46 A)
 &rst
  ixpk= 4948, nxpk= 20, iat=  -1,2577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#  156 MET  HG+         156 MET  HA          5.50    (#   4949:20  Unique         2.14, 3.46 A)
 &rst
  ixpk= 4949, nxpk= 20, iat=  -1,2577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#    0 AMB  20-2:4950   156 MET  HA          2.80    (#   4950:20  Single Ambig)
 &rst
  ixpk= 4950, nxpk= 20, iat=  -1,2577, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2579,2580,2579,2580,
 &end
#
#    0 AMB  20-2:4951     0 AMB  20-1:4951   4.50    (#   4951:20  Double Ambig)
 &rst
  ixpk= 4951, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2582,2583,2582,2583,
 igr2=2579,2580,2579,2580,
 &end
#
#  156 MET  HG-           0 AMB  20-1:4952   3.50    (#   4952:20  Single Ambig)
 &rst
  ixpk= 4952, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2582,2583,
 igr2=2579,2580,2579,2580,
 &end
#
#  156 MET  HA            0 AMB  20-1:4953   4.50    (#   4953:20  Single Ambig)
 &rst
  ixpk= 4953, nxpk= 20, iat=2577,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2579,2580,2579,2580,
 &end
#
#    0 AMB  20-2:4954     0 AMB  20-1:4954   5.50    (#   4954:20  Double Ambig)
 &rst
  ixpk= 4954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=2410, 301, 302, 301, 302,
 igr2=2469,2470,2579,2580,2579,2580,
 &end
#
#  157 SER  HN            0 AMB  20-1:4955   5.50    (#   4955:20  Single Ambig)
 &rst
  ixpk= 4955, nxpk= 20, iat=2592,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2579,2580,2579,2580,
 &end
#
#  156 MET  HN            0 AMB  20-1:4956   4.50    (#   4956:20  Single Ambig)
 &rst
  ixpk= 4956, nxpk= 20, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2579,2580,2579,2580,
 &end
#
#  156 MET  HN          156 MET  HG-         5.50    (#   4957:20  Unique         2.27, 3.05 A)
 &rst
  ixpk= 4957, nxpk= 20, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2582,2583,
 &end
#
#  156 MET  HN          156 MET  HG+         5.50    (#   4958:20  Unique         2.27, 3.05 A)
 &rst
  ixpk= 4958, nxpk= 20, iat=2575,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2582,2583,
 &end
#
#  157 SER  HN          156 MET  HG+         5.50    (#   4959:20  Unique         2.20, 3.87 A)
 &rst
  ixpk= 4959, nxpk= 20, iat=2592,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2582,2583,
 &end
#
#  157 SER  HN          156 MET  HG-         5.50    (#   4960:20  Unique         2.20, 3.87 A)
 &rst
  ixpk= 4960, nxpk= 20, iat=2592,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2582,2583,
 &end
#
#  156 MET  HA          156 MET  HG+         5.50    (#   4961:20  Unique         2.14, 3.46 A)
 &rst
  ixpk= 4961, nxpk= 20, iat=2577,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2582,2583,
 &end
#
#  156 MET  HA          156 MET  HG-         4.50    (#   4962:20  Unique         2.14, 3.46 A)
 &rst
  ixpk= 4962, nxpk= 20, iat=2577,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2582,2583,
 &end
#
#    0 AMB  20-2:4963     0 AMB  20-1:4963   5.50    (#   4963:20  Double Ambig)
 &rst
  ixpk= 4963, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.85, r4=12.35,
 igr1=2536,2537,2536,2537,2596,2597,2596,2597, 301, 302,
      
 igr2=2582,2583,2582,2583,2582,2583,2582,2583, 237, 238,
      
 &end
#
#  116 SER  HB+         119 PRO  HB+         5.50    (#   4964:20  Unique         1.98, 3.74 A)
 &rst
  ixpk= 4964, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1890,1891,
 igr2=1929,1930,
 &end
#
#    0 AMB  20-2:4965     0 AMB  20-1:4965   3.50    (#   4965:20  Double Ambig)
 &rst
  ixpk= 4965, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2579,2580,2579,2580,1705,1706,1705,1706,
 igr2=2582,2583,2582,2583, 237, 238,
 &end
#
#    0 AMB  20-2:4966     0 AMB  20-1:4966   2.80    (#   4966:20  Double Ambig)
 &rst
  ixpk= 4966, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 863, 864,2579,2580,2579,2580,
 igr2=1929,1930,2582,2583,
 &end
#
#  155 VAL  HB            0 AMB  20-1:4967   5.50    (#   4967:20  Single Ambig)
 &rst
  ixpk= 4967, nxpk= 20, iat=2563,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 237, 238,2582,2583,
 &end
#
#  155 VAL  MGX         156 MET  HG-         5.50    (#   4968:20  Unique         2.57, 6.19 A)
 &rst
  ixpk= 4968, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,
 igr2=2582,2583,
 &end
#
#  158 LEU  MDY         158 LEU  HA          3.50    (#   4970:20  Unique         2.06, 3.81 A)
 &rst
  ixpk= 4970, nxpk= 20, iat=  -1,2605, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  MDX         158 LEU  HA          3.50    (#   4971:20  Unique         2.06, 3.81 A)
 &rst
  ixpk= 4971, nxpk= 20, iat=  -1,2605, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HB-         158 LEU  HA          3.50    (#   4972:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 4972, nxpk= 20, iat=  -1,2605, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2607,2608,
 &end
#
#    0 AMB  20-2:4973   158 LEU  HA          3.50    (#   4973:20  Single Ambig)
 &rst
  ixpk= 4973, nxpk= 20, iat=  -1,2605, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2610,2607,2608,
 &end
#
#  158 LEU  HN          158 LEU  HA          4.50    (#   4974:20  Unique         2.76, 2.85 A)
 &rst
  ixpk= 4974, nxpk= 20, iat=2603,2605, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  159 GLN  HN          158 LEU  HB-         5.50    (#   4975:20  Unique         2.27, 3.06 A)
 &rst
  ixpk= 4975, nxpk= 20, iat=2622,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2607,2608,
 &end
#
#  159 GLN  HN          158 LEU  HB+         5.50    (#   4976:20  Unique         2.27, 3.06 A)
 &rst
  ixpk= 4976, nxpk= 20, iat=2622,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2607,2608,
 &end
#
#  158 LEU  HN          158 LEU  HB+         4.50    (#   4977:20  Unique         2.04, 2.89 A)
 &rst
  ixpk= 4977, nxpk= 20, iat=2603,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2607,2608,
 &end
#
#  158 LEU  HN          158 LEU  HB-         4.50    (#   4978:20  Unique         2.04, 2.89 A)
 &rst
  ixpk= 4978, nxpk= 20, iat=2603,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2607,2608,
 &end
#
#  158 LEU  HA          158 LEU  HB+         4.50    (#   4979:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 4979, nxpk= 20, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2607,2608,
 &end
#
#  158 LEU  HA          158 LEU  HB-         4.50    (#   4980:20  Unique         2.37, 2.78 A)
 &rst
  ixpk= 4980, nxpk= 20, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2607,2608,
 &end
#
#   18 ARG  HA          158 LEU  HB-         5.50    (#   4982:20  Unique         2.00, 3.73 A)
 &rst
  ixpk= 4982, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2607,2608,
 &end
#
#  155 VAL  HA          158 LEU  HB+         5.50    (#   4983:20  Unique         2.76, 4.46 A)
 &rst
  ixpk= 4983, nxpk= 20, iat=2561,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2607,2608,
 &end
#
#  155 VAL  HA          158 LEU  HB-         5.50    (#   4984:20  Unique         2.76, 4.46 A)
 &rst
  ixpk= 4984, nxpk= 20, iat=2561,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2607,2608,
 &end
#
#    0 AMB  20-2:4985     0 AMB  20-1:4985   4.50    (#   4985:20  Double Ambig)
 &rst
  ixpk= 4985, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=2612,2613,2614,2616,2617,2618,2565,2566,2567,2569,
      2570,2571,
 igr2=2607,2608,2607,2608,
 &end
#
#  158 LEU  MDX         158 LEU  HB+         4.50    (#   4986:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 4986, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2612,2613,2614,2616,2617,2618,
 igr2=2607,2608,
 &end
#
#    0 AMB  20-2:4987   158 LEU  HB-         3.50    (#   4987:20  Single Ambig)
 &rst
  ixpk= 4987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=2612,2613,2614,2616,2617,2618,2565,2566,2567,2569,
      2570,2571,
 igr2=2607,2608,
 &end
#
#  158 LEU  MDX         158 LEU  HB-         3.50    (#   4988:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 4988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2612,2613,2614,2616,2617,2618,
 igr2=2607,2608,
 &end
#
#  158 LEU  HB-         158 LEU  HG          4.50    (#   4989:20  Unique         2.37, 2.71 A)
 &rst
  ixpk= 4989, nxpk= 20, iat=  -1,2610, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2607,2608,
 &end
#
#    0 AMB  20-2:4990     0 AMB  20-1:4990   5.50    (#   4990:20  Double Ambig)
 &rst
  ixpk= 4990, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2605,1763,1764,
 igr2=2610,1722,
 &end
#
#  158 LEU  HN          158 LEU  HG          4.50    (#   4991:20  Unique         2.08, 3.42 A)
 &rst
  ixpk= 4991, nxpk= 20, iat=2603,2610, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:4992   158 LEU  HG          5.50    (#   4992:20  Single Ambig)
 &rst
  ixpk= 4992, nxpk= 20, iat=  -1,2610, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2592,2622,2663,2664,
 &end
#
#    0 AMB  20-2:4993   158 LEU  MDX         5.50    (#   4993:20  Single Ambig)
 &rst
  ixpk= 4993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2592,2663,2664,2622,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HN          158 LEU  MDX         5.50    (#   4994:20  Unique         1.95, 4.32 A)
 &rst
  ixpk= 4994, nxpk= 20, iat=2603,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  103 GLN  HE2+        158 LEU  MDX         5.50    (#   4995:20  Unique         1.95, 5.27 A)
 &rst
  ixpk= 4995, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  103 GLN  HE2-        158 LEU  MDX         5.50    (#   4996:20  Unique         1.95, 5.27 A)
 &rst
  ixpk= 4996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HA          158 LEU  MDX         4.50    (#   4997:20  Unique         2.06, 3.81 A)
 &rst
  ixpk= 4997, nxpk= 20, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#   18 ARG  HA          158 LEU  MDX         5.50    (#   4998:20  Unique         2.00, 5.21 A)
 &rst
  ixpk= 4998, nxpk= 20, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  155 VAL  HA          158 LEU  MDX         5.50    (#   4999:20  Unique         2.04, 4.78 A)
 &rst
  ixpk= 4999, nxpk= 20, iat=2561,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5000   158 LEU  MDX         5.50    (#   5000:20  Single Ambig)
 &rst
  ixpk= 5000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 268, 269, 268, 269,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5001   158 LEU  MDX         5.50    (#   5001:20  Single Ambig)
 &rst
  ixpk= 5001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=2579,2580,2579,2580,2643,2644, 313, 314,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5002   158 LEU  MDX         2.80    (#   5002:20  Single Ambig)
 &rst
  ixpk= 5002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=2607,2608, 262, 263,2610,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HB-         158 LEU  MDX         3.50    (#   5003:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 5003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2607,2608,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HB-         158 LEU  MDY         3.50    (#   5005:20  Unique         1.99, 3.29 A)
 &rst
  ixpk= 5005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2607,2608,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5006   158 LEU  MDY         2.80    (#   5006:20  Single Ambig)
 &rst
  ixpk= 5006, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=2607,2608,2610,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5007   158 LEU  MDY         5.50    (#   5007:20  Single Ambig)
 &rst
  ixpk= 5007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1705,1706,1705,1706,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HA          158 LEU  MDY         2.80    (#   5008:20  Unique         2.06, 3.81 A)
 &rst
  ixpk= 5008, nxpk= 20, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  103 GLN  HE2-        158 LEU  MDY         5.50    (#   5009:20  Unique         1.95, 5.27 A)
 &rst
  ixpk= 5009, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  103 GLN  HE2+        158 LEU  MDY         5.50    (#   5010:20  Unique         1.95, 5.27 A)
 &rst
  ixpk= 5010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1710,1711,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  158 LEU  HN          158 LEU  MDY         5.50    (#   5011:20  Unique         1.95, 4.32 A)
 &rst
  ixpk= 5011, nxpk= 20, iat=2603,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#    0 AMB  20-2:5012   158 LEU  MDY         5.50    (#   5012:20  Single Ambig)
 &rst
  ixpk= 5012, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2592,2663,2664,2622,
 igr2=2612,2613,2614,2616,2617,2618,
 &end
#
#  151 PHE  HB+         148 MET  HA          5.50    (#   5013:20  Unique         4.20, 6.06 A)
 &rst
  ixpk= 5013, nxpk= 20, iat=  -1,2450, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2506,2507,
 &end
#
#    0 AMB  20-2:5014   148 MET  HA          5.50    (#   5014:20  Single Ambig)
 &rst
  ixpk= 5014, nxpk= 20, iat=  -1,2450, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2506,2507,2367,2368,2394,2395,
 &end
#
#    0 AMB  20-2:5015     0 AMB  20-1:5015   3.50    (#   5015:20  Double Ambig)
 &rst
  ixpk= 5015, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2624,1763,1764,
 igr2=2626,2627,1794,1795,
 &end
#
#    0 AMB  20-2:5016   159 GLN  HB-         3.50    (#   5016:20  Single Ambig)
 &rst
  ixpk= 5016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2624,2577,
 igr2=2626,2627,
 &end
#
#  159 GLN  HE2-        159 GLN  HB+         5.50    (#   5017:20  Unique         1.95, 3.44 A)
 &rst
  ixpk= 5017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2634,2635,
 igr2=2626,2627,
 &end
#
#  159 GLN  HE2-        159 GLN  HB-         5.50    (#   5018:20  Unique         1.95, 3.44 A)
 &rst
  ixpk= 5018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2634,2635,
 igr2=2626,2627,
 &end
#
#  159 GLN  HN          159 GLN  HB+         4.50    (#   5019:20  Unique         2.77, 3.28 A)
 &rst
  ixpk= 5019, nxpk= 20, iat=2622,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2626,2627,
 &end
#
#  159 GLN  HN          159 GLN  HB-         4.50    (#   5020:20  Unique         2.77, 3.28 A)
 &rst
  ixpk= 5020, nxpk= 20, iat=2622,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2626,2627,
 &end
#
#  160 GLU  HN          159 GLN  HB+         5.50    (#   5021:20  Unique         2.62, 4.24 A)
 &rst
  ixpk= 5021, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2626,2627,
 &end
#
#    0 AMB  20-2:5022     0 AMB  20-1:5022   4.50    (#   5022:20  Double Ambig)
 &rst
  ixpk= 5022, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 786,2639,
 igr2= 790, 791,2626,2627,
 &end
#
#    0 AMB  20-2:5023     0 AMB  20-1:5023   5.50    (#   5023:20  Double Ambig)
 &rst
  ixpk= 5023, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 299,2654,1824,
 igr2=2626,2627,2626,2627,1794,1795,
 &end
#
#   53 ALA  HN           52 ARG  HB+         5.50    (#   5024:20  Unique         2.24, 3.16 A)
 &rst
  ixpk= 5024, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 790, 791,
 &end
#
#    0 AMB  20-2:5025     0 AMB  20-1:5025   4.50    (#   5025:20  Double Ambig)
 &rst
  ixpk= 5025, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1=1475,1476,1926,1927,1926,1927,1489,2607,2608,
 igr2=1478,1479,1862,1863,1862,1863,1478,1479,2629,2630,
      
 &end
#
#    0 AMB  20-2:5026     0 AMB  20-1:5026   5.50    (#   5026:20  Double Ambig)
 &rst
  ixpk= 5026, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2683,2684,2386,
 igr2=2641,2450,
 &end
#
#  160 GLU  HN          160 GLU  HB+         4.50    (#   5027:20  Unique         2.21, 2.79 A)
 &rst
  ixpk= 5027, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2643,2644,
 &end
#
#  160 GLU  HN          160 GLU  HB-         4.50    (#   5028:20  Unique         2.21, 2.79 A)
 &rst
  ixpk= 5028, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2643,2644,
 &end
#
#  160 GLU  HA          160 GLU  HB+         3.50    (#   5029:20  Unique         2.54, 2.80 A)
 &rst
  ixpk= 5029, nxpk= 20, iat=2641,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2643,2644,
 &end
#
#  160 GLU  HA          160 GLU  HG+         4.50    (#   5030:20  Unique         2.03, 2.83 A)
 &rst
  ixpk= 5030, nxpk= 20, iat=2641,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2646,2647,
 &end
#
#  160 GLU  HA          160 GLU  HG-         4.50    (#   5031:20  Unique         2.03, 2.83 A)
 &rst
  ixpk= 5031, nxpk= 20, iat=2641,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2646,2647,
 &end
#
#  160 GLU  HN          160 GLU  HG+         5.50    (#   5032:20  Unique         3.10, 4.55 A)
 &rst
  ixpk= 5032, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2646,2647,
 &end
#
#  160 GLU  HN          160 GLU  HG-         5.50    (#   5033:20  Unique         3.10, 4.55 A)
 &rst
  ixpk= 5033, nxpk= 20, iat=2639,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2646,2647,
 &end
#
#    0 AMB  20-2:5034     0 AMB  20-1:5034   5.50    (#   5034:20  Double Ambig)
 &rst
  ixpk= 5034, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2654,2575,
 igr2=2646,2647,2646,2647,
 &end
#
#  161 ASN  HN          160 GLU  HG-         5.50    (#   5035:20  Unique         4.64, 5.12 A)
 &rst
  ixpk= 5035, nxpk= 20, iat=2654,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2646,2647,
 &end
#
#    0 AMB  20-2:5036     0 AMB  20-1:5036   5.50    (#   5036:20  Double Ambig)
 &rst
  ixpk= 5036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2624,2577,
 igr2=2658,2659,2658,2659,
 &end
#
#    0 AMB  20-2:5037   161 ASN  HB-         5.50    (#   5037:20  Single Ambig)
 &rst
  ixpk= 5037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2624,2577,
 igr2=2658,2659,
 &end
#
#  161 ASN  HD2-        161 ASN  HB+         5.50    (#   5040:20  Unique         2.18, 3.34 A)
 &rst
  ixpk= 5040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2663,2664,
 igr2=2658,2659,
 &end
#
#  161 ASN  HD2-        161 ASN  HB-         5.50    (#   5041:20  Unique         2.18, 3.34 A)
 &rst
  ixpk= 5041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2663,2664,
 igr2=2658,2659,
 &end
#
#  161 ASN  HD2+        161 ASN  HB+         5.50    (#   5042:20  Unique         2.18, 3.34 A)
 &rst
  ixpk= 5042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2663,2664,
 igr2=2658,2659,
 &end
#
#  161 ASN  HD2+        161 ASN  HB-         5.50    (#   5043:20  Unique         2.18, 3.34 A)
 &rst
  ixpk= 5043, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2663,2664,
 igr2=2658,2659,
 &end
#
#  162 THR  HN          161 ASN  HB+         5.50    (#   5044:20  Unique         2.51, 3.29 A)
 &rst
  ixpk= 5044, nxpk= 20, iat=2668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2658,2659,
 &end
#
#  162 THR  HN          161 ASN  HB-         5.50    (#   5045:20  Unique         2.51, 3.29 A)
 &rst
  ixpk= 5045, nxpk= 20, iat=2668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2658,2659,
 &end
#
#  161 ASN  HN          161 ASN  HB+         5.50    (#   5046:20  Unique         2.66, 3.24 A)
 &rst
  ixpk= 5046, nxpk= 20, iat=2654,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2658,2659,
 &end
#
#  161 ASN  HN          161 ASN  HB-         4.50    (#   5047:20  Unique         2.66, 3.24 A)
 &rst
  ixpk= 5047, nxpk= 20, iat=2654,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2658,2659,
 &end
#
#    0 AMB  20-2:5048   162 THR  HA          5.50    (#   5048:20  Single Ambig)
 &rst
  ixpk= 5048, nxpk= 20, iat=  -1,2670, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2668,2696,
 &end
#
#  162 THR  HB          162 THR  HA          4.50    (#   5049:20  Unique         2.94, 2.97 A)
 &rst
  ixpk= 5049, nxpk= 20, iat=2672,2670, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  163 PRO  HD+         162 THR  HA          3.50    (#   5050:20  Unique         3.75, 3.91 A)
 &rst
  ixpk= 5050, nxpk= 20, iat=  -1,2670, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2683,2684,
 &end
#
#  163 PRO  HD-         162 THR  HA          3.50    (#   5051:20  Unique         3.75, 3.91 A)
 &rst
  ixpk= 5051, nxpk= 20, iat=  -1,2670, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2683,2684,
 &end
#
#  162 THR  MG2         162 THR  HA          4.50    (#   5052:20  Unique         2.05, 3.29 A)
 &rst
  ixpk= 5052, nxpk= 20, iat=  -1,2670, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2674,2675,2676,
 &end
#
#  162 THR  MG2         162 THR  HB          3.50    (#   5053:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 5053, nxpk= 20, iat=  -1,2672, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2674,2675,2676,
 &end
#
#  163 PRO  HD-         162 THR  HB          5.50    (#   5054:20  Unique         1.87, 2.25 A)
 &rst
  ixpk= 5054, nxpk= 20, iat=  -1,2672, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2683,2684,
 &end
#
#  162 THR  HA          162 THR  HB          4.50    (#   5055:20  Unique         2.94, 2.97 A)
 &rst
  ixpk= 5055, nxpk= 20, iat=2670,2672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  162 THR  HN          162 THR  HB          4.50    (#   5056:20  Unique         2.22, 2.44 A)
 &rst
  ixpk= 5056, nxpk= 20, iat=2668,2672, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-2:5057   162 THR  MG2         5.50    (#   5057:20  Single Ambig)
 &rst
  ixpk= 5057, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2668,2696,
 igr2=2674,2675,2676,
 &end
#
#  162 THR  HA          162 THR  MG2         4.50    (#   5058:20  Unique         2.05, 3.29 A)
 &rst
  ixpk= 5058, nxpk= 20, iat=2670,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2674,2675,2676,
 &end
#
#  162 THR  HB          162 THR  MG2         4.50    (#   5059:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 5059, nxpk= 20, iat=2672,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=2674,2675,2676,
 &end
#
#  163 PRO  HB-         163 PRO  HA          4.50    (#   5060:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5060, nxpk= 20, iat=  -1,2692, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2689,2690,
 &end
#
#  163 PRO  HB+         163 PRO  HA          4.50    (#   5061:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5061, nxpk= 20, iat=  -1,2692, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2689,2690,
 &end
#
#  163 PRO  HD+         163 PRO  HA          5.50    (#   5062:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 5062, nxpk= 20, iat=  -1,2692, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2683,2684,
 &end
#
#    0 AMB  20-2:5063   163 PRO  HA          3.50    (#   5063:20  Single Ambig)
 &rst
  ixpk= 5063, nxpk= 20, iat=  -1,2692, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2696,2668,
 &end
#
#  164 LYS  HN          163 PRO  HB+         5.50    (#   5064:20  Unique         3.33, 3.79 A)
 &rst
  ixpk= 5064, nxpk= 20, iat=2696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2689,2690,
 &end
#
#  164 LYS  HN          163 PRO  HB-         5.50    (#   5065:20  Unique         3.33, 3.79 A)
 &rst
  ixpk= 5065, nxpk= 20, iat=2696,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2689,2690,
 &end
#
#  163 PRO  HA          163 PRO  HB+         4.50    (#   5066:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5066, nxpk= 20, iat=2692,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2689,2690,
 &end
#
#  163 PRO  HA          163 PRO  HB-         5.50    (#   5067:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 5067, nxpk= 20, iat=2692,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2689,2690,
 &end
#
#  163 PRO  HD+         163 PRO  HB+         5.50    (#   5068:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5068, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2689,2690,
 &end
#
#  163 PRO  HD-         163 PRO  HB+         5.50    (#   5069:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5069, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2689,2690,
 &end
#
#  163 PRO  HB+         163 PRO  HG+         3.50    (#   5070:20  Unique         2.32, 2.58 A)
 &rst
  ixpk= 5070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2689,2690,
 igr2=2686,2687,
 &end
#
#  163 PRO  HD-         163 PRO  HG+         5.50    (#   5072:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5072, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2686,2687,
 &end
#
#  163 PRO  HD+         163 PRO  HG+         5.50    (#   5073:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2686,2687,
 &end
#
#  163 PRO  HD+         163 PRO  HG-         5.50    (#   5074:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2686,2687,
 &end
#
#  163 PRO  HD-         163 PRO  HG-         5.50    (#   5075:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5075, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2683,2684,
 igr2=2686,2687,
 &end
#
#    0 AMB  20-2:5076     0 AMB  20-1:5076   5.50    (#   5076:20  Double Ambig)
 &rst
  ixpk= 5076, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2692, 284,
 igr2=2686,2687,2686,2687,
 &end
#
#  162 THR  HN          163 PRO  HD+         5.50    (#   5077:20  Unique         1.72, 2.57 A)
 &rst
  ixpk= 5077, nxpk= 20, iat=2668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  162 THR  HN          163 PRO  HD-         5.50    (#   5078:20  Unique         1.72, 2.57 A)
 &rst
  ixpk= 5078, nxpk= 20, iat=2668,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  162 THR  HA          163 PRO  HD+         3.50    (#   5081:20  Unique         3.75, 3.91 A)
 &rst
  ixpk= 5081, nxpk= 20, iat=2670,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2683,2684,
 &end
#
#  162 THR  HA          163 PRO  HD-         3.50    (#   5082:20  Unique         3.75, 3.91 A)
 &rst
  ixpk= 5082, nxpk= 20, iat=2670,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=2683,2684,
 &end
#
#  163 PRO  HA          163 PRO  HD+         5.50    (#   5083:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 5083, nxpk= 20, iat=2692,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  163 PRO  HA          163 PRO  HD-         5.50    (#   5084:20  Unique         3.60, 3.85 A)
 &rst
  ixpk= 5084, nxpk= 20, iat=2692,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  162 THR  HB          163 PRO  HD+         5.50    (#   5085:20  Unique         1.87, 2.25 A)
 &rst
  ixpk= 5085, nxpk= 20, iat=2672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  162 THR  HB          163 PRO  HD-         5.50    (#   5086:20  Unique         1.87, 2.25 A)
 &rst
  ixpk= 5086, nxpk= 20, iat=2672,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2683,2684,
 &end
#
#  163 PRO  HB+         163 PRO  HD+         5.50    (#   5087:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5087, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2689,2690,
 igr2=2683,2684,
 &end
#
#  163 PRO  HB+         163 PRO  HD-         5.50    (#   5088:20  Unique         2.98, 3.70 A)
 &rst
  ixpk= 5088, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2689,2690,
 igr2=2683,2684,
 &end
#
#  163 PRO  HG+         163 PRO  HD+         4.50    (#   5089:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2686,2687,
 igr2=2683,2684,
 &end
#
#  163 PRO  HG-         163 PRO  HD+         3.50    (#   5090:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2686,2687,
 igr2=2683,2684,
 &end
#
#  163 PRO  HG+         163 PRO  HD-         4.50    (#   5091:20  Unique         2.30, 2.58 A)
 &rst
  ixpk= 5091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2686,2687,
 igr2=2683,2684,
 &end
#
#    0 AMB  20-2:5092   163 PRO  HD-         4.50    (#   5092:20  Single Ambig)
 &rst
  ixpk= 5092, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2686,2687,2689,2690,
 igr2=2683,2684,
 &end
#
#  162 THR  MG2         163 PRO  HD+         5.50    (#   5093:20  Unique         1.97, 3.82 A)
 &rst
  ixpk= 5093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2674,2675,2676,
 igr2=2683,2684,
 &end
#
#  162 THR  MG2         163 PRO  HD-         5.50    (#   5094:20  Unique         1.97, 3.82 A)
 &rst
  ixpk= 5094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2674,2675,2676,
 igr2=2683,2684,
 &end
#
#    0 AMB  20-2:5095   164 LYS  HA          5.50    (#   5095:20  Single Ambig)
 &rst
  ixpk= 5095, nxpk= 20, iat=  -1,2698, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2703,2704,2703,2704,
 &end
#
#  164 LYS  HN          164 LYS  HA          5.50    (#   5096:20  Unique         2.28, 2.78 A)
 &rst
  ixpk= 5096, nxpk= 20, iat=2696,2698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   88 THR  MG2          89 LYS  HG+         5.50    (#   5099:20  Unique         4.41, 6.33 A)
 &rst
  ixpk= 5099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1441,1442,1443,
 igr2=1456,1457,
 &end
#
#  164 LYS  HA            0 AMB  20-1:5100   5.50    (#   5100:20  Single Ambig)
 &rst
  ixpk= 5100, nxpk= 20, iat=2698,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2703,2704,2703,2704,
 &end
#
#  164 LYS  HN            0 AMB  20-1:5101   5.50    (#   5101:20  Single Ambig)
 &rst
  ixpk= 5101, nxpk= 20, iat=2696,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=2703,2704,2703,2704,
 &end
#
#   88 THR  HN            0 AMB  20-1:5102   5.50    (#   5102:20  Single Ambig)
 &rst
  ixpk= 5102, nxpk= 20, iat=1435,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1459,1460,1459,1460,
 &end
#
#   67 ILE  HB           67 ILE  HG1+        5.50    (#   5109:20  Unique         2.44, 2.79 A)
 &rst
  ixpk= 5109, nxpk= 20, iat=1044,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1050,1051,
 &end
#
#   50 MET  ME           67 ILE  HG1+        5.50    (#   5110:20  Unique         1.98, 4.45 A)
 &rst
  ixpk= 5110, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 759, 760, 761,
 igr2=1050,1051,
 &end
#
#    0 AMB  20-2:5112     0 AMB  20-1:5112   5.50    (#   5112:20  Double Ambig)
 &rst
  ixpk= 5112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1688,1689,1690,1692,1693,1694,1053,1054,1055,
 igr2=1050,1051,1050,1051,
 &end
#
#   67 ILE  QG2          67 ILE  HG1+        5.50    (#   5113:20  Unique         1.95, 3.39 A)
 &rst
  ixpk= 5113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1046,1047,1048,
 igr2=1050,1051,
 &end
#
#   67 ILE  HN           67 ILE  HG1+        5.50    (#   5115:20  Unique         1.83, 2.71 A)
 &rst
  ixpk= 5115, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1050,1051,
 &end
#
#  134 ARG  HA            0 AMB  20-1:5116   4.50    (#   5116:20  Single Ambig)
 &rst
  ixpk= 5116, nxpk= 20, iat=2187,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=2318,2319,2192,2193,
 &end
#
#  101 LEU  MDY         154 VAL  MGY         2.80    (#   5117:20  Unique         2.00, 5.81 A)
 &rst
  ixpk= 5117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1669,1670,1671,1673,1674,1675,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#    0 AMB  20-2:5118   154 VAL  MGY         3.50    (#   5118:20  Single Ambig)
 &rst
  ixpk= 5118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1082,1083,1084,1063,1064,
 igr2=2549,2550,2551,2553,2554,2555,
 &end
#
#    0 AMB  20-2:5119    36 PRO  HB-         5.50    (#   5119:20  Single Ambig)
 &rst
  ixpk= 5119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 162, 163, 164, 166, 167, 168,2232,2233,2234,2236,
      2237,2238,
 igr2= 578, 579,
 &end
#
#   68 LEU  MDY         103 GLN  HB-         5.50    (#   5120:20  Unique         1.89, 5.49 A)
 &rst
  ixpk= 5120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1068,1069,1070,1072,1073,1074,
 igr2=1702,1703,
 &end
#
#    0 AMB  20-2:5121    36 PRO  HB-         5.50    (#   5121:20  Single Ambig)
 &rst
  ixpk= 5121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901, 227, 228, 229,
 igr2= 578, 579,
 &end
#
#   68 LEU  HG          103 GLN  HB-         5.50    (#   5122:20  Unique         2.63, 3.90 A)
 &rst
  ixpk= 5122, nxpk= 20, iat=1066,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1702,1703,
 &end
#
#    0 AMB  20-2:5123   149 LYS  HA          5.50    (#   5123:20  Single Ambig)
 &rst
  ixpk= 5123, nxpk= 20, iat=  -1,2467, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2522,2123,
 &end
#
#    0 AMB  20-2:5124   149 LYS  HA          4.50    (#   5124:20  Single Ambig)
 &rst
  ixpk= 5124, nxpk= 20, iat=  -1,2467, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=2526,2527,2528,2472,2473,
 &end
#
#    0 AMB  20-2:5125   149 LYS  HA          4.50    (#   5125:20  Single Ambig)
 &rst
  ixpk= 5125, nxpk= 20, iat=  -1,2467, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2472,2473,2475,2476,
 &end
#
#  149 LYS  HB-         149 LYS  HA          4.50    (#   5126:20  Unique         2.28, 2.72 A)
 &rst
  ixpk= 5126, nxpk= 20, iat=  -1,2467, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2469,2470,
 &end
#
#  149 LYS  HB+         149 LYS  HA          4.50    (#   5127:20  Unique         2.28, 2.72 A)
 &rst
  ixpk= 5127, nxpk= 20, iat=  -1,2467, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2469,2470,
 &end
#
#    0 AMB  20-2:5128    65 VAL  HB          5.50    (#   5128:20  Single Ambig)
 &rst
  ixpk= 5128, nxpk= 20, iat=  -1,1004, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 829, 830, 831, 833, 834, 835, 829, 830, 831, 833,
       834, 835, 227, 228, 229,
 &end
#
#  103 GLN  HB-          68 LEU  HG          4.50    (#   5129:20  Unique         2.63, 3.90 A)
 &rst
  ixpk= 5129, nxpk= 20, iat=  -1,1066, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1702,1703,
 &end
#
#    0 AMB  20-2:5130     0 AMB  20-1:5130   5.50    (#   5130:20  Double Ambig)
 &rst
  ixpk= 5130, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.69, r4=11.19,
 igr1=2192,2193,2491,2492,2159,2160,
 igr2=2175,2176,2177,2179,2180,2181,1105,1106,1107,
 &end
#
#  110 GLU  HG-         110 GLU  HA          5.50    (#   5131:20  Unique         2.06, 3.15 A)
 &rst
  ixpk= 5131, nxpk= 20, iat=  -1,1792, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#  130 TRP  HA          148 MET  ME          5.50    (#   5132:20  Unique         3.37, 4.94 A)
 &rst
  ixpk= 5132, nxpk= 20, iat=2112,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=2459,2460,2461,
 &end
#
#    0 AMB  10-2:1        2 ILE  HN          3.50    (#      1:10  Single Ambig)
 &rst
  ixpk= 1, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1=   6,  23,
 &end
#
#    1 MET  HG+           2 ILE  HN          5.50    (#      2:10  Unique         2.28, 3.43 A)
 &rst
  ixpk= 2, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
#    1 MET  HG-           2 ILE  HN          5.50    (#      3:10  Unique         2.28, 3.43 A)
 &rst
  ixpk= 3, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
#    0 AMB  10-2:4        2 ILE  HN          4.50    (#      4:10  Single Ambig)
 &rst
  ixpk= 4, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=   8,   9,   8,   9,
 &end
#
#    0 AMB  10-2:5        0 AMB  10-1:5      3.50    (#      5:10  Double Ambig)
 &rst
  ixpk= 5, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2018,2019,  25,
 igr2=2038,  21,
 &end
#
#    2 ILE  HG1-          2 ILE  HN          5.50    (#      6:10  Unique         1.94, 3.49 A)
 &rst
  ixpk= 6, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    2 ILE  HG1+          2 ILE  HN          5.50    (#      7:10  Unique         1.94, 3.49 A)
 &rst
  ixpk= 7, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    2 ILE  QG2           2 ILE  HN          4.50    (#      8:10  Unique         4.24, 4.75 A)
 &rst
  ixpk= 8, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  27,  28,  29,
 &end
#
#    8 ARG  HA            3 ASP  HN          4.50    (#     10:10  Unique         3.74, 4.50 A)
 &rst
  ixpk= 10, nxpk= 10, iat= 106,  40, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    3 ASP  HA            3 ASP  HN          3.50    (#     11:10  Unique         2.28, 2.87 A)
 &rst
  ixpk= 11, nxpk= 10, iat=  42,  40, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    2 ILE  HA            3 ASP  HN          2.80    (#     12:10  Unique         2.17, 2.31 A)
 &rst
  ixpk= 12, nxpk= 10, iat=  23,  40, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:13       3 ASP  HN          4.50    (#     13:10  Single Ambig)
 &rst
  ixpk= 13, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 129, 130, 129, 130,
 &end
#
#    6 GLY  HA-           3 ASP  HN          5.50    (#     14:10  Unique         3.26, 5.11 A)
 &rst
  ixpk= 14, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#    3 ASP  HB+           3 ASP  HN          3.50    (#     15:10  Unique         2.17, 2.88 A)
 &rst
  ixpk= 15, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  44,  45,
 &end
#
#    3 ASP  HB-           3 ASP  HN          3.50    (#     16:10  Unique         2.17, 2.88 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  44,  45,
 &end
#
#    0 AMB  10-2:17       3 ASP  HN          5.50    (#     17:10  Single Ambig)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  11,  12,  56,  57,
 &end
#
#    1 MET  HG-           3 ASP  HN          5.50    (#     18:10  Unique         3.37, 5.85 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  11,  12,
 &end
#
#    0 AMB  10-2:19       3 ASP  HN          5.50    (#     19:10  Single Ambig)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  87,  88, 135, 136,
 &end
#
#    0 AMB  10-2:20       3 ASP  HN          4.50    (#     20:10  Single Ambig)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 132, 133, 108, 109, 108, 109,
 &end
#
#    2 ILE  HB            3 ASP  HN          4.50    (#     21:10  Unique         2.77, 3.65 A)
 &rst
  ixpk= 21, nxpk= 10, iat=  25,  40, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:22       3 ASP  HN          5.50    (#     22:10  Single Ambig)
 &rst
  ixpk= 22, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  31,  32,1559,1560,
 &end
#
#    2 ILE  HG1+          3 ASP  HN          5.50    (#     23:10  Unique         4.03, 4.97 A)
 &rst
  ixpk= 23, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    2 ILE  QG2           3 ASP  HN          2.80    (#     24:10  Unique         1.96, 2.95 A)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=  27,  28,  29,
 &end
#
#    5 ASP  HN            4 ASP  HN          3.50    (#     25:10  Unique         2.19, 3.04 A)
 &rst
  ixpk= 25, nxpk= 10, iat=  64,  52, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HA            4 ASP  HN          3.50    (#     26:10  Unique         2.54, 3.05 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  42,  52, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 ASP  HA            4 ASP  HN          3.50    (#     27:10  Unique         2.28, 2.80 A)
 &rst
  ixpk= 27, nxpk= 10, iat=  54,  52, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HB+           4 ASP  HN          3.50    (#     28:10  Unique         1.92, 3.03 A)
 &rst
  ixpk= 28, nxpk= 10, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  44,  45,
 &end
#
#    4 ASP  HB-           4 ASP  HN          2.80    (#     30:10  Unique         2.09, 2.88 A)
 &rst
  ixpk= 30, nxpk= 10, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=  56,  57,
 &end
#
#    7 TYR  HB-           4 ASP  HN          5.50    (#     31:10  Unique         2.97, 5.64 A)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1,  52, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#    6 GLY  HN            5 ASP  HN          2.80    (#     32:10  Unique         1.79, 2.34 A)
 &rst
  ixpk= 32, nxpk= 10, iat=  76,  64, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    4 ASP  HN            5 ASP  HN          3.50    (#     33:10  Unique         2.19, 3.04 A)
 &rst
  ixpk= 33, nxpk= 10, iat=  52,  64, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 TYR  HD            5 ASP  HN          5.50    (#     34:10  Unique         4.41, 5.65 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#    5 ASP  HA            5 ASP  HN          2.80    (#     36:10  Unique         2.76, 2.85 A)
 &rst
  ixpk= 36, nxpk= 10, iat=  66,  64, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    4 ASP  HA            5 ASP  HN          3.50    (#     37:10  Unique         3.49, 3.54 A)
 &rst
  ixpk= 37, nxpk= 10, iat=  54,  64, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    6 GLY  HA+           5 ASP  HN          5.50    (#     38:10  Unique         4.17, 4.83 A)
 &rst
  ixpk= 38, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#    6 GLY  HA-           5 ASP  HN          5.50    (#     39:10  Unique         4.17, 4.83 A)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#    5 ASP  HB+           5 ASP  HN          3.50    (#     40:10  Unique         2.08, 2.96 A)
 &rst
  ixpk= 40, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  68,  69,
 &end
#
#    0 AMB  10-2:41       5 ASP  HN          2.80    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=  68,  69,  44,  45,
 &end
#
#    4 ASP  HB-           5 ASP  HN          4.50    (#     42:10  Unique         1.90, 2.54 A)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  56,  57,
 &end
#
#    7 TYR  HB-           5 ASP  HN          5.50    (#     43:10  Unique         3.58, 5.44 A)
 &rst
  ixpk= 43, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#    2 ILE  QG2           5 ASP  HN          5.50    (#     44:10  Unique         3.42, 5.55 A)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  27,  28,  29,
 &end
#
#    0 AMB  10-2:45       5 ASP  HN          5.50    (#     45:10  Single Ambig)
 &rst
  ixpk= 45, nxpk= 10, iat=  -1,  64, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1525,1526,1527,1522,1523,
 &end
#
#    5 ASP  HN            6 GLY  HN          2.80    (#     47:10  Unique         1.79, 2.34 A)
 &rst
  ixpk= 47, nxpk= 10, iat=  64,  76, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    7 TYR  HD            6 GLY  HN          5.50    (#     49:10  Unique         3.73, 4.91 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#    7 TYR  HE            6 GLY  HN          5.50    (#     50:10  Unique         5.11, 6.00 A)
 &rst
  ixpk= 50, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#    0 AMB  10-2:51       6 GLY  HN          3.50    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  66,  42,
 &end
#
#    4 ASP  HA            6 GLY  HN          5.50    (#     52:10  Unique         3.90, 4.68 A)
 &rst
  ixpk= 52, nxpk= 10, iat=  54,  76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    6 GLY  HA+           6 GLY  HN          3.50    (#     53:10  Unique         2.38, 2.74 A)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  78,  79,
 &end
#
#    6 GLY  HA-           6 GLY  HN          3.50    (#     54:10  Unique         2.38, 2.74 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  78,  79,
 &end
#
#    5 ASP  HB+           6 GLY  HN          4.50    (#     55:10  Unique         2.43, 3.33 A)
 &rst
  ixpk= 55, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  68,  69,
 &end
#
#    0 AMB  10-2:56       6 GLY  HN          4.50    (#     56:10  Single Ambig)
 &rst
  ixpk= 56, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  44,  45,  68,  69,
 &end
#
#    4 ASP  HB-           6 GLY  HN          5.50    (#     57:10  Unique         3.14, 4.39 A)
 &rst
  ixpk= 57, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  56,  57,
 &end
#
#    7 TYR  HB-           6 GLY  HN          5.50    (#     58:10  Unique         3.65, 4.67 A)
 &rst
  ixpk= 58, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#    0 AMB  10-2:59       6 GLY  HN          5.50    (#     59:10  Single Ambig)
 &rst
  ixpk= 59, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1475,1476,1478,1479,
 &end
#
#   90 PRO  HG-           6 GLY  HN          5.50    (#     60:10  Unique         2.71, 4.76 A)
 &rst
  ixpk= 60, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1475,1476,
 &end
#
#    2 ILE  QG2           6 GLY  HN          4.50    (#     61:10  Unique         2.24, 3.98 A)
 &rst
  ixpk= 61, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  27,  28,  29,
 &end
#
#   93 ILE  QD1           6 GLY  HN          5.50    (#     62:10  Unique         2.89, 5.44 A)
 &rst
  ixpk= 62, nxpk= 10, iat=  -1,  76, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1525,1526,1527,
 &end
#
#   93 ILE  HN            6 GLY  HN          5.50    (#     63:10  Unique         4.13, 5.11 A)
 &rst
  ixpk= 63, nxpk= 10, iat=1512,  76, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  113 MET  HN          114 GLN  HN          3.50    (#     64:10  Unique         2.23, 2.71 A)
 &rst
  ixpk= 64, nxpk= 10, iat=1838,1855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  115 THR  HN          114 GLN  HN          4.50    (#     65:10  Unique         1.80, 2.25 A)
 &rst
  ixpk= 65, nxpk= 10, iat=1872,1855, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  114 GLN  HA          114 GLN  HN          3.50    (#     67:10  Unique         2.85, 2.92 A)
 &rst
  ixpk= 67, nxpk= 10, iat=1857,1855, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  113 MET  HA          114 GLN  HN          4.50    (#     68:10  Unique         2.96, 3.26 A)
 &rst
  ixpk= 68, nxpk= 10, iat=1840,1855, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:69       0 AMB  10-1:69     5.50    (#     69:10  Double Ambig)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1876,1874, 129, 130,
 igr2=1855,  83,
 &end
#
#  113 MET  HG+         114 GLN  HN          4.50    (#     71:10  Unique         3.87, 4.75 A)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1845,1846,
 &end
#
#    0 AMB  10-2:72     114 GLN  HN          2.80    (#     72:10  Single Ambig)
 &rst
  ixpk= 72, nxpk= 10, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1862,1863,1862,1863,1859,1860,
 &end
#
#  114 GLN  HB-         114 GLN  HN          2.80    (#     73:10  Unique         2.24, 3.21 A)
 &rst
  ixpk= 73, nxpk= 10, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1859,1860,
 &end
#
#    0 AMB  10-2:74     114 GLN  HN          4.50    (#     74:10  Single Ambig)
 &rst
  ixpk= 74, nxpk= 10, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1842,1843,1842,1843,
 &end
#
#    0 AMB  10-2:75       0 AMB  10-1:75     3.50    (#     75:10  Double Ambig)
 &rst
  ixpk= 75, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  34,  35,  36,1878,1879,1880,
 igr2=  83,1855,
 &end
#
#   96 LYS  HN            8 ARG  HN          5.50    (#     77:10  Unique         2.39, 2.86 A)
 &rst
  ixpk= 77, nxpk= 10, iat=1555, 104, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HN            8 ARG  HN          5.50    (#     78:10  Unique         3.87, 4.15 A)
 &rst
  ixpk= 78, nxpk= 10, iat=1531, 104, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 TYR  HE            8 ARG  HN          5.50    (#     80:10  Unique         5.87, 6.89 A)
 &rst
  ixpk= 80, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#   95 GLN  HA            8 ARG  HN          4.50    (#     81:10  Unique         1.82, 2.13 A)
 &rst
  ixpk= 81, nxpk= 10, iat=1540, 104, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 ARG  HA            8 ARG  HN          5.50    (#     82:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 106, 104, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 TYR  HA            8 ARG  HN          4.50    (#     83:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 83, nxpk= 10, iat=  85, 104, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:84       8 ARG  HN          5.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  23,1533,1534,
 &end
#
#    0 AMB  10-2:85       8 ARG  HN          5.50    (#     85:10  Single Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130, 129, 130,
 &end
#
#    7 TYR  HB+           8 ARG  HN          5.50    (#     87:10  Unique         2.50, 3.62 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  87,  88,
 &end
#
#    0 AMB  10-2:89       8 ARG  HN          3.50    (#     89:10  Single Ambig)
 &rst
  ixpk= 89, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 108, 109, 108, 109, 111, 112,
 &end
#
#    8 ARG  HG-           8 ARG  HN          5.50    (#     90:10  Unique         2.14, 3.92 A)
 &rst
  ixpk= 90, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 111, 112,
 &end
#
#    0 AMB  10-2:91       8 ARG  HN          5.50    (#     91:10  Single Ambig)
 &rst
  ixpk= 91, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  31,  32,1198,1199,
 &end
#
#    0 AMB  10-2:92       8 ARG  HN          5.50    (#     92:10  Single Ambig)
 &rst
  ixpk= 92, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  27,  28,  29,1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  10-2:93       8 ARG  HN          5.50    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1, 104, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1525,1526,1527,1565,1566,
 &end
#
#   93 ILE  HN            8 ARG  HN          5.50    (#     94:10  Unique         5.30, 5.52 A)
 &rst
  ixpk= 94, nxpk= 10, iat=1512, 104, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HN           10 ASN  HN          5.50    (#     95:10  Unique         4.51, 4.77 A)
 &rst
  ixpk= 95, nxpk= 10, iat=1577, 142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           10 ASN  HN          5.50    (#     96:10  Unique         4.30, 4.33 A)
 &rst
  ixpk= 96, nxpk= 10, iat= 156, 142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:97      10 ASN  HN          5.50    (#     97:10  Single Ambig)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1555, 609,
 &end
#
#   98 LYS  HN           10 ASN  HN          5.50    (#     98:10  Unique         4.46, 4.91 A)
 &rst
  ixpk= 98, nxpk= 10, iat=1594, 142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HN           10 ASN  HN          5.50    (#     99:10  Unique         3.67, 3.99 A)
 &rst
  ixpk= 99, nxpk= 10, iat= 616, 142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+         10 ASN  HN          4.50    (#    100:10  Unique         1.89, 3.96 A)
 &rst
  ixpk= 100, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 151, 152,
 &end
#
#   10 ASN  HD2-         10 ASN  HN          5.50    (#    101:10  Unique         1.89, 3.96 A)
 &rst
  ixpk= 101, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   97 GLN  HA           10 ASN  HN          5.50    (#    102:10  Unique         2.57, 3.02 A)
 &rst
  ixpk= 102, nxpk= 10, iat=1579, 142, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:103     10 ASN  HN          3.50    (#    103:10  Single Ambig)
 &rst
  ixpk= 103, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 138, 144,
 &end
#
#    0 AMB  10-2:104     10 ASN  HN          5.50    (#    104:10  Single Ambig)
 &rst
  ixpk= 104, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 129, 130, 129, 130,
 &end
#
#   10 ASN  HB+          10 ASN  HN          5.50    (#    105:10  Unique         2.94, 3.56 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB-          10 ASN  HN          5.50    (#    106:10  Unique         2.94, 3.56 A)
 &rst
  ixpk= 106, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#    9 PRO  HB+          10 ASN  HN          4.50    (#    108:10  Unique         3.59, 4.01 A)
 &rst
  ixpk= 108, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 135, 136,
 &end
#
#    0 AMB  10-2:110     10 ASN  HN          5.50    (#    110:10  Single Ambig)
 &rst
  ixpk= 110, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 620,1542,1543,
 &end
#
#   96 LYS  HG+          10 ASN  HN          5.50    (#    111:10  Unique         2.79, 4.91 A)
 &rst
  ixpk= 111, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1562,1563,
 &end
#
#   40 ILE  QD1          10 ASN  HN          4.50    (#    112:10  Unique         2.21, 3.67 A)
 &rst
  ixpk= 112, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 629, 630, 631,
 &end
#
#    0 AMB  10-2:113     10 ASN  HN          5.50    (#    113:10  Single Ambig)
 &rst
  ixpk= 113, nxpk= 10, iat=  -1, 142, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1565,1566, 162, 163, 164, 166, 167, 168,
 &end
#
#   10 ASN  HN           11 VAL  HN          5.50    (#    114:10  Unique         4.30, 4.33 A)
 &rst
  ixpk= 114, nxpk= 10, iat= 142, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 GLY  HN           11 VAL  HN          5.50    (#    115:10  Unique         2.05, 2.44 A)
 &rst
  ixpk= 115, nxpk= 10, iat= 602, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   39 GLY  HN           11 VAL  HN          5.50    (#    116:10  Unique         1.91, 2.42 A)
 &rst
  ixpk= 116, nxpk= 10, iat= 609, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           11 VAL  HN          5.50    (#    117:10  Unique         4.43, 4.87 A)
 &rst
  ixpk= 117, nxpk= 10, iat=1594, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 GLY  HN           11 VAL  HN          5.50    (#    118:10  Unique         4.00, 4.13 A)
 &rst
  ixpk= 118, nxpk= 10, iat= 172, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HN           11 VAL  HN          5.50    (#    119:10  Unique         4.10, 4.39 A)
 &rst
  ixpk= 119, nxpk= 10, iat= 616, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+         11 VAL  HN          5.50    (#    120:10  Unique         4.01, 5.16 A)
 &rst
  ixpk= 120, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HD2-         11 VAL  HN          5.50    (#    121:10  Unique         4.01, 5.16 A)
 &rst
  ixpk= 121, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   11 VAL  HA           11 VAL  HN          5.50    (#    122:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 122, nxpk= 10, iat= 158, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 GLN  HA           11 VAL  HN          5.50    (#    123:10  Unique         3.02, 3.62 A)
 &rst
  ixpk= 123, nxpk= 10, iat= 587, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HA           11 VAL  HN          3.50    (#    124:10  Unique         2.57, 2.72 A)
 &rst
  ixpk= 124, nxpk= 10, iat= 144, 156, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLY  HA+          11 VAL  HN          5.50    (#    126:10  Unique         3.54, 4.55 A)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 611, 612,
 &end
#
#    0 AMB  10-2:127     11 VAL  HN          5.50    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 174, 175, 618,
 &end
#
#   39 GLY  HA-          11 VAL  HN          5.50    (#    128:10  Unique         3.54, 4.55 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 611, 612,
 &end
#
#   10 ASN  HB+          11 VAL  HN          4.50    (#    129:10  Unique         1.88, 2.45 A)
 &rst
  ixpk= 129, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB-          11 VAL  HN          4.50    (#    130:10  Unique         1.88, 2.45 A)
 &rst
  ixpk= 130, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 146, 147,
 &end
#
#   97 GLN  HB+          11 VAL  HN          5.50    (#    131:10  Unique         2.76, 3.74 A)
 &rst
  ixpk= 131, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#   11 VAL  HB           11 VAL  HN          5.50    (#    133:10  Unique         3.31, 3.80 A)
 &rst
  ixpk= 133, nxpk= 10, iat= 160, 156, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:134     11 VAL  HN          5.50    (#    134:10  Single Ambig)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 742, 743, 744, 620, 755, 756,1542,1543, 183,
 &end
#
#    0 AMB  10-2:135     11 VAL  HN          5.50    (#    135:10  Single Ambig)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 814, 815, 816, 189, 190,
 &end
#
#   11 VAL  MGY          11 VAL  HN          3.50    (#    136:10  Unique         2.06, 3.69 A)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   40 ILE  HG1+         11 VAL  HN          5.50    (#    137:10  Unique         3.63, 4.71 A)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   11 VAL  MGX          11 VAL  HN          3.50    (#    138:10  Unique         2.06, 3.69 A)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 156, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HN           12 GLY  HN          5.50    (#    139:10  Unique         4.00, 4.13 A)
 &rst
  ixpk= 139, nxpk= 10, iat= 156, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 PHE  HN           12 GLY  HN          5.50    (#    140:10  Unique         4.01, 4.55 A)
 &rst
  ixpk= 140, nxpk= 10, iat=1640, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           12 GLY  HN          5.50    (#    141:10  Unique         2.24, 2.95 A)
 &rst
  ixpk= 141, nxpk= 10, iat=1594, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HD1          12 GLY  HN          5.50    (#    143:10  Unique         3.15, 4.74 A)
 &rst
  ixpk= 143, nxpk= 10, iat=1624, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HA           12 GLY  HN          4.50    (#    144:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 144, nxpk= 10, iat= 158, 172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HA           12 GLY  HN          4.50    (#    145:10  Unique         2.97, 3.30 A)
 &rst
  ixpk= 145, nxpk= 10, iat=1618, 172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 GLY  HA+          12 GLY  HN          5.50    (#    146:10  Unique         2.30, 2.61 A)
 &rst
  ixpk= 146, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#   99 TRP  HB+          12 GLY  HN          5.50    (#    147:10  Unique         5.14, 5.58 A)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#    0 AMB  10-2:148     12 GLY  HN          5.50    (#    148:10  Single Ambig)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 146, 147,1644,1645,1644,1645,
 &end
#
#   97 GLN  HB+          12 GLY  HN          5.50    (#    149:10  Unique         2.02, 3.14 A)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#    0 AMB  10-2:150     12 GLY  HN          5.50    (#    150:10  Single Ambig)
 &rst
  ixpk= 150, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 589, 590, 790, 791,
 &end
#
#   11 VAL  HB           12 GLY  HN          4.50    (#    151:10  Unique         2.96, 3.40 A)
 &rst
  ixpk= 151, nxpk= 10, iat= 160, 172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:152     12 GLY  HN          5.50    (#    152:10  Single Ambig)
 &rst
  ixpk= 152, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 755, 756, 700, 701, 702, 183,
 &end
#
#    0 AMB  10-2:153     12 GLY  HN          5.50    (#    153:10  Single Ambig)
 &rst
  ixpk= 153, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 189, 190, 752, 753, 814, 815, 816,
 &end
#
#   11 VAL  MGY          12 GLY  HN          4.50    (#    154:10  Unique         3.15, 4.89 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   12 GLY  HA-          12 GLY  HN          5.50    (#    155:10  Unique         2.30, 2.61 A)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#    0 AMB  10-2:156     12 GLY  HN          4.50    (#    156:10  Single Ambig)
 &rst
  ixpk= 156, nxpk= 10, iat=  -1, 172, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 162, 163, 164, 166, 167, 168,1601,1602,
 &end
#
#   97 GLN  HA           12 GLY  HN          5.50    (#    157:10  Unique         3.65, 4.17 A)
 &rst
  ixpk= 157, nxpk= 10, iat=1579, 172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  HN           13 ILE  HN          5.50    (#    158:10  Unique         4.06, 4.40 A)
 &rst
  ixpk= 158, nxpk= 10, iat= 198, 179, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:162     13 ILE  HN          4.50    (#    162:10  Single Ambig)
 &rst
  ixpk= 162, nxpk= 10, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 587,1618,
 &end
#
#   13 ILE  HA           13 ILE  HN          5.50    (#    163:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 163, nxpk= 10, iat= 181, 179, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   36 PRO  HB+          13 ILE  HN          5.50    (#    164:10  Unique         2.29, 3.42 A)
 &rst
  ixpk= 164, nxpk= 10, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 578, 579,
 &end
#
#   13 ILE  HB           13 ILE  HN          4.50    (#    166:10  Unique         2.26, 2.48 A)
 &rst
  ixpk= 166, nxpk= 10, iat= 183, 179, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ILE  HG1-         13 ILE  HN          5.50    (#    167:10  Unique         2.34, 3.62 A)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 189, 190,
 &end
#
#   12 GLY  HA-          13 ILE  HN          3.50    (#    168:10  Unique         2.14, 2.65 A)
 &rst
  ixpk= 168, nxpk= 10, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 174, 175,
 &end
#
#   14 VAL  MGX          13 ILE  HN          5.50    (#    169:10  Unique         3.52, 6.07 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1, 179, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#  102 LEU  HN           14 VAL  HN          5.50    (#    170:10  Unique         3.15, 3.67 A)
 &rst
  ixpk= 170, nxpk= 10, iat=1679, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  100 PHE  HN           14 VAL  HN          5.50    (#    172:10  Unique         3.63, 3.99 A)
 &rst
  ixpk= 172, nxpk= 10, iat=1640, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ILE  HN           14 VAL  HN          5.50    (#    173:10  Unique         4.06, 4.40 A)
 &rst
  ixpk= 173, nxpk= 10, iat= 179, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HE3          14 VAL  HN          5.50    (#    174:10  Unique         4.70, 5.11 A)
 &rst
  ixpk= 174, nxpk= 10, iat=1635, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HA           14 VAL  HN          5.50    (#    177:10  Unique         4.70, 5.12 A)
 &rst
  ixpk= 177, nxpk= 10, iat=1618, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HA           14 VAL  HN          5.50    (#    178:10  Unique         3.55, 4.18 A)
 &rst
  ixpk= 178, nxpk= 10, iat=1662, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   13 ILE  HA           14 VAL  HN          4.50    (#    180:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 180, nxpk= 10, iat= 181, 198, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 VAL  HA           14 VAL  HN          5.50    (#    181:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 181, nxpk= 10, iat= 200, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:182     14 VAL  HN          5.50    (#    182:10  Single Ambig)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1644,1645,1644,1645,
 &end
#
#   14 VAL  HB           14 VAL  HN          5.50    (#    183:10  Unique         2.69, 2.92 A)
 &rst
  ixpk= 183, nxpk= 10, iat= 202, 198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:184     14 VAL  HN          5.50    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 218, 578, 579,
 &end
#
#    0 AMB  10-2:185     14 VAL  HN          5.50    (#    185:10  Single Ambig)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1686, 183,
 &end
#
#    0 AMB  10-2:187     14 VAL  HN          5.50    (#    187:10  Single Ambig)
 &rst
  ixpk= 187, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1683,1684, 189, 190,
 &end
#
#    0 AMB  10-2:188     14 VAL  HN          5.50    (#    188:10  Single Ambig)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1664,1665,1667, 162, 163, 164, 166, 167, 168,
 &end
#
#   13 ILE  QG2          14 VAL  HN          3.50    (#    189:10  Unique         2.23, 3.45 A)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 185, 186, 187,
 &end
#
#    0 AMB  10-2:190     14 VAL  HN          4.50    (#    190:10  Single Ambig)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#   14 VAL  MGX          14 VAL  HN          4.50    (#    191:10  Unique         2.53, 4.13 A)
 &rst
  ixpk= 191, nxpk= 10, iat=  -1, 198, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#   14 VAL  MGX          15 ILE  HN          5.50    (#    192:10  Unique         3.57, 4.93 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  10-2:193     15 ILE  HN          4.50    (#    193:10  Single Ambig)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
 igr1= 192, 193, 194, 189, 190, 921, 922, 923, 925, 926,
       927, 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:194     15 ILE  HN          3.50    (#    194:10  Single Ambig)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 185, 186, 187, 227, 228, 229,
 &end
#
#    0 AMB  10-2:195     15 ILE  HN          4.50    (#    195:10  Single Ambig)
 &rst
  ixpk= 195, nxpk= 10, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 329, 330, 331, 333, 334, 335, 220, 221, 222,
 &end
#
#   15 ILE  HG1-         15 ILE  HN          5.50    (#    197:10  Unique         2.38, 3.22 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 224, 225,
 &end
#
#   15 ILE  HB           15 ILE  HN          5.50    (#    198:10  Unique         2.23, 2.42 A)
 &rst
  ixpk= 198, nxpk= 10, iat= 218, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  HA           15 ILE  HN          5.50    (#    199:10  Unique         2.27, 2.28 A)
 &rst
  ixpk= 199, nxpk= 10, iat= 200, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HA           15 ILE  HN          5.50    (#    201:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 201, nxpk= 10, iat= 216, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 VAL  HN           15 ILE  HN          5.50    (#    203:10  Unique         3.54, 3.65 A)
 &rst
  ixpk= 203, nxpk= 10, iat= 198, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN           15 ILE  HN          5.50    (#    204:10  Unique         4.14, 4.35 A)
 &rst
  ixpk= 204, nxpk= 10, iat= 233, 214, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   15 ILE  HN           16 CYS  HN          5.50    (#    205:10  Unique         4.14, 4.35 A)
 &rst
  ixpk= 205, nxpk= 10, iat= 214, 233, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:206     16 CYS  HN          5.50    (#    206:10  Single Ambig)
 &rst
  ixpk= 206, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1698, 198,
 &end
#
#  104 LEU  HN           16 CYS  HN          5.50    (#    207:10  Unique         2.51, 3.63 A)
 &rst
  ixpk= 207, nxpk= 10, iat=1715, 233, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           16 CYS  HN          5.50    (#    208:10  Unique         4.23, 4.43 A)
 &rst
  ixpk= 208, nxpk= 10, iat= 244, 233, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2+         16 CYS  HN          5.50    (#    209:10  Unique         3.42, 4.37 A)
 &rst
  ixpk= 209, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   16 CYS  HA           16 CYS  HN          5.50    (#    210:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 210, nxpk= 10, iat= 235, 233, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HA           16 CYS  HN          4.50    (#    211:10  Unique         2.40, 3.20 A)
 &rst
  ixpk= 211, nxpk= 10, iat=1700, 233, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 ILE  HA           16 CYS  HN          3.50    (#    212:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 212, nxpk= 10, iat= 216, 233, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   16 CYS  HB+          16 CYS  HN          5.50    (#    213:10  Unique         2.23, 3.01 A)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#   16 CYS  HB-          16 CYS  HN          5.50    (#    214:10  Unique         2.23, 3.01 A)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#    0 AMB  10-2:215     16 CYS  HN          5.50    (#    215:10  Single Ambig)
 &rst
  ixpk= 215, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1705,1706,1705,1706,
 &end
#
#    0 AMB  10-2:216     16 CYS  HN          5.50    (#    216:10  Single Ambig)
 &rst
  ixpk= 216, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 265, 266, 262, 263,1020,1021,
 &end
#
#  102 LEU  HB+          16 CYS  HN          4.50    (#    217:10  Unique         3.74, 4.64 A)
 &rst
  ixpk= 217, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1683,1684,
 &end
#
#   15 ILE  QG2          16 CYS  HN          3.50    (#    219:10  Unique         2.30, 3.79 A)
 &rst
  ixpk= 219, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 220, 221, 222,
 &end
#
#  101 LEU  MDX          16 CYS  HN          4.50    (#    220:10  Unique         2.62, 5.16 A)
 &rst
  ixpk= 220, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#   15 ILE  QD1          16 CYS  HN          3.50    (#    221:10  Unique         2.50, 4.64 A)
 &rst
  ixpk= 221, nxpk= 10, iat=  -1, 233, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 227, 228, 229,
 &end
#
#   16 CYS  HN           17 ASN  HN          5.50    (#    222:10  Unique         4.23, 4.43 A)
 &rst
  ixpk= 222, nxpk= 10, iat= 233, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLY  HN           17 ASN  HN          5.50    (#    224:10  Unique         2.91, 3.85 A)
 &rst
  ixpk= 224, nxpk= 10, iat= 299, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 GLN  HN           17 ASN  HN          5.50    (#    225:10  Unique         2.54, 3.31 A)
 &rst
  ixpk= 225, nxpk= 10, iat= 306, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HD2+         17 ASN  HN          5.50    (#    228:10  Unique         1.87, 2.91 A)
 &rst
  ixpk= 228, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#   16 CYS  HA           17 ASN  HN          4.50    (#    229:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 229, nxpk= 10, iat= 235, 244, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 VAL  HA           17 ASN  HN          5.50    (#    230:10  Unique         4.12, 4.82 A)
 &rst
  ixpk= 230, nxpk= 10, iat= 325, 244, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HA           17 ASN  HN          4.50    (#    231:10  Unique         2.79, 2.89 A)
 &rst
  ixpk= 231, nxpk= 10, iat= 246, 244, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 ASN  HB+          17 ASN  HN          4.50    (#    232:10  Unique         2.28, 3.17 A)
 &rst
  ixpk= 232, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 248, 249,
 &end
#
#   16 CYS  HB+          17 ASN  HN          4.50    (#    233:10  Unique         2.91, 3.84 A)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 237, 238,
 &end
#
#   16 CYS  HB-          17 ASN  HN          4.50    (#    234:10  Unique         2.91, 3.84 A)
 &rst
  ixpk= 234, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 237, 238,
 &end
#
#    0 AMB  10-2:235     17 ASN  HN          5.50    (#    235:10  Single Ambig)
 &rst
  ixpk= 235, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 289, 290,1719,1720, 286, 287, 313, 314,
 &end
#
#    0 AMB  10-2:236     17 ASN  HN          5.50    (#    236:10  Single Ambig)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 286, 287, 262, 263,
 &end
#
#   18 ARG  HG-          17 ASN  HN          5.50    (#    237:10  Unique         4.74, 6.01 A)
 &rst
  ixpk= 237, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 265, 266,
 &end
#
#    0 AMB  10-2:238     17 ASN  HN          5.50    (#    238:10  Single Ambig)
 &rst
  ixpk= 238, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1724,1725,1726,1728,1729,1730,2565,2566,2567,2569,
      2570,2571,
 &end
#
#    0 AMB  10-2:239     17 ASN  HN          5.50    (#    239:10  Single Ambig)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1669,1670,1671,1673,1674,1675, 921, 922, 923, 925,
       926, 927, 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:240     17 ASN  HN          5.50    (#    240:10  Single Ambig)
 &rst
  ixpk= 240, nxpk= 10, iat=  -1, 244, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 329, 330, 331, 333, 334, 335,1006,1007,1008,1010,
      1011,1012,
 &end
#
#   17 ASN  HN           18 ARG  HN          5.50    (#    242:10  Unique         2.44, 3.50 A)
 &rst
  ixpk= 242, nxpk= 10, iat= 244, 258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HN           18 ARG  HN          4.50    (#    243:10  Unique         1.78, 2.78 A)
 &rst
  ixpk= 243, nxpk= 10, iat= 282, 258, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  103 GLN  HE2+         18 ARG  HN          5.50    (#    244:10  Unique         3.25, 5.45 A)
 &rst
  ixpk= 244, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   17 ASN  HD2+         18 ARG  HN          5.50    (#    245:10  Unique         4.08, 5.28 A)
 &rst
  ixpk= 245, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#   17 ASN  HA           18 ARG  HN          3.50    (#    246:10  Unique         2.33, 2.83 A)
 &rst
  ixpk= 246, nxpk= 10, iat= 246, 258, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 GLN  HA           18 ARG  HN          5.50    (#    247:10  Unique         4.32, 5.20 A)
 &rst
  ixpk= 247, nxpk= 10, iat= 284, 258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 ARG  HA           18 ARG  HN          3.50    (#    248:10  Unique         2.27, 2.52 A)
 &rst
  ixpk= 248, nxpk= 10, iat= 260, 258, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:249     18 ARG  HN          5.50    (#    249:10  Single Ambig)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 268, 269, 268, 269,
 &end
#
#   17 ASN  HB+          18 ARG  HN          4.50    (#    250:10  Unique         1.90, 3.64 A)
 &rst
  ixpk= 250, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:251     18 ARG  HN          5.50    (#    251:10  Single Ambig)
 &rst
  ixpk= 251, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 289, 290,1719,1720, 286, 287,
 &end
#
#   18 ARG  HB+          18 ARG  HN          3.50    (#    252:10  Unique         2.72, 3.57 A)
 &rst
  ixpk= 252, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 262, 263,
 &end
#
#   18 ARG  HG+          18 ARG  HN          2.80    (#    253:10  Unique         1.79, 3.11 A)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 265, 266,
 &end
#
#   18 ARG  HG-          18 ARG  HN          3.50    (#    254:10  Unique         1.79, 3.11 A)
 &rst
  ixpk= 254, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 265, 266,
 &end
#
#  104 LEU  MDY          18 ARG  HN          5.50    (#    255:10  Unique         4.10, 6.64 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  10-2:256     18 ARG  HN          5.50    (#    256:10  Single Ambig)
 &rst
  ixpk= 256, nxpk= 10, iat=  -1, 258, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,2565,2566,2567,2569,2570,2571,
 &end
#
#   20 GLY  HN           19 GLN  HN          3.50    (#    257:10  Unique         1.70, 2.08 A)
 &rst
  ixpk= 257, nxpk= 10, iat= 299, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ARG  HN           19 GLN  HN          3.50    (#    258:10  Unique         1.78, 2.78 A)
 &rst
  ixpk= 258, nxpk= 10, iat= 258, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ASN  HN           19 GLN  HN          5.50    (#    259:10  Unique         3.12, 3.89 A)
 &rst
  ixpk= 259, nxpk= 10, iat= 244, 282, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:260     19 GLN  HN          5.50    (#    260:10  Single Ambig)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 294, 295,2634,2635,
 &end
#
#   17 ASN  HD2+         19 GLN  HN          5.50    (#    261:10  Unique         3.48, 5.59 A)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#   17 ASN  HA           19 GLN  HN          5.50    (#    262:10  Unique         3.88, 4.31 A)
 &rst
  ixpk= 262, nxpk= 10, iat= 246, 282, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HA           19 GLN  HN          3.50    (#    265:10  Unique         2.73, 2.90 A)
 &rst
  ixpk= 265, nxpk= 10, iat= 284, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ARG  HA           19 GLN  HN          3.50    (#    266:10  Unique         2.80, 3.15 A)
 &rst
  ixpk= 266, nxpk= 10, iat= 260, 282, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 GLY  HA-          19 GLN  HN          5.50    (#    267:10  Unique         3.80, 4.49 A)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 301, 302,
 &end
#
#    0 AMB  10-2:268     19 GLN  HN          5.50    (#    268:10  Single Ambig)
 &rst
  ixpk= 268, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 268, 269, 268, 269,
 &end
#
#   17 ASN  HB+          19 GLN  HN          4.50    (#    269:10  Unique         2.09, 3.64 A)
 &rst
  ixpk= 269, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:270     19 GLN  HN          2.80    (#    270:10  Single Ambig)
 &rst
  ixpk= 270, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 289, 290, 286, 287,
 &end
#
#   18 ARG  HB+          19 GLN  HN          4.50    (#    271:10  Unique         1.78, 4.05 A)
 &rst
  ixpk= 271, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 262, 263,
 &end
#
#    0 AMB  10-2:272     19 GLN  HN          2.80    (#    272:10  Single Ambig)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 262, 263, 286, 287,
 &end
#
#   18 ARG  HG-          19 GLN  HN          4.50    (#    273:10  Unique         2.83, 4.42 A)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 265, 266,
 &end
#
#    0 AMB  10-2:274     19 GLN  HN          5.50    (#    274:10  Single Ambig)
 &rst
  ixpk= 274, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1724,1725,1726,1728,1729,1730,1667,
 &end
#
#    0 AMB  10-2:275     19 GLN  HN          5.50    (#    275:10  Single Ambig)
 &rst
  ixpk= 275, nxpk= 10, iat=  -1, 282, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,
 &end
#
#   18 ARG  HN           20 GLY  HN          5.50    (#    277:10  Unique         3.40, 3.95 A)
 &rst
  ixpk= 277, nxpk= 10, iat= 258, 299, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           20 GLY  HN          5.50    (#    278:10  Unique         2.91, 3.85 A)
 &rst
  ixpk= 278, nxpk= 10, iat= 244, 299, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HN           20 GLY  HN          2.80    (#    279:10  Unique         1.70, 2.08 A)
 &rst
  ixpk= 279, nxpk= 10, iat= 282, 299, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   19 GLN  HA           20 GLY  HN          4.50    (#    283:10  Unique         2.93, 3.27 A)
 &rst
  ixpk= 283, nxpk= 10, iat= 284, 299, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 GLY  HA+          20 GLY  HN          3.50    (#    284:10  Unique         2.30, 2.67 A)
 &rst
  ixpk= 284, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 301, 302,
 &end
#
#   20 GLY  HA-          20 GLY  HN          3.50    (#    285:10  Unique         2.30, 2.67 A)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 301, 302,
 &end
#
#   16 CYS  HB+          20 GLY  HN          5.50    (#    286:10  Unique         2.98, 5.26 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#   17 ASN  HB+          20 GLY  HN          5.50    (#    287:10  Unique         2.07, 4.66 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:288     20 GLY  HN          5.50    (#    288:10  Single Ambig)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2629,2630,2629,2630,
 &end
#
#    0 AMB  10-2:289     20 GLY  HN          5.50    (#    289:10  Single Ambig)
 &rst
  ixpk= 289, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 262, 263,2586,2587,2588,
 &end
#
#    0 AMB  10-2:290     20 GLY  HN          4.50    (#    290:10  Single Ambig)
 &rst
  ixpk= 290, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 289, 290, 286, 287,
 &end
#
#   19 GLN  HB-          20 GLY  HN          4.50    (#    291:10  Unique         2.77, 3.94 A)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 286, 287,
 &end
#
#   18 ARG  HG-          20 GLY  HN          5.50    (#    292:10  Unique         4.73, 6.03 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 265, 266,
 &end
#
#  155 VAL  MGX          20 GLY  HN          4.50    (#    293:10  Unique         2.18, 5.15 A)
 &rst
  ixpk= 293, nxpk= 10, iat=  -1, 299, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#   22 VAL  HN           21 GLN  HN          5.50    (#    295:10  Unique         3.81, 4.28 A)
 &rst
  ixpk= 295, nxpk= 10, iat= 323, 306, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLY  HN           21 GLN  HN          3.50    (#    296:10  Unique         1.77, 2.21 A)
 &rst
  ixpk= 296, nxpk= 10, iat= 299, 306, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 ARG  HN           21 GLN  HN          5.50    (#    297:10  Unique         3.83, 4.88 A)
 &rst
  ixpk= 297, nxpk= 10, iat= 258, 306, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           21 GLN  HN          5.50    (#    298:10  Unique         2.54, 3.31 A)
 &rst
  ixpk= 298, nxpk= 10, iat= 244, 306, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:299     21 GLN  HN          5.50    (#    299:10  Single Ambig)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2634,2635, 294, 295,
 &end
#
#    0 AMB  10-2:302     21 GLN  HN          5.50    (#    302:10  Single Ambig)
 &rst
  ixpk= 302, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 318, 319, 235,
 &end
#
#   19 GLN  HA           21 GLN  HN          5.50    (#    305:10  Unique         3.51, 4.87 A)
 &rst
  ixpk= 305, nxpk= 10, iat= 284, 306, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   20 GLY  HA+          21 GLN  HN          4.50    (#    306:10  Unique         2.70, 3.20 A)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 301, 302,
 &end
#
#   20 GLY  HA-          21 GLN  HN          4.50    (#    307:10  Unique         2.70, 3.20 A)
 &rst
  ixpk= 307, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 301, 302,
 &end
#
#    0 AMB  10-2:308     21 GLN  HN          5.50    (#    308:10  Single Ambig)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 248, 249,2042,2043,
 &end
#
#  129 TYR  HB+          21 GLN  HN          5.50    (#    309:10  Unique         4.57, 6.43 A)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#   16 CYS  HB-          21 GLN  HN          5.50    (#    310:10  Unique         2.83, 4.83 A)
 &rst
  ixpk= 310, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 237, 238,
 &end
#
#    0 AMB  10-2:311     21 GLN  HN          3.50    (#    311:10  Single Ambig)
 &rst
  ixpk= 311, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 289, 290, 310, 311,
 &end
#
#    0 AMB  10-2:312     21 GLN  HN          3.50    (#    312:10  Single Ambig)
 &rst
  ixpk= 312, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 310, 311, 286, 287,
 &end
#
#    0 AMB  10-2:313     21 GLN  HN          4.50    (#    313:10  Single Ambig)
 &rst
  ixpk= 313, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 313, 314, 289, 290,
 &end
#
#   22 VAL  MGY          21 GLN  HN          4.50    (#    316:10  Unique         4.87, 6.84 A)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  10-2:317     21 GLN  HN          5.50    (#    317:10  Single Ambig)
 &rst
  ixpk= 317, nxpk= 10, iat=  -1, 306, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,2549,2550,2551,2553,
      2554,2555,
 &end
#
#  127 VAL  HN           22 VAL  HN          5.50    (#    318:10  Unique         2.48, 3.30 A)
 &rst
  ixpk= 318, nxpk= 10, iat=2062, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   21 GLN  HN           22 VAL  HN          5.50    (#    320:10  Unique         3.81, 4.28 A)
 &rst
  ixpk= 320, nxpk= 10, iat= 306, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:323     22 VAL  HN          5.50    (#    323:10  Single Ambig)
 &rst
  ixpk= 323, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 235, 318, 319,
 &end
#
#  126 TRP  HA           22 VAL  HN          5.50    (#    325:10  Unique         4.09, 5.02 A)
 &rst
  ixpk= 325, nxpk= 10, iat=2040, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 SER  HA           22 VAL  HN          5.50    (#    327:10  Unique         4.31, 5.12 A)
 &rst
  ixpk= 327, nxpk= 10, iat=2080, 323, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:328     22 VAL  HN          5.50    (#    328:10  Single Ambig)
 &rst
  ixpk= 328, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2042,2043,2042,2043,
 &end
#
#    0 AMB  10-2:329     22 VAL  HN          5.50    (#    329:10  Single Ambig)
 &rst
  ixpk= 329, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 310, 311, 327,
 &end
#
#   21 GLN  HG+          22 VAL  HN          4.50    (#    330:10  Unique         3.58, 4.47 A)
 &rst
  ixpk= 330, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 313, 314,
 &end
#
#   21 GLN  HB-          22 VAL  HN          5.50    (#    331:10  Unique         1.81, 2.76 A)
 &rst
  ixpk= 331, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 310, 311,
 &end
#
#   22 VAL  MGX          22 VAL  HN          3.50    (#    332:10  Unique         1.93, 3.62 A)
 &rst
  ixpk= 332, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  127 VAL  MGX          22 VAL  HN          5.50    (#    333:10  Unique         2.73, 5.43 A)
 &rst
  ixpk= 333, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY          22 VAL  HN          5.50    (#    334:10  Unique         2.73, 5.43 A)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HN           23 MET  HN          5.50    (#    336:10  Unique         4.11, 4.42 A)
 &rst
  ixpk= 336, nxpk= 10, iat= 356, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HN           23 MET  HN          5.50    (#    337:10  Unique         5.00, 5.40 A)
 &rst
  ixpk= 337, nxpk= 10, iat= 244, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HA           23 MET  HN          5.50    (#    341:10  Unique         3.63, 4.09 A)
 &rst
  ixpk= 341, nxpk= 10, iat= 235, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 VAL  HA           23 MET  HN          5.50    (#    342:10  Unique         2.15, 2.21 A)
 &rst
  ixpk= 342, nxpk= 10, iat= 325, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   23 MET  HA           23 MET  HN          5.50    (#    343:10  Unique         2.72, 2.78 A)
 &rst
  ixpk= 343, nxpk= 10, iat= 341, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HB-          23 MET  HN          5.50    (#    344:10  Unique         5.11, 6.33 A)
 &rst
  ixpk= 344, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   22 VAL  HB           23 MET  HN          5.50    (#    345:10  Unique         2.36, 3.42 A)
 &rst
  ixpk= 345, nxpk= 10, iat= 327, 339, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:346     23 MET  HN          5.50    (#    346:10  Single Ambig)
 &rst
  ixpk= 346, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 343, 344, 343, 344,
 &end
#
#    0 AMB  10-2:348     23 MET  HN          5.50    (#    348:10  Single Ambig)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 224, 225,1683,1684,2563,
 &end
#
#   22 VAL  MGX          23 MET  HN          4.50    (#    350:10  Unique         2.01, 4.43 A)
 &rst
  ixpk= 350, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#    0 AMB  10-2:351     23 MET  HN          5.50    (#    351:10  Single Ambig)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 185, 186, 187, 227, 228, 229, 829, 830, 831, 833,
       834, 835,
 &end
#
#   14 VAL  MGY          23 MET  HN          5.50    (#    352:10  Unique         3.29, 5.93 A)
 &rst
  ixpk= 352, nxpk= 10, iat=  -1, 339, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 204, 205, 206, 208, 209, 210,
 &end
#
#  125 ARG  HN           24 TRP  HN          5.50    (#    353:10  Unique         3.79, 4.78 A)
 &rst
  ixpk= 353, nxpk= 10, iat=2014, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HN           24 TRP  HN          5.50    (#    354:10  Unique         3.98, 4.27 A)
 &rst
  ixpk= 354, nxpk= 10, iat= 380, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HH2          24 TRP  HN          5.50    (#    355:10  Unique         4.85, 5.32 A)
 &rst
  ixpk= 355, nxpk= 10, iat=2053, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:357     24 TRP  HN          5.50    (#    357:10  Single Ambig)
 &rst
  ixpk= 357, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 364,2142,2151,
 &end
#
#    0 AMB  10-2:358     24 TRP  HN          5.50    (#    358:10  Single Ambig)
 &rst
  ixpk= 358, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2040, 358,
 &end
#
#   23 MET  HA           24 TRP  HN          5.50    (#    359:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 359, nxpk= 10, iat= 341, 356, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HB+          24 TRP  HN          5.50    (#    360:10  Unique         2.33, 2.82 A)
 &rst
  ixpk= 360, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#   24 TRP  HB-          24 TRP  HN          5.50    (#    361:10  Unique         2.33, 2.82 A)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#  113 MET  ME           24 TRP  HN          5.50    (#    362:10  Unique         3.99, 5.49 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1849,1850,1851,
 &end
#
#  127 VAL  MGX          24 TRP  HN          5.50    (#    364:10  Unique         3.93, 6.13 A)
 &rst
  ixpk= 364, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY          24 TRP  HN          5.50    (#    365:10  Unique         3.93, 6.13 A)
 &rst
  ixpk= 365, nxpk= 10, iat=  -1, 356, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   24 TRP  HA           25 ALA  HN          5.50    (#    371:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 371, nxpk= 10, iat= 358, 380, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HA           25 ALA  HN          5.50    (#    372:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 372, nxpk= 10, iat= 382, 380, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 TRP  HB-          25 ALA  HN          5.50    (#    373:10  Unique         3.56, 4.22 A)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1, 380, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 360, 361,
 &end
#
#    0 AMB  10-2:374     25 ALA  HN          5.50    (#    374:10  Single Ambig)
 &rst
  ixpk= 374, nxpk= 10, iat=  -1, 380, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 &end
#
#   25 ALA  MB           25 ALA  HN          4.50    (#    375:10  Unique         2.56, 3.24 A)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1, 380, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 384, 385, 386,
 &end
#
#  125 ARG  HN           26 ARG  HN          5.50    (#    376:10  Unique         3.98, 5.06 A)
 &rst
  ixpk= 376, nxpk= 10, iat=2014, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HN           26 ARG  HN          5.50    (#    377:10  Unique         3.16, 4.26 A)
 &rst
  ixpk= 377, nxpk= 10, iat=1971, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HE           26 ARG  HN          5.50    (#    378:10  Unique         2.65, 4.34 A)
 &rst
  ixpk= 378, nxpk= 10, iat= 403, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HN           26 ARG  HN          5.50    (#    379:10  Unique         2.06, 3.13 A)
 &rst
  ixpk= 379, nxpk= 10, iat=1983, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HA           26 ARG  HN          5.50    (#    382:10  Unique         3.89, 5.78 A)
 &rst
  ixpk= 382, nxpk= 10, iat=1992, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HA           26 ARG  HN          5.50    (#    383:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 383, nxpk= 10, iat= 382, 390, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HB+          26 ARG  HN          5.50    (#    384:10  Unique         3.24, 4.57 A)
 &rst
  ixpk= 384, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#    0 AMB  10-2:385     26 ARG  HN          5.50    (#    385:10  Single Ambig)
 &rst
  ixpk= 385, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1994,1995, 400, 401, 400, 401,
 &end
#
#    0 AMB  10-2:386     26 ARG  HN          5.50    (#    386:10  Single Ambig)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1975,1976, 360, 361,
 &end
#
#    0 AMB  10-2:387     26 ARG  HN          5.50    (#    387:10  Single Ambig)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1849,1850,1851,1842,1843,1842,1843,
 &end
#
#    0 AMB  10-2:388     26 ARG  HN          5.50    (#    388:10  Single Ambig)
 &rst
  ixpk= 388, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 394, 395, 394, 395,
 &end
#
#   25 ALA  MB           26 ARG  HN          4.50    (#    389:10  Unique         2.76, 3.97 A)
 &rst
  ixpk= 389, nxpk= 10, iat=  -1, 390, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 384, 385, 386,
 &end
#
#   26 ARG  HG-          27 ARG  HN          5.50    (#    392:10  Unique         2.21, 3.27 A)
 &rst
  ixpk= 392, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   26 ARG  HG+          27 ARG  HN          5.50    (#    394:10  Unique         2.21, 3.27 A)
 &rst
  ixpk= 394, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   27 ARG  HG-          27 ARG  HN          5.50    (#    395:10  Unique         3.37, 4.26 A)
 &rst
  ixpk= 395, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 421, 422,
 &end
#
#   27 ARG  HB-          27 ARG  HN          4.50    (#    396:10  Unique         2.07, 2.62 A)
 &rst
  ixpk= 396, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 418, 419,
 &end
#
#   27 ARG  HB+          27 ARG  HN          4.50    (#    397:10  Unique         2.07, 2.62 A)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 418, 419,
 &end
#
#    0 AMB  10-2:398     27 ARG  HN          5.50    (#    398:10  Single Ambig)
 &rst
  ixpk= 398, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 472, 473, 472, 473,
 &end
#
#   27 ARG  HD-          27 ARG  HN          5.50    (#    400:10  Unique         2.84, 4.77 A)
 &rst
  ixpk= 400, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#    0 AMB  10-2:401     27 ARG  HN          5.50    (#    401:10  Single Ambig)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 424, 425, 400, 401, 400, 401,
 &end
#
#    0 AMB  10-2:402     27 ARG  HN          5.50    (#    402:10  Single Ambig)
 &rst
  ixpk= 402, nxpk= 10, iat=  -1, 414, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 392,1955,1956,
 &end
#
#   27 ARG  HA           27 ARG  HN          5.50    (#    403:10  Unique         2.74, 2.81 A)
 &rst
  ixpk= 403, nxpk= 10, iat= 416, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HA           27 ARG  HN          5.50    (#    404:10  Unique         2.80, 3.29 A)
 &rst
  ixpk= 404, nxpk= 10, iat= 512, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HN           27 ARG  HN          5.50    (#    405:10  Unique         1.89, 3.01 A)
 &rst
  ixpk= 405, nxpk= 10, iat= 499, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HN           27 ARG  HN          5.50    (#    407:10  Unique         4.41, 4.77 A)
 &rst
  ixpk= 407, nxpk= 10, iat= 510, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HN           27 ARG  HN          5.50    (#    408:10  Unique         4.66, 4.98 A)
 &rst
  ixpk= 408, nxpk= 10, iat=1971, 414, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HN           28 PHE  HN          5.50    (#    409:10  Unique         1.89, 3.19 A)
 &rst
  ixpk= 409, nxpk= 10, iat=1971, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HD           28 PHE  HN          4.50    (#    410:10  Unique         1.94, 3.72 A)
 &rst
  ixpk= 410, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 446, 454,
 &end
#
#  121 PHE  HA           28 PHE  HN          5.50    (#    411:10  Unique         1.85, 2.31 A)
 &rst
  ixpk= 411, nxpk= 10, iat=1953, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HA           28 PHE  HN          5.50    (#    412:10  Unique         2.14, 2.20 A)
 &rst
  ixpk= 412, nxpk= 10, iat= 416, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HA           28 PHE  HN          5.50    (#    413:10  Unique         2.27, 2.77 A)
 &rst
  ixpk= 413, nxpk= 10, iat= 440, 438, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HB+          28 PHE  HN          5.50    (#    414:10  Unique         1.94, 4.57 A)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#   27 ARG  HD+          28 PHE  HN          5.50    (#    415:10  Unique         1.94, 3.92 A)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#   28 PHE  HB+          28 PHE  HN          4.50    (#    416:10  Unique         2.07, 2.96 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 442, 443,
 &end
#
#   30 GLN  HB-          28 PHE  HN          5.50    (#    417:10  Unique         4.23, 5.74 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 469, 470,
 &end
#
#   27 ARG  HG-          28 PHE  HN          5.50    (#    418:10  Unique         1.96, 4.06 A)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 421, 422,
 &end
#
#   28 PHE  HB-          28 PHE  HN          5.50    (#    419:10  Unique         2.07, 2.96 A)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1, 438, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#   30 GLN  HN           29 GLY  HN          4.50    (#    421:10  Unique         2.01, 2.70 A)
 &rst
  ixpk= 421, nxpk= 10, iat= 465, 458, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 HIS  HD2          29 GLY  HN          5.50    (#    422:10  Unique         2.59, 3.93 A)
 &rst
  ixpk= 422, nxpk= 10, iat= 495, 458, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HD           29 GLY  HN          5.50    (#    423:10  Unique         1.92, 4.37 A)
 &rst
  ixpk= 423, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 446, 454,
 &end
#
#   30 GLN  HA           29 GLY  HN          5.50    (#    425:10  Unique         4.51, 5.05 A)
 &rst
  ixpk= 425, nxpk= 10, iat= 467, 458, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   29 GLY  HA+          29 GLY  HN          3.50    (#    426:10  Unique         2.30, 2.66 A)
 &rst
  ixpk= 426, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 460, 461,
 &end
#
#   28 PHE  HA           29 GLY  HN          3.50    (#    427:10  Unique         2.14, 2.76 A)
 &rst
  ixpk= 427, nxpk= 10, iat= 440, 458, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 GLY  HA-          29 GLY  HN          3.50    (#    428:10  Unique         2.30, 2.66 A)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 460, 461,
 &end
#
#  122 ASP  HB+          29 GLY  HN          5.50    (#    429:10  Unique         5.02, 6.04 A)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#   28 PHE  HB+          29 GLY  HN          5.50    (#    430:10  Unique         1.87, 3.79 A)
 &rst
  ixpk= 430, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#   28 PHE  HB-          29 GLY  HN          5.50    (#    431:10  Unique         1.87, 3.79 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#  122 ASP  HB-          29 GLY  HN          4.50    (#    432:10  Unique         5.02, 6.04 A)
 &rst
  ixpk= 432, nxpk= 10, iat=  -1, 458, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1975,1976,
 &end
#
#    0 AMB  10-2:433     30 GLN  HN          3.50    (#    433:10  Single Ambig)
 &rst
  ixpk= 433, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 482, 458,
 &end
#
#   27 ARG  HN           30 GLN  HN          5.50    (#    434:10  Unique         4.86, 5.27 A)
 &rst
  ixpk= 434, nxpk= 10, iat= 414, 465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HD2          30 GLN  HN          5.50    (#    435:10  Unique         2.74, 4.04 A)
 &rst
  ixpk= 435, nxpk= 10, iat= 495, 465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 PHE  HD           30 GLN  HN          5.50    (#    436:10  Unique         3.90, 5.86 A)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 446, 454,
 &end
#
#   32 SER  HN           30 GLN  HN          5.50    (#    437:10  Unique         3.60, 4.25 A)
 &rst
  ixpk= 437, nxpk= 10, iat= 499, 465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HA           30 GLN  HN          5.50    (#    439:10  Unique         3.87, 4.46 A)
 &rst
  ixpk= 439, nxpk= 10, iat= 484, 465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 GLN  HA           30 GLN  HN          3.50    (#    440:10  Unique         2.70, 2.87 A)
 &rst
  ixpk= 440, nxpk= 10, iat= 467, 465, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 PHE  HA           30 GLN  HN          4.50    (#    441:10  Unique         3.23, 4.21 A)
 &rst
  ixpk= 441, nxpk= 10, iat= 440, 465, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 GLY  HA+          30 GLN  HN          3.50    (#    442:10  Unique         2.44, 3.18 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 460, 461,
 &end
#
#   29 GLY  HA-          30 GLN  HN          3.50    (#    443:10  Unique         2.44, 3.18 A)
 &rst
  ixpk= 443, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 460, 461,
 &end
#
#    0 AMB  10-2:444     30 GLN  HN          3.50    (#    444:10  Single Ambig)
 &rst
  ixpk= 444, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 472, 473, 472, 473,
 &end
#
#    0 AMB  10-2:445     30 GLN  HN          3.50    (#    445:10  Single Ambig)
 &rst
  ixpk= 445, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 418, 419, 469, 470,
 &end
#
#   27 ARG  HG-          30 GLN  HN          5.50    (#    446:10  Unique         1.92, 4.45 A)
 &rst
  ixpk= 446, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 421, 422,
 &end
#
#   26 ARG  HG-          30 GLN  HN          5.50    (#    447:10  Unique         4.28, 5.74 A)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1, 465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   30 GLN  HN           31 HIS  HN          5.50    (#    448:10  Unique         1.79, 2.22 A)
 &rst
  ixpk= 448, nxpk= 10, iat= 465, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HD2          31 HIS  HN          5.50    (#    449:10  Unique         2.21, 2.83 A)
 &rst
  ixpk= 449, nxpk= 10, iat= 495, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HN           31 HIS  HN          5.50    (#    450:10  Unique         2.58, 2.71 A)
 &rst
  ixpk= 450, nxpk= 10, iat= 499, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HA           31 HIS  HN          5.50    (#    452:10  Unique         2.27, 2.28 A)
 &rst
  ixpk= 452, nxpk= 10, iat= 484, 482, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 GLN  HA           31 HIS  HN          4.50    (#    453:10  Unique         3.37, 3.47 A)
 &rst
  ixpk= 453, nxpk= 10, iat= 467, 482, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:454     31 HIS  HN          5.50    (#    454:10  Single Ambig)
 &rst
  ixpk= 454, nxpk= 10, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 460, 461, 503, 504, 503, 504,
 &end
#
#   31 HIS  HB+          31 HIS  HN          5.50    (#    455:10  Unique         3.22, 3.79 A)
 &rst
  ixpk= 455, nxpk= 10, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#   31 HIS  HB-          31 HIS  HN          5.50    (#    456:10  Unique         3.22, 3.79 A)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#    0 AMB  10-2:458     31 HIS  HN          4.50    (#    458:10  Single Ambig)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 472, 473, 472, 473,
 &end
#
#   27 ARG  HB+          31 HIS  HN          5.50    (#    459:10  Unique         1.92, 3.97 A)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1, 482, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 418, 419,
 &end
#
#   27 ARG  HN           32 SER  HN          5.50    (#    460:10  Unique         1.89, 3.01 A)
 &rst
  ixpk= 460, nxpk= 10, iat= 414, 499, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 HIS  HN           32 SER  HN          3.50    (#    461:10  Unique         2.58, 2.71 A)
 &rst
  ixpk= 461, nxpk= 10, iat= 482, 499, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   30 GLN  HN           32 SER  HN          5.50    (#    462:10  Unique         3.60, 4.25 A)
 &rst
  ixpk= 462, nxpk= 10, iat= 465, 499, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HA           32 SER  HN          4.50    (#    463:10  Unique         2.84, 2.90 A)
 &rst
  ixpk= 463, nxpk= 10, iat= 501, 499, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 HIS  HA           32 SER  HN          4.50    (#    464:10  Unique         2.47, 2.83 A)
 &rst
  ixpk= 464, nxpk= 10, iat= 484, 499, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 GLN  HA           32 SER  HN          5.50    (#    465:10  Unique         4.11, 4.72 A)
 &rst
  ixpk= 465, nxpk= 10, iat= 467, 499, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:466     32 SER  HN          3.50    (#    466:10  Single Ambig)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 503, 504, 503, 504,
 &end
#
#   31 HIS  HB+          32 SER  HN          5.50    (#    467:10  Unique         3.88, 4.29 A)
 &rst
  ixpk= 467, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 486, 487,
 &end
#
#    0 AMB  10-2:468     32 SER  HN          5.50    (#    468:10  Single Ambig)
 &rst
  ixpk= 468, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 486, 487,1955,1956,
 &end
#
#   27 ARG  HD-          32 SER  HN          5.50    (#    469:10  Unique         4.07, 5.92 A)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#    0 AMB  10-2:470     32 SER  HN          3.50    (#    470:10  Single Ambig)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 472, 473, 472, 473,
 &end
#
#   27 ARG  HB-          32 SER  HN          4.50    (#    471:10  Unique         1.89, 3.43 A)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 418, 419,
 &end
#
#    0 AMB  10-2:472     32 SER  HN          3.50    (#    472:10  Single Ambig)
 &rst
  ixpk= 472, nxpk= 10, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 418, 419, 469, 470,
 &end
#
#   24 TRP  HE1          33 TRP  HN          5.50    (#    475:10  Unique         4.59, 5.10 A)
 &rst
  ixpk= 475, nxpk= 10, iat= 366, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HD1          33 TRP  HN          5.50    (#    477:10  Unique         1.93, 2.58 A)
 &rst
  ixpk= 477, nxpk= 10, iat= 518, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HN           33 TRP  HN          5.50    (#    478:10  Unique         4.14, 4.31 A)
 &rst
  ixpk= 478, nxpk= 10, iat= 499, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HA           33 TRP  HN          5.50    (#    481:10  Unique         2.87, 2.89 A)
 &rst
  ixpk= 481, nxpk= 10, iat= 512, 510, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 SER  HA           33 TRP  HN          3.50    (#    482:10  Unique         2.14, 2.25 A)
 &rst
  ixpk= 482, nxpk= 10, iat= 501, 510, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:483     33 TRP  HN          3.50    (#    483:10  Single Ambig)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 503, 504, 503, 504,
 &end
#
#   33 TRP  HB+          33 TRP  HN          4.50    (#    485:10  Unique         2.11, 3.13 A)
 &rst
  ixpk= 485, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 514, 515,
 &end
#
#   33 TRP  HB-          33 TRP  HN          4.50    (#    486:10  Unique         2.11, 3.13 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 510, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 514, 515,
 &end
#
#   27 ARG  HB+          34 GLN  HN          5.50    (#    488:10  Unique         2.79, 4.65 A)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 418, 419,
 &end
#
#   34 GLN  HB-          34 GLN  HN          5.50    (#    489:10  Unique         2.35, 2.96 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 538, 539,
 &end
#
#   34 GLN  HB+          34 GLN  HN          5.50    (#    490:10  Unique         2.35, 2.96 A)
 &rst
  ixpk= 490, nxpk= 10, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 538, 539,
 &end
#
#   34 GLN  HA           34 GLN  HN          5.50    (#    491:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 491, nxpk= 10, iat= 536, 534, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HA           34 GLN  HN          5.50    (#    492:10  Unique         4.86, 5.33 A)
 &rst
  ixpk= 492, nxpk= 10, iat= 416, 534, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   34 GLN  HA           35 PHE  HN          4.50    (#    494:10  Unique         2.43, 2.47 A)
 &rst
  ixpk= 494, nxpk= 10, iat= 536, 551, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 GLN  HB-          35 PHE  HN          5.50    (#    496:10  Unique         2.27, 3.26 A)
 &rst
  ixpk= 496, nxpk= 10, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 538, 539,
 &end
#
#   35 PHE  HB+          35 PHE  HN          5.50    (#    497:10  Unique         2.08, 2.91 A)
 &rst
  ixpk= 497, nxpk= 10, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 555, 556,
 &end
#
#   35 PHE  HB-          35 PHE  HN          5.50    (#    498:10  Unique         2.08, 2.91 A)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 555, 556,
 &end
#
#   38 GLY  HN           37 GLN  HN          5.50    (#    501:10  Unique         3.69, 4.27 A)
 &rst
  ixpk= 501, nxpk= 10, iat= 602, 585, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HH2          37 GLN  HN          5.50    (#    503:10  Unique         4.26, 5.23 A)
 &rst
  ixpk= 503, nxpk= 10, iat=1631, 585, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 GLN  HA           37 GLN  HN          5.50    (#    505:10  Unique         2.27, 2.30 A)
 &rst
  ixpk= 505, nxpk= 10, iat= 587, 585, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   36 PRO  HA           37 GLN  HN          3.50    (#    506:10  Unique         3.37, 3.51 A)
 &rst
  ixpk= 506, nxpk= 10, iat= 581, 585, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 GLY  HA+          37 GLN  HN          5.50    (#    507:10  Unique         2.43, 3.84 A)
 &rst
  ixpk= 507, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 174, 175,
 &end
#
#   36 PRO  HB+          37 GLN  HN          5.50    (#    508:10  Unique         1.89, 2.92 A)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 578, 579,
 &end
#
#   37 GLN  HB-          37 GLN  HN          4.50    (#    509:10  Unique         2.39, 3.49 A)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 589, 590,
 &end
#
#   37 GLN  HB+          37 GLN  HN          4.50    (#    510:10  Unique         2.39, 3.49 A)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 589, 590,
 &end
#
#    0 AMB  10-2:512     37 GLN  HN          5.50    (#    512:10  Single Ambig)
 &rst
  ixpk= 512, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 189, 190, 814, 815, 816,
 &end
#
#    0 AMB  10-2:513     37 GLN  HN          5.50    (#    513:10  Single Ambig)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 189, 190, 162, 163, 164, 166, 167, 168, 192, 193,
       194,
 &end
#
#    0 AMB  10-2:514     37 GLN  HN          5.50    (#    514:10  Single Ambig)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1, 585, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1=1688,1689,1690,1692,1693,1694, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,1562,1563,
      
 &end
#
#   11 VAL  HN           38 GLY  HN          5.50    (#    515:10  Unique         2.05, 2.44 A)
 &rst
  ixpk= 515, nxpk= 10, iat= 156, 602, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   39 GLY  HN           38 GLY  HN          5.50    (#    516:10  Unique         1.88, 2.41 A)
 &rst
  ixpk= 516, nxpk= 10, iat= 609, 602, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+         38 GLY  HN          5.50    (#    520:10  Unique         3.73, 5.40 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HA           38 GLY  HN          5.50    (#    522:10  Unique         3.43, 4.07 A)
 &rst
  ixpk= 522, nxpk= 10, iat= 144, 602, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   37 GLN  HA           38 GLY  HN          4.50    (#    523:10  Unique         2.16, 2.27 A)
 &rst
  ixpk= 523, nxpk= 10, iat= 587, 602, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 GLY  HA+          38 GLY  HN          4.50    (#    524:10  Unique         2.36, 2.75 A)
 &rst
  ixpk= 524, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 604, 605,
 &end
#
#    0 AMB  10-2:525     38 GLY  HN          5.50    (#    525:10  Single Ambig)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 174, 175, 812,
 &end
#
#   38 GLY  HA-          38 GLY  HN          4.50    (#    526:10  Unique         2.36, 2.75 A)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 604, 605,
 &end
#
#   10 ASN  HB+          38 GLY  HN          5.50    (#    527:10  Unique         1.91, 2.95 A)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB-          38 GLY  HN          5.50    (#    528:10  Unique         1.91, 2.95 A)
 &rst
  ixpk= 528, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#    0 AMB  10-2:529     38 GLY  HN          5.50    (#    529:10  Single Ambig)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 881, 882,1545,1546,
 &end
#
#   37 GLN  HB-          38 GLY  HN          4.50    (#    530:10  Unique         2.59, 3.77 A)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 589, 590,
 &end
#
#   37 GLN  HB+          38 GLY  HN          4.50    (#    531:10  Unique         2.59, 3.77 A)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 589, 590,
 &end
#
#    0 AMB  10-2:532     38 GLY  HN          5.50    (#    532:10  Single Ambig)
 &rst
  ixpk= 532, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 160, 135, 136,
 &end
#
#    0 AMB  10-2:533     38 GLY  HN          5.50    (#    533:10  Single Ambig)
 &rst
  ixpk= 533, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1943,1944,1542,1543, 742, 743, 744, 793, 794, 755,
       756,
 &end
#
#    0 AMB  10-2:534     38 GLY  HN          5.50    (#    534:10  Single Ambig)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 814, 815, 816, 189, 190,
 &end
#
#   11 VAL  MGY          38 GLY  HN          5.50    (#    535:10  Unique         2.87, 5.40 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          38 GLY  HN          4.50    (#    537:10  Unique         2.87, 5.40 A)
 &rst
  ixpk= 537, nxpk= 10, iat=  -1, 602, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  HN           39 GLY  HN          5.50    (#    539:10  Unique         1.91, 2.42 A)
 &rst
  ixpk= 539, nxpk= 10, iat= 156, 609, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 GLY  HN           39 GLY  HN          5.50    (#    540:10  Unique         1.88, 2.41 A)
 &rst
  ixpk= 540, nxpk= 10, iat= 602, 609, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HN           39 GLY  HN          4.50    (#    541:10  Unique         2.53, 3.41 A)
 &rst
  ixpk= 541, nxpk= 10, iat= 616, 609, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HD2-         39 GLY  HN          5.50    (#    542:10  Unique         3.94, 5.83 A)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HA           39 GLY  HN          5.50    (#    543:10  Unique         1.94, 2.59 A)
 &rst
  ixpk= 543, nxpk= 10, iat= 144, 609, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 GLY  HA+          39 GLY  HN          3.50    (#    544:10  Unique         2.29, 3.06 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 604, 605,
 &end
#
#   39 GLY  HA+          39 GLY  HN          3.50    (#    545:10  Unique         2.30, 2.70 A)
 &rst
  ixpk= 545, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 611, 612,
 &end
#
#   38 GLY  HA-          39 GLY  HN          2.80    (#    546:10  Unique         2.29, 3.06 A)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 604, 605,
 &end
#
#   10 ASN  HB+          39 GLY  HN          5.50    (#    547:10  Unique         1.94, 3.17 A)
 &rst
  ixpk= 547, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB-          39 GLY  HN          5.50    (#    548:10  Unique         1.94, 3.17 A)
 &rst
  ixpk= 548, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#    0 AMB  10-2:549     39 GLY  HN          5.50    (#    549:10  Single Ambig)
 &rst
  ixpk= 549, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 589, 590, 863, 864, 677, 678,
 &end
#
#    0 AMB  10-2:550     39 GLY  HN          5.50    (#    550:10  Single Ambig)
 &rst
  ixpk= 550, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791, 589, 590,
 &end
#
#    0 AMB  10-2:551     39 GLY  HN          5.50    (#    551:10  Single Ambig)
 &rst
  ixpk= 551, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 742, 743, 744, 793, 794, 620,
 &end
#
#   53 ALA  MB           39 GLY  HN          5.50    (#    552:10  Unique         3.80, 5.21 A)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 814, 815, 816,
 &end
#
#   11 VAL  MGY          39 GLY  HN          5.50    (#    553:10  Unique         2.38, 4.43 A)
 &rst
  ixpk= 553, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   40 ILE  HG1+         39 GLY  HN          5.50    (#    554:10  Unique         3.43, 4.80 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   11 VAL  MGX          39 GLY  HN          5.50    (#    555:10  Unique         2.38, 4.43 A)
 &rst
  ixpk= 555, nxpk= 10, iat=  -1, 609, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   10 ASN  HN           40 ILE  HN          5.50    (#    556:10  Unique         3.67, 3.99 A)
 &rst
  ixpk= 556, nxpk= 10, iat= 142, 616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           40 ILE  HN          5.50    (#    557:10  Unique         4.10, 4.39 A)
 &rst
  ixpk= 557, nxpk= 10, iat= 156, 616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   39 GLY  HN           40 ILE  HN          4.50    (#    558:10  Unique         2.53, 3.41 A)
 &rst
  ixpk= 558, nxpk= 10, iat= 609, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 ASN  HD2-         40 ILE  HN          5.50    (#    559:10  Unique         4.83, 6.01 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HA           40 ILE  HN          4.50    (#    560:10  Unique         1.86, 1.95 A)
 &rst
  ixpk= 560, nxpk= 10, iat= 144, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   39 GLY  HA+          40 ILE  HN          3.50    (#    561:10  Unique         2.14, 2.77 A)
 &rst
  ixpk= 561, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 611, 612,
 &end
#
#   40 ILE  HA           40 ILE  HN          4.50    (#    562:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 562, nxpk= 10, iat= 618, 616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:563     40 ILE  HN          5.50    (#    563:10  Single Ambig)
 &rst
  ixpk= 563, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 129, 130, 129, 130, 698,
 &end
#
#   39 GLY  HA-          40 ILE  HN          3.50    (#    564:10  Unique         2.14, 2.77 A)
 &rst
  ixpk= 564, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 611, 612,
 &end
#
#   10 ASN  HB+          40 ILE  HN          5.50    (#    565:10  Unique         3.14, 4.33 A)
 &rst
  ixpk= 565, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#   10 ASN  HB-          40 ILE  HN          5.50    (#    566:10  Unique         3.14, 4.33 A)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 146, 147,
 &end
#
#    9 PRO  HG+          40 ILE  HN          5.50    (#    567:10  Unique         3.89, 4.80 A)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 132, 133,
 &end
#
#   40 ILE  HB           40 ILE  HN          3.50    (#    571:10  Unique         2.32, 2.50 A)
 &rst
  ixpk= 571, nxpk= 10, iat= 620, 616, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:572     40 ILE  HN          3.50    (#    572:10  Single Ambig)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 162, 163, 164, 166, 167, 168, 622, 623, 624,
 &end
#
#   40 ILE  HG1+         40 ILE  HN          5.50    (#    573:10  Unique         1.94, 2.92 A)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   11 VAL  MGX          40 ILE  HN          5.50    (#    574:10  Unique         3.73, 5.32 A)
 &rst
  ixpk= 574, nxpk= 10, iat=  -1, 616, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   52 ARG  HE           41 ASN  HN          5.50    (#    575:10  Unique         4.44, 5.20 A)
 &rst
  ixpk= 575, nxpk= 10, iat= 799, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ALA  HN           41 ASN  HN          5.50    (#    576:10  Unique         4.68, 5.29 A)
 &rst
  ixpk= 576, nxpk= 10, iat= 738, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 GLU  HN           41 ASN  HN          5.50    (#    577:10  Unique         3.90, 4.25 A)
 &rst
  ixpk= 577, nxpk= 10, iat= 670, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 ASN  HD2+         41 ASN  HN          5.50    (#    578:10  Unique         2.67, 4.53 A)
 &rst
  ixpk= 578, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 644, 645,
 &end
#
#   40 ILE  HN           41 ASN  HN          5.50    (#    579:10  Unique         4.45, 4.59 A)
 &rst
  ixpk= 579, nxpk= 10, iat= 616, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   41 ASN  HD2-         41 ASN  HN          5.50    (#    580:10  Unique         2.67, 4.53 A)
 &rst
  ixpk= 580, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 644, 645,
 &end
#
#   41 ASN  HA           41 ASN  HN          5.50    (#    582:10  Unique         2.76, 2.88 A)
 &rst
  ixpk= 582, nxpk= 10, iat= 637, 635, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   40 ILE  HA           41 ASN  HN          4.50    (#    583:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 583, nxpk= 10, iat= 618, 635, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 PRO  HD+          41 ASN  HN          5.50    (#    584:10  Unique         4.70, 4.91 A)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   42 PRO  HD-          41 ASN  HN          5.50    (#    585:10  Unique         4.70, 4.91 A)
 &rst
  ixpk= 585, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   41 ASN  HB+          41 ASN  HN          5.50    (#    586:10  Unique         2.08, 2.79 A)
 &rst
  ixpk= 586, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 639, 640,
 &end
#
#   41 ASN  HB-          41 ASN  HN          4.50    (#    587:10  Unique         2.08, 2.79 A)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 639, 640,
 &end
#
#    0 AMB  10-2:588     41 ASN  HN          4.50    (#    588:10  Single Ambig)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 674, 675, 674, 675, 677, 678,
 &end
#
#   49 ALA  MB           41 ASN  HN          3.50    (#    589:10  Unique         2.12, 3.29 A)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 742, 743, 744,
 &end
#
#   40 ILE  QG2          41 ASN  HN          3.50    (#    590:10  Unique         1.95, 3.13 A)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 622, 623, 624,
 &end
#
#   40 ILE  HG1+         41 ASN  HN          5.50    (#    591:10  Unique         3.95, 4.59 A)
 &rst
  ixpk= 591, nxpk= 10, iat=  -1, 635, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 626, 627,
 &end
#
#   44 GLU  HN           43 GLY  HN          3.50    (#    592:10  Unique         1.89, 2.37 A)
 &rst
  ixpk= 592, nxpk= 10, iat= 670, 663, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 ASN  HA           43 GLY  HN          5.50    (#    593:10  Unique         4.89, 5.13 A)
 &rst
  ixpk= 593, nxpk= 10, iat= 637, 663, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:595     43 GLY  HN          5.50    (#    595:10  Single Ambig)
 &rst
  ixpk= 595, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 687, 672,
 &end
#
#   42 PRO  HA           43 GLY  HN          2.80    (#    596:10  Unique         2.21, 2.37 A)
 &rst
  ixpk= 596, nxpk= 10, iat= 659, 663, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   43 GLY  HA+          43 GLY  HN          2.80    (#    597:10  Unique         2.35, 2.70 A)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 665, 666,
 &end
#
#   43 GLY  HA-          43 GLY  HN          2.80    (#    598:10  Unique         2.35, 2.70 A)
 &rst
  ixpk= 598, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 665, 666,
 &end
#
#   42 PRO  HD+          43 GLY  HN          5.50    (#    599:10  Unique         4.81, 5.11 A)
 &rst
  ixpk= 599, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   42 PRO  HB+          43 GLY  HN          3.50    (#    600:10  Unique         3.99, 4.35 A)
 &rst
  ixpk= 600, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 656, 657,
 &end
#
#    0 AMB  10-2:601     43 GLY  HN          4.50    (#    601:10  Single Ambig)
 &rst
  ixpk= 601, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 677, 678, 674, 675, 674, 675, 653, 654,
 &end
#
#    0 AMB  10-2:602     43 GLY  HN          4.50    (#    602:10  Single Ambig)
 &rst
  ixpk= 602, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  15,  16,  17, 653, 654,
 &end
#
#   42 PRO  HB-          43 GLY  HN          4.50    (#    603:10  Unique         3.99, 4.35 A)
 &rst
  ixpk= 603, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 656, 657,
 &end
#
#   40 ILE  QG2          43 GLY  HN          5.50    (#    604:10  Unique         3.67, 4.74 A)
 &rst
  ixpk= 604, nxpk= 10, iat=  -1, 663, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#   41 ASN  HN           44 GLU  HN          5.50    (#    605:10  Unique         3.90, 4.25 A)
 &rst
  ixpk= 605, nxpk= 10, iat= 635, 670, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   43 GLY  HN           44 GLU  HN          3.50    (#    606:10  Unique         1.89, 2.37 A)
 &rst
  ixpk= 606, nxpk= 10, iat= 663, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   45 SER  HN           44 GLU  HN          4.50    (#    607:10  Unique         1.89, 3.86 A)
 &rst
  ixpk= 607, nxpk= 10, iat= 685, 670, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:608     44 GLU  HN          5.50    (#    608:10  Single Ambig)
 &rst
  ixpk= 608, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 644, 645, 733, 734,
 &end
#
#   41 ASN  HA           44 GLU  HN          5.50    (#    610:10  Unique         4.57, 4.81 A)
 &rst
  ixpk= 610, nxpk= 10, iat= 637, 670, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 GLU  HA           44 GLU  HN          3.50    (#    611:10  Unique         2.79, 2.86 A)
 &rst
  ixpk= 611, nxpk= 10, iat= 672, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   42 PRO  HA           44 GLU  HN          3.50    (#    612:10  Unique         3.89, 4.09 A)
 &rst
  ixpk= 612, nxpk= 10, iat= 659, 670, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   43 GLY  HA+          44 GLU  HN          3.50    (#    613:10  Unique         2.90, 3.24 A)
 &rst
  ixpk= 613, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 665, 666,
 &end
#
#   42 PRO  HD+          44 GLU  HN          5.50    (#    615:10  Unique         4.28, 5.07 A)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 650, 651,
 &end
#
#   43 GLY  HA-          44 GLU  HN          3.50    (#    616:10  Unique         2.90, 3.24 A)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 665, 666,
 &end
#
#   41 ASN  HB+          44 GLU  HN          5.50    (#    617:10  Unique         2.35, 3.46 A)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 639, 640,
 &end
#
#   44 GLU  HG+          44 GLU  HN          4.50    (#    618:10  Unique         2.44, 4.45 A)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 677, 678,
 &end
#
#    0 AMB  10-2:619     44 GLU  HN          2.80    (#    619:10  Single Ambig)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 674, 675, 674, 675, 677, 678,
 &end
#
#    0 AMB  10-2:620     44 GLU  HN          5.50    (#    620:10  Single Ambig)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 656, 657, 135, 136,
 &end
#
#    0 AMB  10-2:621     44 GLU  HN          5.50    (#    621:10  Single Ambig)
 &rst
  ixpk= 621, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 742, 743, 744, 793, 794,
 &end
#
#   40 ILE  QG2          44 GLU  HN          4.50    (#    622:10  Unique         3.79, 4.70 A)
 &rst
  ixpk= 622, nxpk= 10, iat=  -1, 670, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 622, 623, 624,
 &end
#
#   46 ALA  HN           45 SER  HN          5.50    (#    623:10  Unique         4.33, 4.55 A)
 &rst
  ixpk= 623, nxpk= 10, iat= 696, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ALA  HN           45 SER  HN          5.50    (#    624:10  Unique         3.32, 4.55 A)
 &rst
  ixpk= 624, nxpk= 10, iat= 738, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HN           45 SER  HN          5.50    (#    625:10  Unique         4.29, 4.81 A)
 &rst
  ixpk= 625, nxpk= 10, iat= 721, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 GLU  HN           45 SER  HN          5.50    (#    626:10  Unique         1.89, 3.86 A)
 &rst
  ixpk= 626, nxpk= 10, iat= 670, 685, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HE2+         45 SER  HN          5.50    (#    627:10  Unique         1.87, 3.13 A)
 &rst
  ixpk= 627, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   48 GLN  HE2-         45 SER  HN          5.50    (#    628:10  Unique         1.87, 3.13 A)
 &rst
  ixpk= 628, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   45 SER  HA           45 SER  HN          2.80    (#    629:10  Unique         2.29, 2.68 A)
 &rst
  ixpk= 629, nxpk= 10, iat= 687, 685, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   45 SER  HB+          45 SER  HN          5.50    (#    630:10  Unique         2.15, 2.96 A)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 689, 690,
 &end
#
#   45 SER  HB-          45 SER  HN          4.50    (#    631:10  Unique         2.15, 2.96 A)
 &rst
  ixpk= 631, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 689, 690,
 &end
#
#    0 AMB  10-2:632     45 SER  HN          3.50    (#    632:10  Single Ambig)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 674, 675, 674, 675,
 &end
#
#   44 GLU  HG+          45 SER  HN          3.50    (#    633:10  Unique         2.24, 3.49 A)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 677, 678,
 &end
#
#   49 ALA  MB           45 SER  HN          5.50    (#    635:10  Unique         2.61, 5.32 A)
 &rst
  ixpk= 635, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 742, 743, 744,
 &end
#
#   40 ILE  QG2          45 SER  HN          5.50    (#    636:10  Unique         2.65, 5.26 A)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1, 685, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 622, 623, 624,
 &end
#
#   47 GLU  HN           46 ALA  HN          4.50    (#    637:10  Unique         2.24, 2.45 A)
 &rst
  ixpk= 637, nxpk= 10, iat= 706, 696, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ALA  HN           46 ALA  HN          5.50    (#    639:10  Unique         4.43, 4.75 A)
 &rst
  ixpk= 639, nxpk= 10, iat= 738, 696, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HN           46 ALA  HN          5.50    (#    640:10  Unique         3.70, 4.49 A)
 &rst
  ixpk= 640, nxpk= 10, iat= 721, 696, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:641     46 ALA  HN          5.50    (#    641:10  Single Ambig)
 &rst
  ixpk= 641, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1164, 733, 734,
 &end
#
#   74 TRP  HH2          46 ALA  HN          5.50    (#    642:10  Unique         4.00, 4.54 A)
 &rst
  ixpk= 642, nxpk= 10, iat=1166, 696, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HE2-         46 ALA  HN          5.50    (#    643:10  Unique         4.07, 4.89 A)
 &rst
  ixpk= 643, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   45 SER  HA           46 ALA  HN          2.80    (#    644:10  Unique         2.37, 2.60 A)
 &rst
  ixpk= 644, nxpk= 10, iat= 687, 696, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   45 SER  HB+          46 ALA  HN          4.50    (#    645:10  Unique         2.12, 3.22 A)
 &rst
  ixpk= 645, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 689, 690,
 &end
#
#   46 ALA  HA           46 ALA  HN          3.50    (#    646:10  Unique         2.80, 2.87 A)
 &rst
  ixpk= 646, nxpk= 10, iat= 698, 696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   47 GLU  HA           46 ALA  HN          5.50    (#    647:10  Unique         4.90, 5.07 A)
 &rst
  ixpk= 647, nxpk= 10, iat= 708, 696, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   44 GLU  HG+          46 ALA  HN          5.50    (#    649:10  Unique         5.28, 6.13 A)
 &rst
  ixpk= 649, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 677, 678,
 &end
#
#    0 AMB  10-2:650     46 ALA  HN          5.50    (#    650:10  Single Ambig)
 &rst
  ixpk= 650, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 710, 711, 677, 678, 713, 714, 674, 675,
 &end
#
#    0 AMB  10-2:651     46 ALA  HN          5.50    (#    651:10  Single Ambig)
 &rst
  ixpk= 651, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1607,1608, 713, 714,
 &end
#
#   47 GLU  HB-          46 ALA  HN          5.50    (#    652:10  Unique         4.22, 4.76 A)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 710, 711,
 &end
#
#   46 ALA  MB           46 ALA  HN          2.80    (#    653:10  Unique         2.15, 2.93 A)
 &rst
  ixpk= 653, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 700, 701, 702,
 &end
#
#    0 AMB  10-2:654     46 ALA  HN          5.50    (#    654:10  Single Ambig)
 &rst
  ixpk= 654, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 162, 163, 164, 166, 167, 168,1601,1602,
 &end
#
#    0 AMB  10-2:655     46 ALA  HN          5.50    (#    655:10  Single Ambig)
 &rst
  ixpk= 655, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605, 626, 627,
 &end
#
#    0 AMB  10-2:656     46 ALA  HN          4.50    (#    656:10  Single Ambig)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 622, 623, 624, 162, 163, 164, 166, 167, 168,
 &end
#
#   46 ALA  HN           47 GLU  HN          4.50    (#    658:10  Unique         2.24, 2.45 A)
 &rst
  ixpk= 658, nxpk= 10, iat= 696, 706, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ALA  HN           47 GLU  HN          5.50    (#    659:10  Unique         3.35, 3.89 A)
 &rst
  ixpk= 659, nxpk= 10, iat= 738, 706, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 GLN  HN           47 GLU  HN          4.50    (#    661:10  Unique         2.44, 2.80 A)
 &rst
  ixpk= 661, nxpk= 10, iat= 721, 706, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLN  HE2+         47 GLU  HN          5.50    (#    662:10  Unique         3.46, 4.44 A)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#    0 AMB  10-2:663     47 GLU  HN          5.50    (#    663:10  Single Ambig)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1166, 773, 782,
 &end
#
#   48 GLN  HE2-         47 GLU  HN          4.50    (#    664:10  Unique         3.46, 4.44 A)
 &rst
  ixpk= 664, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 733, 734,
 &end
#
#   51 TYR  HE           47 GLU  HN          5.50    (#    665:10  Unique         5.41, 7.64 A)
 &rst
  ixpk= 665, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   45 SER  HA           47 GLU  HN          4.50    (#    666:10  Unique         4.10, 4.45 A)
 &rst
  ixpk= 666, nxpk= 10, iat= 687, 706, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 SER  HB+          47 GLU  HN          5.50    (#    667:10  Unique         2.18, 3.43 A)
 &rst
  ixpk= 667, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 689, 690,
 &end
#
#   45 SER  HB-          47 GLU  HN          4.50    (#    668:10  Unique         2.18, 3.43 A)
 &rst
  ixpk= 668, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 689, 690,
 &end
#
#   47 GLU  HA           47 GLU  HN          4.50    (#    669:10  Unique         2.75, 2.83 A)
 &rst
  ixpk= 669, nxpk= 10, iat= 708, 706, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:670     47 GLU  HN          5.50    (#    670:10  Single Ambig)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 728, 729, 728, 729,
 &end
#
#    0 AMB  10-2:671     47 GLU  HN          5.50    (#    671:10  Single Ambig)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 725, 726, 677, 678,
 &end
#
#    0 AMB  10-2:672     47 GLU  HN          2.80    (#    672:10  Single Ambig)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 710, 711, 713, 714,
 &end
#
#   47 GLU  HG-          47 GLU  HN          3.50    (#    673:10  Unique         3.05, 4.31 A)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 713, 714,
 &end
#
#   47 GLU  HB-          47 GLU  HN          3.50    (#    674:10  Unique         2.08, 2.60 A)
 &rst
  ixpk= 674, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 710, 711,
 &end
#
#   46 ALA  MB           47 GLU  HN          3.50    (#    675:10  Unique         2.42, 3.60 A)
 &rst
  ixpk= 675, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 700, 701, 702,
 &end
#
#   50 MET  HB-          47 GLU  HN          5.50    (#    676:10  Unique         4.42, 5.20 A)
 &rst
  ixpk= 676, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 752, 753,
 &end
#
#    0 AMB  10-2:677     47 GLU  HN          5.50    (#    677:10  Single Ambig)
 &rst
  ixpk= 677, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 162, 163, 164, 166, 167, 168, 622, 623, 624,
 &end
#
#    0 AMB  10-2:678     47 GLU  HN          5.50    (#    678:10  Single Ambig)
 &rst
  ixpk= 678, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1604,1605, 626, 627,
 &end
#
#    0 AMB  10-2:679     47 GLU  HN          5.50    (#    679:10  Single Ambig)
 &rst
  ixpk= 679, nxpk= 10, iat=  -1, 706, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 759, 760, 761,1601,1602,
 &end
#
#   46 ALA  HN           48 GLN  HN          5.50    (#    680:10  Unique         3.70, 4.49 A)
 &rst
  ixpk= 680, nxpk= 10, iat= 696, 721, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 GLU  HN           48 GLN  HN          4.50    (#    681:10  Unique         2.44, 2.80 A)
 &rst
  ixpk= 681, nxpk= 10, iat= 706, 721, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ALA  HN           48 GLN  HN          4.50    (#    682:10  Unique         2.30, 2.70 A)
 &rst
  ixpk= 682, nxpk= 10, iat= 738, 721, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLN  HE2-         48 GLN  HN          5.50    (#    684:10  Unique         2.28, 3.13 A)
 &rst
  ixpk= 684, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   45 SER  HA           48 GLN  HN          5.50    (#    685:10  Unique         4.94, 5.33 A)
 &rst
  ixpk= 685, nxpk= 10, iat= 687, 721, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 SER  HB+          48 GLN  HN          5.50    (#    686:10  Unique         2.61, 3.53 A)
 &rst
  ixpk= 686, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 689, 690,
 &end
#
#    0 AMB  10-2:687     48 GLN  HN          3.50    (#    687:10  Single Ambig)
 &rst
  ixpk= 687, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 689, 690, 723,
 &end
#
#   47 GLU  HA           48 GLN  HN          5.50    (#    688:10  Unique         3.43, 3.55 A)
 &rst
  ixpk= 688, nxpk= 10, iat= 708, 721, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:689     48 GLN  HN          3.50    (#    689:10  Single Ambig)
 &rst
  ixpk= 689, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 728, 729, 728, 729,
 &end
#
#   48 GLN  HB+          48 GLN  HN          3.50    (#    690:10  Unique         2.30, 3.07 A)
 &rst
  ixpk= 690, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 725, 726,
 &end
#
#   47 GLU  HB+          48 GLN  HN          4.50    (#    691:10  Unique         1.99, 2.98 A)
 &rst
  ixpk= 691, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 710, 711,
 &end
#
#   47 GLU  HB-          48 GLN  HN          4.50    (#    692:10  Unique         1.99, 2.98 A)
 &rst
  ixpk= 692, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 710, 711,
 &end
#
#    0 AMB  10-2:693     48 GLN  HN          4.50    (#    693:10  Single Ambig)
 &rst
  ixpk= 693, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 742, 743, 744, 700, 701, 702, 755, 756,
 &end
#
#    0 AMB  10-2:695     48 GLN  HN          5.50    (#    695:10  Single Ambig)
 &rst
  ixpk= 695, nxpk= 10, iat=  -1, 721, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 162, 163, 164, 166, 167, 168, 622, 623, 624,
 &end
#
#   46 ALA  HN           49 ALA  HN          5.50    (#    697:10  Unique         4.43, 4.75 A)
 &rst
  ixpk= 697, nxpk= 10, iat= 696, 738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:698     49 ALA  HN          5.50    (#    698:10  Single Ambig)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 685, 706,
 &end
#
#    0 AMB  10-2:699     49 ALA  HN          5.50    (#    699:10  Single Ambig)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 765, 786,
 &end
#
#   48 GLN  HN           49 ALA  HN          4.50    (#    701:10  Unique         2.30, 2.70 A)
 &rst
  ixpk= 701, nxpk= 10, iat= 721, 738, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLN  HE2-         49 ALA  HN          5.50    (#    703:10  Unique         3.35, 4.43 A)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 733, 734,
 &end
#
#   90 PRO  HA           91 VAL  HN          3.50    (#    704:10  Unique         2.15, 2.32 A)
 &rst
  ixpk= 704, nxpk= 10, iat=1481,1485, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   89 LYS  HA           91 VAL  HN          3.50    (#    705:10  Unique         2.21, 2.78 A)
 &rst
  ixpk= 705, nxpk= 10, iat=1451,1485, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HA           91 VAL  HN          5.50    (#    706:10  Unique         4.78, 5.06 A)
 &rst
  ixpk= 706, nxpk= 10, iat=1401,1485, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:707     49 ALA  HN          3.50    (#    707:10  Single Ambig)
 &rst
  ixpk= 707, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 740, 723, 689, 690,
 &end
#
#   91 VAL  HA           91 VAL  HN          3.50    (#    708:10  Unique         2.64, 2.77 A)
 &rst
  ixpk= 708, nxpk= 10, iat=1487,1485, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:709     91 VAL  HN          4.50    (#    709:10  Single Ambig)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1472,1473,1472,1473,
 &end
#
#   47 GLU  HA           49 ALA  HN          5.50    (#    710:10  Unique         3.94, 4.45 A)
 &rst
  ixpk= 710, nxpk= 10, iat= 708, 738, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:711     91 VAL  HN          5.50    (#    711:10  Single Ambig)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1462,1463,1462,1463,1403,1404,
 &end
#
#   92 CYS  HB+          91 VAL  HN          5.50    (#    712:10  Unique         3.68, 6.88 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1505,1506,
 &end
#
#    0 AMB  10-2:713     49 ALA  HN          4.50    (#    713:10  Single Ambig)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 728, 729, 728, 729,
 &end
#
#    0 AMB  10-2:714      0 AMB  10-1:714    2.80    (#    714:10  Double Ambig)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 725, 726,1478,1479,
 igr2= 738,1485,
 &end
#
#    0 AMB  10-2:715     49 ALA  HN          3.50    (#    715:10  Single Ambig)
 &rst
  ixpk= 715, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 677, 678, 674, 675,
 &end
#
#    0 AMB  10-2:716     91 VAL  HN          4.50    (#    716:10  Single Ambig)
 &rst
  ixpk= 716, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1478,1479,1475,1476,
 &end
#
#    0 AMB  10-2:717     91 VAL  HN          3.50    (#    717:10  Single Ambig)
 &rst
  ixpk= 717, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1489,1453,1454,
 &end
#
#   49 ALA  MB           49 ALA  HN          2.80    (#    718:10  Unique         2.21, 2.91 A)
 &rst
  ixpk= 718, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 742, 743, 744,
 &end
#
#   50 MET  HB-          49 ALA  HN          5.50    (#    719:10  Unique         4.24, 4.78 A)
 &rst
  ixpk= 719, nxpk= 10, iat=  -1, 738, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 752, 753,
 &end
#
#   91 VAL  MGY          91 VAL  HN          3.50    (#    720:10  Unique         1.96, 3.58 A)
 &rst
  ixpk= 720, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  10-2:721      0 AMB  10-1:721    5.50    (#    721:10  Double Ambig)
 &rst
  ixpk= 721, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1= 626, 627,  34,  35,  36,1365,1366,1367,1369,1370,
      1371,
 igr2= 738,1485,
 &end
#
#    0 AMB  10-2:723      0 AMB  10-1:723    5.50    (#    723:10  Double Ambig)
 &rst
  ixpk= 723, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.21, r4= 9.71,
 igr1= 162, 163, 164, 166, 167, 168,1525,1526,1527,1522,
      1523,
 igr2= 738,1485,
 &end
#
#   91 VAL  MGX          91 VAL  HN          3.50    (#    724:10  Unique         1.96, 3.58 A)
 &rst
  ixpk= 724, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  10-2:727     50 MET  HN          5.50    (#    727:10  Single Ambig)
 &rst
  ixpk= 727, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 706, 685,
 &end
#
#   51 TYR  HN           50 MET  HN          4.50    (#    728:10  Unique         2.43, 2.68 A)
 &rst
  ixpk= 728, nxpk= 10, iat= 765, 748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   48 GLN  HN           50 MET  HN          5.50    (#    729:10  Unique         3.35, 3.92 A)
 &rst
  ixpk= 729, nxpk= 10, iat= 721, 748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HD           50 MET  HN          4.50    (#    730:10  Unique         2.97, 5.22 A)
 &rst
  ixpk= 730, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 773, 782,
 &end
#
#   51 TYR  HE           50 MET  HN          5.50    (#    732:10  Unique         4.03, 5.98 A)
 &rst
  ixpk= 732, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#    0 AMB  10-2:733     50 MET  HN          4.50    (#    733:10  Single Ambig)
 &rst
  ixpk= 733, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 740, 723,
 &end
#
#   50 MET  HA           50 MET  HN          4.50    (#    734:10  Unique         2.77, 2.80 A)
 &rst
  ixpk= 734, nxpk= 10, iat= 750, 748, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   47 GLU  HA           50 MET  HN          5.50    (#    735:10  Unique         3.23, 3.52 A)
 &rst
  ixpk= 735, nxpk= 10, iat= 708, 748, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:736     50 MET  HN          5.50    (#    736:10  Single Ambig)
 &rst
  ixpk= 736, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 769, 770,1644,1645,1644,1645,
 &end
#
#    0 AMB  10-2:737     50 MET  HN          5.50    (#    737:10  Single Ambig)
 &rst
  ixpk= 737, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 713, 714, 677, 678, 710, 711, 674, 675,
 &end
#
#   47 GLU  HG-          50 MET  HN          5.50    (#    738:10  Unique         4.76, 5.41 A)
 &rst
  ixpk= 738, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 713, 714,
 &end
#
#    0 AMB  10-2:739     50 MET  HN          5.50    (#    739:10  Single Ambig)
 &rst
  ixpk= 739, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 160, 710, 711,
 &end
#
#   50 MET  HB+          50 MET  HN          3.50    (#    740:10  Unique         2.09, 2.55 A)
 &rst
  ixpk= 740, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 752, 753,
 &end
#
#    0 AMB  10-2:741     50 MET  HN          2.80    (#    741:10  Single Ambig)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 742, 743, 744, 755, 756,
 &end
#
#   50 MET  HB-          50 MET  HN          4.50    (#    742:10  Unique         2.09, 2.55 A)
 &rst
  ixpk= 742, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          50 MET  HN          4.50    (#    743:10  Unique         2.83, 4.61 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   11 VAL  MGX          50 MET  HN          3.50    (#    744:10  Unique         2.83, 4.61 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  10-2:745     50 MET  HN          5.50    (#    745:10  Single Ambig)
 &rst
  ixpk= 745, nxpk= 10, iat=  -1, 748, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 626, 627,1604,1605,1053,1054,1055,
 &end
#
#   54 LEU  HN           51 TYR  HN          5.50    (#    746:10  Unique         4.75, 4.87 A)
 &rst
  ixpk= 746, nxpk= 10, iat= 820, 765, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   50 MET  HN           51 TYR  HN          4.50    (#    748:10  Unique         2.43, 2.68 A)
 &rst
  ixpk= 748, nxpk= 10, iat= 748, 765, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:749     51 TYR  HN          5.50    (#    749:10  Single Ambig)
 &rst
  ixpk= 749, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 721, 839,
 &end
#
#   51 TYR  HD           51 TYR  HN          3.50    (#    750:10  Unique         1.84, 3.30 A)
 &rst
  ixpk= 750, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 773, 782,
 &end
#
#   51 TYR  HE           51 TYR  HN          5.50    (#    751:10  Unique         3.91, 4.93 A)
 &rst
  ixpk= 751, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   52 ARG  HA           51 TYR  HN          5.50    (#    752:10  Unique         4.64, 4.74 A)
 &rst
  ixpk= 752, nxpk= 10, iat= 788, 765, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:753     51 TYR  HN          3.50    (#    753:10  Single Ambig)
 &rst
  ixpk= 753, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 767, 723, 740,
 &end
#
#   50 MET  HA           51 TYR  HN          5.50    (#    754:10  Unique         3.46, 3.51 A)
 &rst
  ixpk= 754, nxpk= 10, iat= 750, 765, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   47 GLU  HA           51 TYR  HN          5.50    (#    755:10  Unique         4.79, 5.10 A)
 &rst
  ixpk= 755, nxpk= 10, iat= 708, 765, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HB+          51 TYR  HN          4.50    (#    756:10  Unique         2.54, 3.15 A)
 &rst
  ixpk= 756, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB-          51 TYR  HN          4.50    (#    757:10  Unique         2.54, 3.15 A)
 &rst
  ixpk= 757, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 769, 770,
 &end
#
#    0 AMB  10-2:758     51 TYR  HN          5.50    (#    758:10  Single Ambig)
 &rst
  ixpk= 758, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 728, 729, 728, 729,
 &end
#
#    0 AMB  10-2:760     51 TYR  HN          5.50    (#    760:10  Single Ambig)
 &rst
  ixpk= 760, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 713, 714, 677, 678, 674, 675, 674, 675,
 &end
#
#    0 AMB  10-2:761     51 TYR  HN          5.50    (#    761:10  Single Ambig)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 790, 791, 824, 825,
 &end
#
#    0 AMB  10-2:762     51 TYR  HN          4.50    (#    762:10  Single Ambig)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 742, 743, 744, 827, 793, 794,
 &end
#
#   50 MET  HB-          51 TYR  HN          4.50    (#    764:10  Unique         2.54, 3.35 A)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 752, 753,
 &end
#
#   11 VAL  MGY          51 TYR  HN          5.50    (#    765:10  Unique         4.42, 5.91 A)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#   54 LEU  MDX          51 TYR  HN          4.50    (#    766:10  Unique         4.50, 6.99 A)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  10-2:767     51 TYR  HN          3.50    (#    767:10  Single Ambig)
 &rst
  ixpk= 767, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 759, 760, 761, 192, 193, 194, 162, 163, 164, 166,
       167, 168,
 &end
#
#   52 ARG  HE           52 ARG  HN          5.50    (#    768:10  Unique         2.94, 3.26 A)
 &rst
  ixpk= 768, nxpk= 10, iat= 799, 786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 LEU  HN           52 ARG  HN          5.50    (#    769:10  Unique         3.73, 3.85 A)
 &rst
  ixpk= 769, nxpk= 10, iat= 820, 786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:770     52 ARG  HN          4.50    (#    770:10  Single Ambig)
 &rst
  ixpk= 770, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 810, 748,
 &end
#
#    0 AMB  10-2:771     52 ARG  HN          5.50    (#    771:10  Single Ambig)
 &rst
  ixpk= 771, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 839, 721,
 &end
#
#    0 AMB  10-2:772     52 ARG  HN          4.50    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 773, 782, 847, 855,
 &end
#
#   62 ARG  HE           52 ARG  HN          5.50    (#    773:10  Unique         4.70, 5.27 A)
 &rst
  ixpk= 773, nxpk= 10, iat= 955, 786, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 ARG  HA           52 ARG  HN          4.50    (#    775:10  Unique         2.70, 2.74 A)
 &rst
  ixpk= 775, nxpk= 10, iat= 788, 786, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:776     52 ARG  HN          3.50    (#    776:10  Single Ambig)
 &rst
  ixpk= 776, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 740, 767,
 &end
#
#    0 AMB  10-2:777     52 ARG  HN          5.50    (#    777:10  Single Ambig)
 &rst
  ixpk= 777, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 750, 796, 797,
 &end
#
#    0 AMB  10-2:778     52 ARG  HN          5.50    (#    778:10  Single Ambig)
 &rst
  ixpk= 778, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 796, 797, 843, 844,
 &end
#
#   51 TYR  HB+          52 ARG  HN          4.50    (#    779:10  Unique         3.12, 3.80 A)
 &rst
  ixpk= 779, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 769, 770,
 &end
#
#   51 TYR  HB-          52 ARG  HN          5.50    (#    780:10  Unique         3.12, 3.80 A)
 &rst
  ixpk= 780, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 769, 770,
 &end
#
#    0 AMB  10-2:782     52 ARG  HN          5.50    (#    782:10  Single Ambig)
 &rst
  ixpk= 782, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 677, 678, 674, 675, 674, 675, 863, 864, 713, 714,
      
 &end
#
#   52 ARG  HB-          52 ARG  HN          3.50    (#    783:10  Unique         2.15, 2.56 A)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 790, 791,
 &end
#
#   52 ARG  HB+          52 ARG  HN          3.50    (#    784:10  Unique         2.15, 2.56 A)
 &rst
  ixpk= 784, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 790, 791,
 &end
#
#    0 AMB  10-2:785     52 ARG  HN          4.50    (#    785:10  Single Ambig)
 &rst
  ixpk= 785, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 793, 794, 742, 743, 744,
 &end
#
#    0 AMB  10-2:786     52 ARG  HN          4.50    (#    786:10  Single Ambig)
 &rst
  ixpk= 786, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 752, 753, 814, 815, 816, 189, 190, 949, 950,
 &end
#
#   54 LEU  MDX          52 ARG  HN          5.50    (#    787:10  Unique         5.24, 7.44 A)
 &rst
  ixpk= 787, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  10-2:788     52 ARG  HN          5.50    (#    788:10  Single Ambig)
 &rst
  ixpk= 788, nxpk= 10, iat=  -1, 786, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 162, 163, 164, 166, 167, 168, 192, 193, 194,
 &end
#
#   54 LEU  HN           53 ALA  HN          4.50    (#    790:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 790, nxpk= 10, iat= 820, 810, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 ARG  HN           53 ALA  HN          4.50    (#    791:10  Unique         2.75, 2.87 A)
 &rst
  ixpk= 791, nxpk= 10, iat= 786, 810, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HN           53 ALA  HN          5.50    (#    792:10  Unique         4.17, 4.59 A)
 &rst
  ixpk= 792, nxpk= 10, iat= 839, 810, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:793     53 ALA  HN          5.50    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 847, 855, 773, 782,
 &end
#
#   52 ARG  HA           53 ALA  HN          5.50    (#    795:10  Unique         3.48, 3.52 A)
 &rst
  ixpk= 795, nxpk= 10, iat= 788, 810, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:796     53 ALA  HN          3.50    (#    796:10  Single Ambig)
 &rst
  ixpk= 796, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 812, 767,
 &end
#
#    0 AMB  10-2:797     53 ALA  HN          5.50    (#    797:10  Single Ambig)
 &rst
  ixpk= 797, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 750, 796, 797, 843, 844,
 &end
#
#    0 AMB  10-2:798     53 ALA  HN          5.50    (#    798:10  Single Ambig)
 &rst
  ixpk= 798, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 796, 797, 843, 844,
 &end
#
#   57 GLU  HG-          53 ALA  HN          5.50    (#    799:10  Unique         5.03, 6.10 A)
 &rst
  ixpk= 799, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#    0 AMB  10-2:800     53 ALA  HN          5.50    (#    800:10  Single Ambig)
 &rst
  ixpk= 800, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 863, 864, 878, 879, 677, 678,
 &end
#
#   52 ARG  HB+          53 ALA  HN          4.50    (#    801:10  Unique         2.24, 3.16 A)
 &rst
  ixpk= 801, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 790, 791,
 &end
#
#   52 ARG  HB-          53 ALA  HN          4.50    (#    802:10  Unique         2.24, 3.16 A)
 &rst
  ixpk= 802, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 790, 791,
 &end
#
#    0 AMB  10-2:803     53 ALA  HN          3.50    (#    803:10  Single Ambig)
 &rst
  ixpk= 803, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 4.84, r4= 5.34,
 igr1= 793, 794, 755, 756, 742, 743, 744,
 &end
#
#   53 ALA  MB           53 ALA  HN          2.80    (#    804:10  Unique         2.08, 2.99 A)
 &rst
  ixpk= 804, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 814, 815, 816,
 &end
#
#   54 LEU  MDX          53 ALA  HN          5.50    (#    805:10  Unique         4.38, 6.78 A)
 &rst
  ixpk= 805, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  10-2:806     53 ALA  HN          4.50    (#    806:10  Single Ambig)
 &rst
  ixpk= 806, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1= 192, 193, 194, 162, 163, 164, 166, 167, 168, 189,
       190,
 &end
#
#   53 ALA  HN           54 LEU  HN          4.50    (#    807:10  Unique         2.15, 2.22 A)
 &rst
  ixpk= 807, nxpk= 10, iat= 810, 820, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:808     54 LEU  HN          5.50    (#    808:10  Single Ambig)
 &rst
  ixpk= 808, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 786, 765,
 &end
#
#   55 PHE  HN           54 LEU  HN          4.50    (#    809:10  Unique         2.60, 2.89 A)
 &rst
  ixpk= 809, nxpk= 10, iat= 839, 820, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HD           54 LEU  HN          5.50    (#    810:10  Unique         3.70, 5.49 A)
 &rst
  ixpk= 810, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#    0 AMB  10-2:812     54 LEU  HN          4.50    (#    812:10  Single Ambig)
 &rst
  ixpk= 812, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 767, 812,
 &end
#
#   54 LEU  HA           54 LEU  HN          4.50    (#    813:10  Unique         2.72, 2.77 A)
 &rst
  ixpk= 813, nxpk= 10, iat= 822, 820, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:814     54 LEU  HN          5.50    (#    814:10  Single Ambig)
 &rst
  ixpk= 814, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 843, 844, 750,
 &end
#
#    0 AMB  10-2:815     54 LEU  HN          5.50    (#    815:10  Single Ambig)
 &rst
  ixpk= 815, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 843, 844, 796, 797,
 &end
#
#    0 AMB  10-2:816     54 LEU  HN          5.50    (#    816:10  Single Ambig)
 &rst
  ixpk= 816, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 866, 867, 952, 953, 952, 953,
 &end
#
#   57 GLU  HB+          54 LEU  HN          5.50    (#    817:10  Unique         4.28, 5.58 A)
 &rst
  ixpk= 817, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 878, 879,
 &end
#
#   54 LEU  HB+          54 LEU  HN          3.50    (#    818:10  Unique         2.04, 2.55 A)
 &rst
  ixpk= 818, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 824, 825,
 &end
#
#    0 AMB  10-2:819     54 LEU  HN          5.50    (#    819:10  Single Ambig)
 &rst
  ixpk= 819, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 755, 756, 793, 794,1943,1944,
 &end
#
#    0 AMB  10-2:820     54 LEU  HN          3.50    (#    820:10  Single Ambig)
 &rst
  ixpk= 820, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 189, 190, 814, 815, 816,
 &end
#
#    0 AMB  10-2:821     54 LEU  HN          3.50    (#    821:10  Single Ambig)
 &rst
  ixpk= 821, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 829, 830, 831, 833, 834, 835, 185, 186, 187,
 &end
#
#    0 AMB  10-2:822     54 LEU  HN          3.50    (#    822:10  Single Ambig)
 &rst
  ixpk= 822, nxpk= 10, iat=  -1, 820, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 192, 193, 194, 189, 190,
 &end
#
#   53 ALA  HN           55 PHE  HN          5.50    (#    824:10  Unique         4.17, 4.59 A)
 &rst
  ixpk= 824, nxpk= 10, iat= 810, 839, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HN           55 PHE  HN          5.50    (#    825:10  Unique         4.30, 4.70 A)
 &rst
  ixpk= 825, nxpk= 10, iat= 905, 839, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HD           55 PHE  HN          4.50    (#    828:10  Unique         2.09, 3.39 A)
 &rst
  ixpk= 828, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 847, 855,
 &end
#
#   60 LEU  HN           55 PHE  HN          5.50    (#    829:10  Unique         4.27, 4.58 A)
 &rst
  ixpk= 829, nxpk= 10, iat= 912, 839, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HA           55 PHE  HN          5.50    (#    830:10  Unique         2.92, 3.97 A)
 &rst
  ixpk= 830, nxpk= 10, iat= 933, 839, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HA           55 PHE  HN          3.50    (#    831:10  Unique         2.77, 2.83 A)
 &rst
  ixpk= 831, nxpk= 10, iat= 841, 839, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:832     55 PHE  HN          5.50    (#    832:10  Single Ambig)
 &rst
  ixpk= 832, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 812, 767,
 &end
#
#   56 GLU  HA           55 PHE  HN          5.50    (#    833:10  Unique         4.97, 5.21 A)
 &rst
  ixpk= 833, nxpk= 10, iat= 861, 839, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 LEU  HA           55 PHE  HN          4.50    (#    834:10  Unique         3.47, 3.54 A)
 &rst
  ixpk= 834, nxpk= 10, iat= 822, 839, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HB+          55 PHE  HN          3.50    (#    835:10  Unique         2.07, 3.09 A)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 843, 844,
 &end
#
#   55 PHE  HB-          55 PHE  HN          3.50    (#    836:10  Unique         2.07, 3.09 A)
 &rst
  ixpk= 836, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 843, 844,
 &end
#
#   57 GLU  HG+          55 PHE  HN          5.50    (#    837:10  Unique         4.11, 6.21 A)
 &rst
  ixpk= 837, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   56 GLU  HG+          55 PHE  HN          5.50    (#    838:10  Unique         3.47, 4.82 A)
 &rst
  ixpk= 838, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 866, 867,
 &end
#
#    0 AMB  10-2:839     55 PHE  HN          5.50    (#    839:10  Single Ambig)
 &rst
  ixpk= 839, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 866, 867, 881, 882,
 &end
#
#    0 AMB  10-2:840     55 PHE  HN          5.50    (#    840:10  Single Ambig)
 &rst
  ixpk= 840, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 863, 864, 878, 879,
 &end
#
#   54 LEU  HB+          55 PHE  HN          4.50    (#    841:10  Unique         1.96, 3.00 A)
 &rst
  ixpk= 841, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#   54 LEU  HB-          55 PHE  HN          4.50    (#    842:10  Unique         1.96, 3.00 A)
 &rst
  ixpk= 842, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 824, 825,
 &end
#
#   54 LEU  HG           55 PHE  HN          4.50    (#    843:10  Unique         3.05, 4.14 A)
 &rst
  ixpk= 843, nxpk= 10, iat= 827, 839, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:844     55 PHE  HN          5.50    (#    844:10  Single Ambig)
 &rst
  ixpk= 844, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 189, 190, 814, 815, 816, 949, 950,
 &end
#
#    0 AMB  10-2:845     55 PHE  HN          4.50    (#    845:10  Single Ambig)
 &rst
  ixpk= 845, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 7.22, r4= 7.72,
 igr1= 189, 190, 192, 193, 194, 921, 922, 923, 925, 926,
       927, 921, 922, 923, 925, 926, 927,
 &end
#
#   54 LEU  MDX          55 PHE  HN          3.50    (#    846:10  Unique         2.09, 5.19 A)
 &rst
  ixpk= 846, nxpk= 10, iat=  -1, 839, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 829, 830, 831, 833, 834, 835,
 &end
#
#   53 ALA  HN           56 GLU  HN          5.50    (#    847:10  Unique         4.86, 5.09 A)
 &rst
  ixpk= 847, nxpk= 10, iat= 810, 859, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HN           56 GLU  HN          4.50    (#    849:10  Unique         2.31, 2.60 A)
 &rst
  ixpk= 849, nxpk= 10, iat= 839, 859, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 GLY  HN           56 GLU  HN          5.50    (#    850:10  Unique         3.91, 4.21 A)
 &rst
  ixpk= 850, nxpk= 10, iat= 905, 859, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HD           56 GLU  HN          4.50    (#    852:10  Unique         2.21, 4.19 A)
 &rst
  ixpk= 852, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 847, 855,
 &end
#
#   60 LEU  HN           56 GLU  HN          5.50    (#    853:10  Unique         4.97, 5.40 A)
 &rst
  ixpk= 853, nxpk= 10, iat= 912, 859, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:854     56 GLU  HN          5.50    (#    854:10  Single Ambig)
 &rst
  ixpk= 854, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 876, 914,1857,
 &end
#
#   55 PHE  HA           56 GLU  HN          4.50    (#    855:10  Unique         3.35, 3.45 A)
 &rst
  ixpk= 855, nxpk= 10, iat= 841, 859, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 ALA  HA           56 GLU  HN          4.50    (#    856:10  Unique         2.87, 3.19 A)
 &rst
  ixpk= 856, nxpk= 10, iat= 812, 859, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:857     56 GLU  HN          5.50    (#    857:10  Single Ambig)
 &rst
  ixpk= 857, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1890,1891,1938,
 &end
#
#   56 GLU  HA           56 GLU  HN          4.50    (#    858:10  Unique         2.85, 2.90 A)
 &rst
  ixpk= 858, nxpk= 10, iat= 861, 859, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 GLY  HA-          56 GLU  HN          5.50    (#    859:10  Unique         4.56, 5.54 A)
 &rst
  ixpk= 859, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#   55 PHE  HB+          56 GLU  HN          4.50    (#    860:10  Unique         2.41, 3.78 A)
 &rst
  ixpk= 860, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 843, 844,
 &end
#
#   55 PHE  HB-          56 GLU  HN          4.50    (#    861:10  Unique         2.41, 3.78 A)
 &rst
  ixpk= 861, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 843, 844,
 &end
#
#   57 GLU  HG+          56 GLU  HN          5.50    (#    862:10  Unique         3.26, 4.95 A)
 &rst
  ixpk= 862, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   56 GLU  HG+          56 GLU  HN          3.50    (#    863:10  Unique         1.96, 2.98 A)
 &rst
  ixpk= 863, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 866, 867,
 &end
#
#   56 GLU  HG-          56 GLU  HN          3.50    (#    864:10  Unique         1.96, 2.98 A)
 &rst
  ixpk= 864, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 866, 867,
 &end
#
#   56 GLU  HB+          56 GLU  HN          3.50    (#    865:10  Unique         2.20, 3.09 A)
 &rst
  ixpk= 865, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 863, 864,
 &end
#
#   56 GLU  HB-          56 GLU  HN          3.50    (#    866:10  Unique         2.20, 3.09 A)
 &rst
  ixpk= 866, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 863, 864,
 &end
#
#    0 AMB  10-2:867     56 GLU  HN          5.50    (#    867:10  Single Ambig)
 &rst
  ixpk= 867, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 827,1926,1927, 793, 794, 793, 794,
 &end
#
#    0 AMB  10-2:869     56 GLU  HN          5.50    (#    869:10  Single Ambig)
 &rst
  ixpk= 869, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 814, 815, 816, 189, 190,
 &end
#
#    0 AMB  10-2:870     56 GLU  HN          5.50    (#    870:10  Single Ambig)
 &rst
  ixpk= 870, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,
 &end
#
#    0 AMB  10-2:871     56 GLU  HN          5.50    (#    871:10  Single Ambig)
 &rst
  ixpk= 871, nxpk= 10, iat=  -1, 859, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 189, 190, 192, 193, 194, 921, 922, 923, 925, 926,
       927,
 &end
#
#   55 PHE  HN           57 GLU  HN          5.50    (#    873:10  Unique         3.62, 3.91 A)
 &rst
  ixpk= 873, nxpk= 10, iat= 839, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HN           57 GLU  HN          5.50    (#    874:10  Unique         2.76, 3.03 A)
 &rst
  ixpk= 874, nxpk= 10, iat= 905, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   58 VAL  HN           57 GLU  HN          4.50    (#    875:10  Unique         2.03, 2.30 A)
 &rst
  ixpk= 875, nxpk= 10, iat= 889, 874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HD           57 GLU  HN          5.50    (#    876:10  Unique         4.59, 5.87 A)
 &rst
  ixpk= 876, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   57 GLU  HA           57 GLU  HN          4.50    (#    877:10  Unique         2.87, 2.93 A)
 &rst
  ixpk= 877, nxpk= 10, iat= 876, 874, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:878     57 GLU  HN          5.50    (#    878:10  Single Ambig)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 841,1840,
 &end
#
#   53 ALA  HA           57 GLU  HN          5.50    (#    879:10  Unique         4.23, 4.45 A)
 &rst
  ixpk= 879, nxpk= 10, iat= 812, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 GLU  HA           57 GLU  HN          5.50    (#    880:10  Unique         3.29, 3.32 A)
 &rst
  ixpk= 880, nxpk= 10, iat= 861, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HB-          57 GLU  HN          5.50    (#    881:10  Unique         4.49, 5.26 A)
 &rst
  ixpk= 881, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 843, 844,
 &end
#
#   57 GLU  HG+          57 GLU  HN          4.50    (#    882:10  Unique         1.97, 3.53 A)
 &rst
  ixpk= 882, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 881, 882,
 &end
#
#   56 GLU  HG+          57 GLU  HN          5.50    (#    883:10  Unique         2.92, 4.76 A)
 &rst
  ixpk= 883, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 866, 867,
 &end
#
#   57 GLU  HG-          57 GLU  HN          4.50    (#    884:10  Unique         1.97, 3.53 A)
 &rst
  ixpk= 884, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 881, 882,
 &end
#
#   57 GLU  HB+          57 GLU  HN          3.50    (#    885:10  Unique         2.13, 2.99 A)
 &rst
  ixpk= 885, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 878, 879,
 &end
#
#   56 GLU  HB-          57 GLU  HN          4.50    (#    886:10  Unique         3.20, 3.85 A)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 863, 864,
 &end
#
#    0 AMB  10-2:888     57 GLU  HN          5.50    (#    888:10  Single Ambig)
 &rst
  ixpk= 888, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1943,1944, 183, 793, 794,
 &end
#
#    0 AMB  10-2:889     57 GLU  HN          5.50    (#    889:10  Single Ambig)
 &rst
  ixpk= 889, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 814, 815, 816, 189, 190,
 &end
#
#    0 AMB  10-2:890     57 GLU  HN          4.50    (#    890:10  Single Ambig)
 &rst
  ixpk= 890, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901, 829, 830, 831, 833, 834, 835,
 &end
#
#    0 AMB  10-2:891     57 GLU  HN          5.50    (#    891:10  Single Ambig)
 &rst
  ixpk= 891, nxpk= 10, iat=  -1, 874, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 189, 190, 192, 193, 194, 921, 922, 923, 925, 926,
       927,
 &end
#
#   57 GLU  HN           58 VAL  HN          4.50    (#    892:10  Unique         2.03, 2.30 A)
 &rst
  ixpk= 892, nxpk= 10, iat= 874, 889, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HA           58 VAL  HN          5.50    (#    895:10  Unique         3.51, 3.56 A)
 &rst
  ixpk= 895, nxpk= 10, iat= 876, 889, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 SER  HA           21 GLN  HE2+        4.50    (#    896:10  Unique         1.91, 4.23 A)
 &rst
  ixpk= 896, nxpk= 10, iat=2080,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#    0 AMB  10-2:897      0 AMB  10-1:897    5.50    (#    897:10  Double Ambig)
 &rst
  ixpk= 897, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 907, 908, 260,
 igr2= 889, 318, 319,
 &end
#
#   59 GLY  HA-          58 VAL  HN          5.50    (#    898:10  Unique         4.00, 4.36 A)
 &rst
  ixpk= 898, nxpk= 10, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#   57 GLU  HG+          58 VAL  HN          5.50    (#    899:10  Unique         1.95, 4.47 A)
 &rst
  ixpk= 899, nxpk= 10, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#   57 GLU  HG-          58 VAL  HN          5.50    (#    900:10  Unique         1.95, 4.47 A)
 &rst
  ixpk= 900, nxpk= 10, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#    0 AMB  10-2:901      0 AMB  10-1:901    3.50    (#    901:10  Double Ambig)
 &rst
  ixpk= 901, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 289, 290, 893,
 igr2= 318, 319, 889,
 &end
#
#    0 AMB  10-2:902      0 AMB  10-1:902    5.50    (#    902:10  Double Ambig)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 248, 249, 824, 825, 183,
 igr2= 318, 319, 889,
 &end
#
#    0 AMB  10-2:903     58 VAL  HN          3.50    (#    903:10  Single Ambig)
 &rst
  ixpk= 903, nxpk= 10, iat=  -1, 889, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#    0 AMB  10-2:905     59 GLY  HN          5.50    (#    905:10  Single Ambig)
 &rst
  ixpk= 905, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  10-2:906     59 GLY  HN          3.50    (#    906:10  Single Ambig)
 &rst
  ixpk= 906, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#    0 AMB  10-2:907     59 GLY  HN          5.50    (#    907:10  Single Ambig)
 &rst
  ixpk= 907, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 824, 825, 183,
 &end
#
#   58 VAL  HB           59 GLY  HN          5.50    (#    908:10  Unique         3.52, 4.06 A)
 &rst
  ixpk= 908, nxpk= 10, iat= 893, 905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HG+          59 GLY  HN          5.50    (#    909:10  Unique         3.60, 6.01 A)
 &rst
  ixpk= 909, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 881, 882,
 &end
#
#    0 AMB  10-2:910     59 GLY  HN          5.50    (#    910:10  Single Ambig)
 &rst
  ixpk= 910, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1828,1829,1828,1829,
 &end
#
#   59 GLY  HA-          59 GLY  HN          4.50    (#    911:10  Unique         2.29, 2.61 A)
 &rst
  ixpk= 911, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 907, 908,
 &end
#
#   59 GLY  HA+          59 GLY  HN          4.50    (#    912:10  Unique         2.29, 2.61 A)
 &rst
  ixpk= 912, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 907, 908,
 &end
#
#   60 LEU  HN           59 GLY  HN          5.50    (#    914:10  Unique         2.01, 2.49 A)
 &rst
  ixpk= 914, nxpk= 10, iat= 912, 905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   55 PHE  HD           59 GLY  HN          5.50    (#    915:10  Unique         5.04, 6.05 A)
 &rst
  ixpk= 915, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   58 VAL  HN           59 GLY  HN          4.50    (#    916:10  Unique         1.82, 1.90 A)
 &rst
  ixpk= 916, nxpk= 10, iat= 889, 905, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:917     59 GLY  HN          5.50    (#    917:10  Single Ambig)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1, 905, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1824,1855,
 &end
#
#   57 GLU  HN           59 GLY  HN          5.50    (#    918:10  Unique         2.76, 3.03 A)
 &rst
  ixpk= 918, nxpk= 10, iat= 874, 905, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:919     60 LEU  HN          3.50    (#    919:10  Single Ambig)
 &rst
  ixpk= 919, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  10-2:920     60 LEU  HN          3.50    (#    920:10  Single Ambig)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,
 &end
#
#   60 LEU  HB-          60 LEU  HN          5.50    (#    921:10  Unique         2.30, 3.19 A)
 &rst
  ixpk= 921, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 916, 917,
 &end
#
#   54 LEU  HG           60 LEU  HN          4.50    (#    922:10  Unique         2.70, 4.10 A)
 &rst
  ixpk= 922, nxpk= 10, iat= 827, 912, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 LEU  HG           60 LEU  HN          3.50    (#    923:10  Unique         2.00, 2.65 A)
 &rst
  ixpk= 923, nxpk= 10, iat= 919, 912, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 LEU  HB+          60 LEU  HN          5.50    (#    924:10  Unique         3.83, 5.21 A)
 &rst
  ixpk= 924, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 824, 825,
 &end
#
#   58 VAL  HB           60 LEU  HN          5.50    (#    925:10  Unique         3.16, 4.22 A)
 &rst
  ixpk= 925, nxpk= 10, iat= 893, 912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:926     60 LEU  HN          5.50    (#    926:10  Single Ambig)
 &rst
  ixpk= 926, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1828,1829, 769, 770, 866, 867,
 &end
#
#    0 AMB  10-2:927     60 LEU  HN          5.50    (#    927:10  Single Ambig)
 &rst
  ixpk= 927, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 992, 993, 992, 993,
 &end
#
#   55 PHE  HB-          60 LEU  HN          5.50    (#    928:10  Unique         3.66, 4.76 A)
 &rst
  ixpk= 928, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 843, 844,
 &end
#
#   55 PHE  HB+          60 LEU  HN          5.50    (#    929:10  Unique         3.66, 4.76 A)
 &rst
  ixpk= 929, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 843, 844,
 &end
#
#   59 GLY  HA-          60 LEU  HN          5.50    (#    930:10  Unique         2.52, 3.22 A)
 &rst
  ixpk= 930, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#   59 GLY  HA+          60 LEU  HN          5.50    (#    931:10  Unique         2.52, 3.22 A)
 &rst
  ixpk= 931, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#   55 PHE  HA           60 LEU  HN          4.50    (#    932:10  Unique         1.97, 2.51 A)
 &rst
  ixpk= 932, nxpk= 10, iat= 841, 912, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 LEU  HA           60 LEU  HN          4.50    (#    933:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 933, nxpk= 10, iat= 914, 912, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HD           60 LEU  HN          5.50    (#    934:10  Unique         3.49, 5.92 A)
 &rst
  ixpk= 934, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 847, 855,
 &end
#
#   59 GLY  HN           60 LEU  HN          4.50    (#    936:10  Unique         2.01, 2.49 A)
 &rst
  ixpk= 936, nxpk= 10, iat= 905, 912, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HN           60 LEU  HN          5.50    (#    937:10  Unique         4.27, 4.58 A)
 &rst
  ixpk= 937, nxpk= 10, iat= 839, 912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:938     60 LEU  HN          5.50    (#    938:10  Single Ambig)
 &rst
  ixpk= 938, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1824,1855,
 &end
#
#    0 AMB  10-2:939     60 LEU  HN          5.50    (#    939:10  Single Ambig)
 &rst
  ixpk= 939, nxpk= 10, iat=  -1, 912, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 874, 859,
 &end
#
#   61 SER  HN           60 LEU  HN          5.50    (#    940:10  Unique         1.99, 3.57 A)
 &rst
  ixpk= 940, nxpk= 10, iat= 931, 912, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HN           61 SER  HN          5.50    (#    941:10  Unique         4.28, 4.43 A)
 &rst
  ixpk= 941, nxpk= 10, iat= 942, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASP  HN           61 SER  HN          5.50    (#    942:10  Unique         2.79, 3.77 A)
 &rst
  ixpk= 942, nxpk= 10, iat= 988, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 LEU  HN           61 SER  HN          5.50    (#    946:10  Unique         1.99, 3.57 A)
 &rst
  ixpk= 946, nxpk= 10, iat= 912, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   60 LEU  HA           61 SER  HN          3.50    (#    947:10  Unique         2.28, 2.97 A)
 &rst
  ixpk= 947, nxpk= 10, iat= 914, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HA           61 SER  HN          4.50    (#    948:10  Unique         2.28, 2.64 A)
 &rst
  ixpk= 948, nxpk= 10, iat= 933, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   55 PHE  HA           61 SER  HN          5.50    (#    949:10  Unique         2.91, 4.50 A)
 &rst
  ixpk= 949, nxpk= 10, iat= 841, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:951     61 SER  HN          4.50    (#    951:10  Single Ambig)
 &rst
  ixpk= 951, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 992, 993, 992, 993,
 &end
#
#   54 LEU  HG           61 SER  HN          5.50    (#    953:10  Unique         1.73, 3.08 A)
 &rst
  ixpk= 953, nxpk= 10, iat= 827, 931, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 LYS  HG+          61 SER  HN          4.50    (#    954:10  Unique         2.91, 5.16 A)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 973, 974,
 &end
#
#   60 LEU  HB+          61 SER  HN          3.50    (#    955:10  Unique         1.85, 2.75 A)
 &rst
  ixpk= 955, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 916, 917,
 &end
#
#   65 VAL  MGX          61 SER  HN          4.50    (#    956:10  Unique         2.48, 4.77 A)
 &rst
  ixpk= 956, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  10-2:957     61 SER  HN          3.50    (#    957:10  Single Ambig)
 &rst
  ixpk= 957, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  10-2:958     61 SER  HN          3.50    (#    958:10  Single Ambig)
 &rst
  ixpk= 958, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 829, 830, 831, 833, 834, 835, 895, 896, 897, 899,
       900, 901, 895, 896, 897, 899, 900, 901,
 &end
#
#   61 SER  HN           63 LYS  HN          5.50    (#    959:10  Unique         3.48, 4.17 A)
 &rst
  ixpk= 959, nxpk= 10, iat= 931, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HN           63 LYS  HN          4.50    (#    960:10  Unique         2.58, 2.67 A)
 &rst
  ixpk= 960, nxpk= 10, iat= 942, 966, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HN           63 LYS  HN          5.50    (#    961:10  Unique         3.56, 4.28 A)
 &rst
  ixpk= 961, nxpk= 10, iat=1000, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HE           63 LYS  HN          5.50    (#    963:10  Unique         5.32, 6.92 A)
 &rst
  ixpk= 963, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   61 SER  HA           63 LYS  HN          5.50    (#    964:10  Unique         3.90, 4.06 A)
 &rst
  ixpk= 964, nxpk= 10, iat= 933, 966, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   63 LYS  HA           63 LYS  HN          3.50    (#    965:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 965, nxpk= 10, iat= 968, 966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ARG  HA           63 LYS  HN          4.50    (#    967:10  Unique         3.21, 3.33 A)
 &rst
  ixpk= 967, nxpk= 10, iat= 944, 966, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:968     63 LYS  HN          5.50    (#    968:10  Single Ambig)
 &rst
  ixpk= 968, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 992, 993, 992, 993, 769, 770,
 &end
#
#    0 AMB  10-2:969     63 LYS  HN          5.50    (#    969:10  Single Ambig)
 &rst
  ixpk= 969, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 952, 953, 952, 953,
 &end
#
#   63 LYS  HB+          63 LYS  HN          3.50    (#    970:10  Unique         2.14, 3.08 A)
 &rst
  ixpk= 970, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 970, 971,
 &end
#
#    0 AMB  10-2:971     63 LYS  HN          5.50    (#    971:10  Single Ambig)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 827,1683,1684,
 &end
#
#   62 ARG  HB+          63 LYS  HN          4.50    (#    972:10  Unique         3.41, 4.20 A)
 &rst
  ixpk= 972, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 946, 947,
 &end
#
#    0 AMB  10-2:973     63 LYS  HN          2.80    (#    973:10  Single Ambig)
 &rst
  ixpk= 973, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 973, 974, 973, 974,
 &end
#
#    0 AMB  10-2:974     63 LYS  HN          4.50    (#    974:10  Single Ambig)
 &rst
  ixpk= 974, nxpk= 10, iat=  -1, 966, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 949, 950,1006,1007,1008,1010,1011,1012,
 &end
#
#    0 AMB  10-2:975     64 ASP  HN          4.50    (#    975:10  Single Ambig)
 &rst
  ixpk= 975, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  10-2:976     64 ASP  HN          3.50    (#    976:10  Single Ambig)
 &rst
  ixpk= 976, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 829, 830, 831, 833, 834, 835,1740,1741,1742,1744,
      1745,1746,
 &end
#
#    0 AMB  10-2:977     64 ASP  HN          3.50    (#    977:10  Single Ambig)
 &rst
  ixpk= 977, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1006,1007,1008,1010,1011,1012,1006,1007,1008,1010,
      1011,1012,
 &end
#
#    0 AMB  10-2:978     64 ASP  HN          3.50    (#    978:10  Single Ambig)
 &rst
  ixpk= 978, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 973, 974, 973, 974,
 &end
#
#    0 AMB  10-2:979     64 ASP  HN          4.50    (#    979:10  Single Ambig)
 &rst
  ixpk= 979, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 916, 917, 946, 947,
 &end
#
#    0 AMB  10-2:980     64 ASP  HN          5.50    (#    980:10  Single Ambig)
 &rst
  ixpk= 980, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 827,1683,1684,
 &end
#
#   63 LYS  HB+          64 ASP  HN          4.50    (#    981:10  Unique         3.00, 4.26 A)
 &rst
  ixpk= 981, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 970, 971,
 &end
#
#    0 AMB  10-2:982     64 ASP  HN          3.50    (#    982:10  Single Ambig)
 &rst
  ixpk= 982, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 992, 993, 992, 993,
 &end
#
#   61 SER  HB+          64 ASP  HN          5.50    (#    984:10  Unique         3.36, 4.65 A)
 &rst
  ixpk= 984, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 935, 936,
 &end
#
#   63 LYS  HA           64 ASP  HN          4.50    (#    985:10  Unique         3.20, 3.28 A)
 &rst
  ixpk= 985, nxpk= 10, iat= 968, 988, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HA           64 ASP  HN          5.50    (#    987:10  Unique         4.42, 4.65 A)
 &rst
  ixpk= 987, nxpk= 10, iat=1002, 988, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HE           64 ASP  HN          5.50    (#    988:10  Unique         5.49, 7.34 A)
 &rst
  ixpk= 988, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   65 VAL  HN           64 ASP  HN          3.50    (#    989:10  Unique         1.78, 2.33 A)
 &rst
  ixpk= 989, nxpk= 10, iat=1000, 988, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 ARG  HN           64 ASP  HN          5.50    (#    990:10  Unique         4.13, 4.26 A)
 &rst
  ixpk= 990, nxpk= 10, iat= 942, 988, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   61 SER  HN           64 ASP  HN          5.50    (#    991:10  Unique         2.79, 3.77 A)
 &rst
  ixpk= 991, nxpk= 10, iat= 931, 988, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HN           65 VAL  HN          5.50    (#    993:10  Unique         4.73, 5.26 A)
 &rst
  ixpk= 993, nxpk= 10, iat=1734,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HN           65 VAL  HN          5.50    (#    994:10  Unique         4.34, 4.39 A)
 &rst
  ixpk= 994, nxpk= 10, iat=1016,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ASP  HN           65 VAL  HN          3.50    (#    995:10  Unique         1.78, 2.33 A)
 &rst
  ixpk= 995, nxpk= 10, iat= 988,1000, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 TYR  HE           65 VAL  HN          5.50    (#    996:10  Unique         4.51, 7.09 A)
 &rst
  ixpk= 996, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   65 VAL  HA           65 VAL  HN          4.50    (#    997:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 997, nxpk= 10, iat=1002,1000, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 ASP  HA           65 VAL  HN          4.50    (#    998:10  Unique         2.43, 2.90 A)
 &rst
  ixpk= 998, nxpk= 10, iat= 990,1000, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 LYS  HA           65 VAL  HN          5.50    (#    999:10  Unique         3.91, 4.21 A)
 &rst
  ixpk= 999, nxpk= 10, iat= 968,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HA           65 VAL  HN          5.50    (#   1001:10  Unique         3.23, 3.81 A)
 &rst
  ixpk= 1001, nxpk= 10, iat= 944,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1002    65 VAL  HN          4.50    (#   1002:10  Single Ambig)
 &rst
  ixpk= 1002, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 992, 993, 992, 993,
 &end
#
#   65 VAL  HB           65 VAL  HN          5.50    (#   1003:10  Unique         3.64, 3.89 A)
 &rst
  ixpk= 1003, nxpk= 10, iat=1004,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HB           65 VAL  HN          5.50    (#   1004:10  Unique         3.54, 4.51 A)
 &rst
  ixpk= 1004, nxpk= 10, iat=1738,1000, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1005    65 VAL  HN          5.50    (#   1005:10  Single Ambig)
 &rst
  ixpk= 1005, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 970, 971,1722,
 &end
#
#    0 AMB  10-2:1006    65 VAL  HN          5.50    (#   1006:10  Single Ambig)
 &rst
  ixpk= 1006, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 976, 977,1020,1021,1050,1051,
 &end
#
#    0 AMB  10-2:1008    65 VAL  HN          5.50    (#   1008:10  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 916, 917, 946, 947, 946, 947,
 &end
#
#    0 AMB  10-2:1009    65 VAL  HN          5.50    (#   1009:10  Single Ambig)
 &rst
  ixpk= 1009, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 973, 974, 973, 974,
 &end
#
#   65 VAL  MGX          65 VAL  HN          2.80    (#   1010:10  Unique         2.03, 3.56 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1006,1007,1008,1010,1011,1012,
 &end
#
#  105 VAL  MGX          65 VAL  HN          3.50    (#   1011:10  Unique         2.91, 5.22 A)
 &rst
  ixpk= 1011, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  10-2:1012    65 VAL  HN          5.50    (#   1012:10  Single Ambig)
 &rst
  ixpk= 1012, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  103 GLN  HN           66 ARG  HN          4.50    (#   1014:10  Unique         2.16, 2.69 A)
 &rst
  ixpk= 1014, nxpk= 10, iat=1698,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 VAL  HN           66 ARG  HN          5.50    (#   1015:10  Unique         4.27, 4.71 A)
 &rst
  ixpk= 1015, nxpk= 10, iat=1734,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 VAL  HN           66 ARG  HN          5.50    (#   1016:10  Unique         4.34, 4.39 A)
 &rst
  ixpk= 1016, nxpk= 10, iat=1000,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 VAL  HA           66 ARG  HN          4.50    (#   1017:10  Unique         2.41, 2.60 A)
 &rst
  ixpk= 1017, nxpk= 10, iat=1002,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  102 LEU  HA           66 ARG  HN          5.50    (#   1018:10  Unique         3.23, 3.72 A)
 &rst
  ixpk= 1018, nxpk= 10, iat=1681,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HA           66 ARG  HN          5.50    (#   1019:10  Unique         4.42, 4.95 A)
 &rst
  ixpk= 1019, nxpk= 10, iat=1700,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HA           66 ARG  HN          4.50    (#   1021:10  Unique         2.88, 2.90 A)
 &rst
  ixpk= 1021, nxpk= 10, iat=1018,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  104 LEU  HA           66 ARG  HN          5.50    (#   1022:10  Unique         4.73, 4.98 A)
 &rst
  ixpk= 1022, nxpk= 10, iat=1717,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   65 VAL  HB           66 ARG  HN          4.50    (#   1023:10  Unique         1.86, 2.01 A)
 &rst
  ixpk= 1023, nxpk= 10, iat=1004,1016, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  103 GLN  HB+          66 ARG  HN          5.50    (#   1024:10  Unique         3.24, 4.35 A)
 &rst
  ixpk= 1024, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1702,1703,
 &end
#
#  102 LEU  HG           66 ARG  HN          5.50    (#   1025:10  Unique         2.01, 4.32 A)
 &rst
  ixpk= 1025, nxpk= 10, iat=1686,1016, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HG1-         66 ARG  HN          4.50    (#   1026:10  Unique         4.22, 5.15 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1050,1051,
 &end
#
#  102 LEU  HB-          66 ARG  HN          5.50    (#   1027:10  Unique         2.44, 3.86 A)
 &rst
  ixpk= 1027, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#    0 AMB  10-2:1028    66 ARG  HN          2.80    (#   1028:10  Single Ambig)
 &rst
  ixpk= 1028, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1006,1007,1008,1010,1011,1012,1006,1007,1008,1010,
      1011,1012,1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  10-2:1029    66 ARG  HN          2.80    (#   1029:10  Single Ambig)
 &rst
  ixpk= 1029, nxpk= 10, iat=  -1,1016, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1740,1741,1742,1744,1745,1746, 227, 228, 229,1068,
      1069,1070,1072,1073,1074,
 &end
#
#   68 LEU  HN           67 ILE  HN          5.50    (#   1030:10  Unique         4.21, 4.32 A)
 &rst
  ixpk= 1030, nxpk= 10, iat=1059,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HN           67 ILE  HN          5.50    (#   1031:10  Unique         3.80, 4.06 A)
 &rst
  ixpk= 1031, nxpk= 10, iat=1016,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HE           67 ILE  HN          5.50    (#   1033:10  Unique         1.95, 2.66 A)
 &rst
  ixpk= 1033, nxpk= 10, iat=1029,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   51 TYR  HE           67 ILE  HN          5.50    (#   1034:10  Unique         4.68, 6.50 A)
 &rst
  ixpk= 1034, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#  102 LEU  HA           67 ILE  HN          5.50    (#   1035:10  Unique         4.44, 4.78 A)
 &rst
  ixpk= 1035, nxpk= 10, iat=1681,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HA           67 ILE  HN          2.80    (#   1036:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1036, nxpk= 10, iat=1018,1040, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   67 ILE  HA           67 ILE  HN          5.50    (#   1038:10  Unique         2.81, 2.88 A)
 &rst
  ixpk= 1038, nxpk= 10, iat=1042,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1039    67 ILE  HN          5.50    (#   1039:10  Single Ambig)
 &rst
  ixpk= 1039, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1026,1027,1026,1027,
 &end
#
#   65 VAL  HB           67 ILE  HN          5.50    (#   1041:10  Unique         4.63, 5.22 A)
 &rst
  ixpk= 1041, nxpk= 10, iat=1004,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HB           67 ILE  HN          2.80    (#   1042:10  Unique         2.58, 2.71 A)
 &rst
  ixpk= 1042, nxpk= 10, iat=1044,1040, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   66 ARG  HG-          67 ILE  HN          5.50    (#   1043:10  Unique         2.92, 3.99 A)
 &rst
  ixpk= 1043, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1023,1024,
 &end
#
#   67 ILE  HG1-         67 ILE  HN          2.80    (#   1044:10  Unique         1.83, 2.71 A)
 &rst
  ixpk= 1044, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1050,1051,
 &end
#
#    0 AMB  10-2:1047    67 ILE  HN          3.50    (#   1047:10  Single Ambig)
 &rst
  ixpk= 1047, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1068,1069,1070,1072,1073,1074,1046,1047,1048,
 &end
#
#    0 AMB  10-2:1048    67 ILE  HN          3.50    (#   1048:10  Single Ambig)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1688,1689,1690,1692,1693,1694,1068,1069,1070,1072,
      1073,1074,
 &end
#
#    0 AMB  10-2:1050    68 LEU  HN          5.50    (#   1050:10  Single Ambig)
 &rst
  ixpk= 1050, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 759, 760, 761, 204, 205, 206, 208, 209, 210,
 &end
#
#    0 AMB  10-2:1051    68 LEU  HN          3.50    (#   1051:10  Single Ambig)
 &rst
  ixpk= 1051, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1068,1069,1070,1072,1073,1074,1046,1047,1048,
 &end
#
#   68 LEU  MDY          68 LEU  HN          3.50    (#   1052:10  Unique         1.79, 4.93 A)
 &rst
  ixpk= 1052, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#   68 LEU  HB-          68 LEU  HN          5.50    (#   1053:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 1053, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#   68 LEU  HB+          68 LEU  HN          4.50    (#   1054:10  Unique         2.17, 2.86 A)
 &rst
  ixpk= 1054, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1063,1064,
 &end
#
#   66 ARG  HG+          68 LEU  HN          4.50    (#   1055:10  Unique         3.58, 4.71 A)
 &rst
  ixpk= 1055, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#    0 AMB  10-2:1056    68 LEU  HN          5.50    (#   1056:10  Single Ambig)
 &rst
  ixpk= 1056, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1050,1051,1020,1021,
 &end
#
#   67 ILE  HB           68 LEU  HN          5.50    (#   1057:10  Unique         4.13, 4.26 A)
 &rst
  ixpk= 1057, nxpk= 10, iat=1044,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HA           68 LEU  HN          5.50    (#   1058:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1058, nxpk= 10, iat=1042,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 LEU  HA           68 LEU  HN          5.50    (#   1059:10  Unique         2.92, 2.93 A)
 &rst
  ixpk= 1059, nxpk= 10, iat=1061,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  HA           68 LEU  HN          5.50    (#   1060:10  Unique         4.60, 4.77 A)
 &rst
  ixpk= 1060, nxpk= 10, iat=1080,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HA           68 LEU  HN          5.50    (#   1062:10  Unique         2.63, 3.04 A)
 &rst
  ixpk= 1062, nxpk= 10, iat=1681,1059, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2-         68 LEU  HN          5.50    (#   1063:10  Unique         4.67, 5.95 A)
 &rst
  ixpk= 1063, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   69 ALA  HN           68 LEU  HN          4.50    (#   1064:10  Unique         1.84, 2.09 A)
 &rst
  ixpk= 1064, nxpk= 10, iat=1078,1059, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1065    68 LEU  HN          5.50    (#   1065:10  Single Ambig)
 &rst
  ixpk= 1065, nxpk= 10, iat=  -1,1059, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1698,1040,
 &end
#
#  102 LEU  HN           69 ALA  HN          5.50    (#   1066:10  Unique         5.08, 5.36 A)
 &rst
  ixpk= 1066, nxpk= 10, iat=1679,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 LEU  HN           69 ALA  HN          4.50    (#   1067:10  Unique         1.84, 2.09 A)
 &rst
  ixpk= 1067, nxpk= 10, iat=1059,1078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  101 LEU  HN           69 ALA  HN          5.50    (#   1069:10  Unique         3.07, 3.71 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=1660,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HN           69 ALA  HN          5.50    (#   1070:10  Unique         4.32, 4.41 A)
 &rst
  ixpk= 1070, nxpk= 10, iat=1088,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HA           69 ALA  HN          5.50    (#   1073:10  Unique         3.72, 4.34 A)
 &rst
  ixpk= 1073, nxpk= 10, iat=1681,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HA           69 ALA  HN          5.50    (#   1075:10  Unique         4.50, 4.93 A)
 &rst
  ixpk= 1075, nxpk= 10, iat=1662,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  HA           69 ALA  HN          4.50    (#   1076:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 1076, nxpk= 10, iat=1080,1078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 LEU  HA           69 ALA  HN          5.50    (#   1077:10  Unique         3.37, 3.48 A)
 &rst
  ixpk= 1077, nxpk= 10, iat=1061,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   67 ILE  HA           69 ALA  HN          4.50    (#   1078:10  Unique         3.37, 3.60 A)
 &rst
  ixpk= 1078, nxpk= 10, iat=1042,1078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 SER  HB+          69 ALA  HN          5.50    (#   1079:10  Unique         4.66, 5.79 A)
 &rst
  ixpk= 1079, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#    0 AMB  10-2:1080    69 ALA  HN          5.50    (#   1080:10  Single Ambig)
 &rst
  ixpk= 1080, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1705,1706,1705,1706,
 &end
#
#   67 ILE  HB           69 ALA  HN          5.50    (#   1081:10  Unique         4.62, 5.19 A)
 &rst
  ixpk= 1081, nxpk= 10, iat=1044,1078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1082    69 ALA  HN          5.50    (#   1082:10  Single Ambig)
 &rst
  ixpk= 1082, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1050,1051,1020,1021,
 &end
#
#   68 LEU  HB-          69 ALA  HN          5.50    (#   1084:10  Unique         2.84, 3.26 A)
 &rst
  ixpk= 1084, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1063,1064,
 &end
#
#    0 AMB  10-2:1085    69 ALA  HN          3.50    (#   1085:10  Single Ambig)
 &rst
  ixpk= 1085, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1=1664,1665,1068,1069,1070,1072,1073,1074,1046,1047,
      1048,
 &end
#
#    0 AMB  10-2:1086    69 ALA  HN          3.50    (#   1086:10  Single Ambig)
 &rst
  ixpk= 1086, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1082,1083,1084,1063,1064,
 &end
#
#  101 LEU  MDY          69 ALA  HN          4.50    (#   1087:10  Unique         2.75, 5.28 A)
 &rst
  ixpk= 1087, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  102 LEU  MDY          69 ALA  HN          5.50    (#   1088:10  Unique         3.77, 6.71 A)
 &rst
  ixpk= 1088, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  10-2:1089    69 ALA  HN          4.50    (#   1089:10  Single Ambig)
 &rst
  ixpk= 1089, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1688,1689,1690,1692,1693,1694,1050,1051,
 &end
#
#  101 LEU  HB-          69 ALA  HN          5.50    (#   1090:10  Unique         1.94, 3.40 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  -1,1078, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1664,1665,
 &end
#
#   71 THR  HN           70 SER  HN          5.50    (#   1092:10  Unique         4.13, 4.25 A)
 &rst
  ixpk= 1092, nxpk= 10, iat=1099,1088, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HN           70 SER  HN          5.50    (#   1093:10  Unique         3.98, 4.33 A)
 &rst
  ixpk= 1093, nxpk= 10, iat=1660,1088, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  HN           70 SER  HN          5.50    (#   1094:10  Unique         4.32, 4.41 A)
 &rst
  ixpk= 1094, nxpk= 10, iat=1078,1088, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HA           70 SER  HN          4.50    (#   1097:10  Unique         2.88, 2.89 A)
 &rst
  ixpk= 1097, nxpk= 10, iat=1090,1088, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   69 ALA  HA           70 SER  HN          2.80    (#   1099:10  Unique         2.24, 2.43 A)
 &rst
  ixpk= 1099, nxpk= 10, iat=1080,1088, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   70 SER  HB+          70 SER  HN          5.50    (#   1100:10  Unique         2.98, 3.67 A)
 &rst
  ixpk= 1100, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#   70 SER  HB-          70 SER  HN          5.50    (#   1101:10  Unique         2.98, 3.67 A)
 &rst
  ixpk= 1101, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#   69 ALA  MB           70 SER  HN          2.80    (#   1102:10  Unique         1.95, 3.24 A)
 &rst
  ixpk= 1102, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1082,1083,1084,
 &end
#
#    0 AMB  10-2:1103    70 SER  HN          4.50    (#   1103:10  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1=1664,1665,2549,2550,2551,2553,2554,2555,1068,1069,
      1070,1072,1073,1074,
 &end
#
#    0 AMB  10-2:1104    70 SER  HN          5.50    (#   1104:10  Single Ambig)
 &rst
  ixpk= 1104, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=2549,2550,2551,2553,2554,2555,1688,1689,1690,1692,
      1693,1694,1604,1605,
 &end
#
#    0 AMB  10-2:1105    70 SER  HN          5.50    (#   1105:10  Single Ambig)
 &rst
  ixpk= 1105, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1669,1670,1671,1673,1674,1675,1601,1602,
 &end
#
#    0 AMB  10-2:1106    70 SER  HN          5.50    (#   1106:10  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1669,1670,1671,1673,1674,1675,1601,1602,
 &end
#
#   72 ARG  HN           71 THR  HN          5.50    (#   1107:10  Unique         4.44, 4.59 A)
 &rst
  ixpk= 1107, nxpk= 10, iat=1113,1099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HN           71 THR  HN          5.50    (#   1108:10  Unique         3.94, 4.36 A)
 &rst
  ixpk= 1108, nxpk= 10, iat=1660,1099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HN           71 THR  HN          5.50    (#   1109:10  Unique         4.13, 4.25 A)
 &rst
  ixpk= 1109, nxpk= 10, iat=1088,1099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HN           71 THR  HN          5.50    (#   1110:10  Unique         3.92, 4.61 A)
 &rst
  ixpk= 1110, nxpk= 10, iat=1616,1099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HA           71 THR  HN          3.50    (#   1114:10  Unique         2.15, 2.23 A)
 &rst
  ixpk= 1114, nxpk= 10, iat=1090,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 THR  HB           71 THR  HN          5.50    (#   1116:10  Unique         2.43, 3.11 A)
 &rst
  ixpk= 1116, nxpk= 10, iat=1103,1099, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HA           71 THR  HN          4.50    (#   1117:10  Unique         2.74, 2.78 A)
 &rst
  ixpk= 1117, nxpk= 10, iat=1101,1099, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 SER  HB+          71 THR  HN          4.50    (#   1118:10  Unique         2.30, 3.48 A)
 &rst
  ixpk= 1118, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1092,1093,
 &end
#
#   70 SER  HB-          71 THR  HN          4.50    (#   1119:10  Unique         2.30, 3.48 A)
 &rst
  ixpk= 1119, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1092,1093,
 &end
#
#   99 TRP  HB-          71 THR  HN          5.50    (#   1120:10  Unique         3.60, 5.04 A)
 &rst
  ixpk= 1120, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#    0 AMB  10-2:1121    71 THR  HN          5.50    (#   1121:10  Single Ambig)
 &rst
  ixpk= 1121, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1644,1645,1644,1645,
 &end
#
#    0 AMB  10-2:1122    71 THR  HN          5.50    (#   1122:10  Single Ambig)
 &rst
  ixpk= 1122, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1179,1180,1117,1118,1117,1118,
 &end
#
#   69 ALA  MB           71 THR  HN          5.50    (#   1123:10  Unique         5.03, 6.36 A)
 &rst
  ixpk= 1123, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1082,1083,1084,
 &end
#
#    0 AMB  10-2:1124    71 THR  HN          5.50    (#   1124:10  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 759, 760, 761, 204, 205, 206, 208, 209, 210,
 &end
#
#   71 THR  HN           72 ARG  HN          5.50    (#   1125:10  Unique         4.44, 4.59 A)
 &rst
  ixpk= 1125, nxpk= 10, iat=1099,1113, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 ASN  HN           72 ARG  HN          4.50    (#   1126:10  Unique         2.01, 2.66 A)
 &rst
  ixpk= 1126, nxpk= 10, iat=1137,1113, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 ASN  HD2+         72 ARG  HN          5.50    (#   1128:10  Unique         4.01, 5.18 A)
 &rst
  ixpk= 1128, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HA           72 ARG  HN          5.50    (#   1130:10  Unique         4.53, 5.15 A)
 &rst
  ixpk= 1130, nxpk= 10, iat=1139,1113, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HB           72 ARG  HN          4.50    (#   1132:10  Unique         2.27, 3.32 A)
 &rst
  ixpk= 1132, nxpk= 10, iat=1103,1113, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 THR  HA           72 ARG  HN          3.50    (#   1133:10  Unique         2.15, 2.30 A)
 &rst
  ixpk= 1133, nxpk= 10, iat=1101,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 ARG  HA           72 ARG  HN          3.50    (#   1134:10  Unique         2.74, 2.80 A)
 &rst
  ixpk= 1134, nxpk= 10, iat=1115,1113, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1135    72 ARG  HN          5.50    (#   1135:10  Single Ambig)
 &rst
  ixpk= 1135, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1123,1124,1123,1124,
 &end
#
#    0 AMB  10-2:1136    72 ARG  HN          5.50    (#   1136:10  Single Ambig)
 &rst
  ixpk= 1136, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1141,1142,1620,1621,
 &end
#
#    0 AMB  10-2:1137    72 ARG  HN          5.50    (#   1137:10  Single Ambig)
 &rst
  ixpk= 1137, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1141,1142,1644,1645,
 &end
#
#    0 AMB  10-2:1138    72 ARG  HN          2.80    (#   1138:10  Single Ambig)
 &rst
  ixpk= 1138, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1117,1118,1117,1118,
 &end
#
#    0 AMB  10-2:1139    72 ARG  HN          3.50    (#   1139:10  Single Ambig)
 &rst
  ixpk= 1139, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1120,1121,1120,1121,
 &end
#
#   71 THR  MG2          72 ARG  HN          4.50    (#   1140:10  Unique         2.00, 4.04 A)
 &rst
  ixpk= 1140, nxpk= 10, iat=  -1,1113, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1105,1106,1107,
 &end
#
#   72 ARG  HN           73 ASN  HN          3.50    (#   1141:10  Unique         2.01, 2.66 A)
 &rst
  ixpk= 1141, nxpk= 10, iat=1113,1137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 ASN  HD2+         73 ASN  HN          5.50    (#   1142:10  Unique         2.36, 3.52 A)
 &rst
  ixpk= 1142, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HD2-         73 ASN  HN          5.50    (#   1144:10  Unique         2.36, 3.52 A)
 &rst
  ixpk= 1144, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HA           73 ASN  HN          2.80    (#   1145:10  Unique         2.79, 2.86 A)
 &rst
  ixpk= 1145, nxpk= 10, iat=1139,1137, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   71 THR  HB           73 ASN  HN          4.50    (#   1147:10  Unique         2.32, 3.27 A)
 &rst
  ixpk= 1147, nxpk= 10, iat=1103,1137, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 THR  HA           73 ASN  HN          4.50    (#   1148:10  Unique         3.68, 4.15 A)
 &rst
  ixpk= 1148, nxpk= 10, iat=1101,1137, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 ARG  HA           73 ASN  HN          3.50    (#   1149:10  Unique         3.46, 3.52 A)
 &rst
  ixpk= 1149, nxpk= 10, iat=1115,1137, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1150    73 ASN  HN          5.50    (#   1150:10  Single Ambig)
 &rst
  ixpk= 1150, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1123,1124,1123,1124,
 &end
#
#   73 ASN  HB+          73 ASN  HN          3.50    (#   1151:10  Unique         2.98, 3.69 A)
 &rst
  ixpk= 1151, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1141,1142,
 &end
#
#   73 ASN  HB-          73 ASN  HN          3.50    (#   1152:10  Unique         2.98, 3.69 A)
 &rst
  ixpk= 1152, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1141,1142,
 &end
#
#    0 AMB  10-2:1153    73 ASN  HN          3.50    (#   1153:10  Single Ambig)
 &rst
  ixpk= 1153, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1117,1118,1117,1118,
 &end
#
#   72 ARG  HG-          73 ASN  HN          4.50    (#   1154:10  Unique         2.28, 4.78 A)
 &rst
  ixpk= 1154, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1120,1121,
 &end
#
#   75 LEU  MDX          73 ASN  HN          4.50    (#   1155:10  Unique         3.24, 5.98 A)
 &rst
  ixpk= 1155, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1184,1185,1186,1188,1189,1190,
 &end
#
#   71 THR  MG2          73 ASN  HN          4.50    (#   1156:10  Unique         1.95, 4.17 A)
 &rst
  ixpk= 1156, nxpk= 10, iat=  -1,1137, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1105,1106,1107,
 &end
#
#   74 TRP  HE1          74 TRP  HN          5.50    (#   1157:10  Unique         4.21, 4.64 A)
 &rst
  ixpk= 1157, nxpk= 10, iat=1161,1151, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 LEU  HN           74 TRP  HN          5.50    (#   1158:10  Unique         4.12, 4.42 A)
 &rst
  ixpk= 1158, nxpk= 10, iat=1175,1151, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1159     0 AMB  10-1:1159   5.50    (#   1159:10  Double Ambig)
 &rst
  ixpk= 1159, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1146,1147,2408,
 igr2=1151,2363,
 &end
#
#   74 TRP  HD1          74 TRP  HN          3.50    (#   1160:10  Unique         1.97, 2.52 A)
 &rst
  ixpk= 1160, nxpk= 10, iat=1159,1151, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   73 ASN  HD2-         74 TRP  HN          5.50    (#   1161:10  Unique         3.31, 4.87 A)
 &rst
  ixpk= 1161, nxpk= 10, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1146,1147,
 &end
#
#   73 ASN  HA           74 TRP  HN          2.80    (#   1162:10  Unique         2.39, 2.71 A)
 &rst
  ixpk= 1162, nxpk= 10, iat=1139,1151, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1163    74 TRP  HN          4.50    (#   1163:10  Single Ambig)
 &rst
  ixpk= 1163, nxpk= 10, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1153,1103,
 &end
#
#   73 ASN  HB+          74 TRP  HN          4.50    (#   1164:10  Unique         1.95, 2.91 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1141,1142,
 &end
#
#   74 TRP  HB+          74 TRP  HN          3.50    (#   1165:10  Unique         2.40, 3.14 A)
 &rst
  ixpk= 1165, nxpk= 10, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1155,1156,
 &end
#
#   73 ASN  HB-          74 TRP  HN          3.50    (#   1166:10  Unique         1.95, 2.91 A)
 &rst
  ixpk= 1166, nxpk= 10, iat=  -1,1151, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1141,1142,
 &end
#
#    0 AMB  10-2:1167     0 AMB  10-1:1167   5.50    (#   1167:10  Double Ambig)
 &rst
  ixpk= 1167, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1151,2363,
 &end
#
#    0 AMB  10-2:1168     0 AMB  10-1:1168   5.50    (#   1168:10  Double Ambig)
 &rst
  ixpk= 1168, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2315,2316,1182,1568,1569,
 igr2=2363,1151,
 &end
#
#   97 GLN  HN           75 LEU  HN          5.50    (#   1169:10  Unique         2.79, 3.46 A)
 &rst
  ixpk= 1169, nxpk= 10, iat=1577,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HN           75 LEU  HN          5.50    (#   1171:10  Unique         4.25, 4.48 A)
 &rst
  ixpk= 1171, nxpk= 10, iat=1194,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1172    75 LEU  HN          5.50    (#   1172:10  Single Ambig)
 &rst
  ixpk= 1172, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1151,1137,
 &end
#
#   99 TRP  HD1          75 LEU  HN          5.50    (#   1174:10  Unique         2.92, 3.76 A)
 &rst
  ixpk= 1174, nxpk= 10, iat=1624,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 LYS  HA           75 LEU  HN          5.50    (#   1175:10  Unique         3.91, 4.70 A)
 &rst
  ixpk= 1175, nxpk= 10, iat=1557,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HA           75 LEU  HN          3.50    (#   1177:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 1177, nxpk= 10, iat=1153,1175, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   98 LYS  HA           75 LEU  HN          5.50    (#   1178:10  Unique         2.90, 3.33 A)
 &rst
  ixpk= 1178, nxpk= 10, iat=1596,1175, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HB-          75 LEU  HN          5.50    (#   1179:10  Unique         2.37, 3.74 A)
 &rst
  ixpk= 1179, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#   74 TRP  HB+          75 LEU  HN          4.50    (#   1180:10  Unique         2.37, 3.74 A)
 &rst
  ixpk= 1180, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1155,1156,
 &end
#
#    0 AMB  10-2:1181    75 LEU  HN          5.50    (#   1181:10  Single Ambig)
 &rst
  ixpk= 1181, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1581,1582,1204,1205,
 &end
#
#   75 LEU  HB+          75 LEU  HN          3.50    (#   1182:10  Unique         2.06, 2.86 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1179,1180,
 &end
#
#   75 LEU  HB-          75 LEU  HN          3.50    (#   1183:10  Unique         2.06, 2.86 A)
 &rst
  ixpk= 1183, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1179,1180,
 &end
#
#    0 AMB  10-2:1184    75 LEU  HN          5.50    (#   1184:10  Single Ambig)
 &rst
  ixpk= 1184, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,1559,1560,
 &end
#
#    0 AMB  10-2:1185    75 LEU  HN          5.50    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=1598,1599,2353,2354,2355,2357,2358,2359,2353,2354,
      2355,2357,2358,2359,
 &end
#
#    0 AMB  10-2:1186    75 LEU  HN          3.50    (#   1186:10  Single Ambig)
 &rst
  ixpk= 1186, nxpk= 10, iat=  -1,1175, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   97 GLN  HN           76 ARG  HN          5.50    (#   1187:10  Unique         5.08, 5.39 A)
 &rst
  ixpk= 1187, nxpk= 10, iat=1577,1194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 LEU  HN           76 ARG  HN          5.50    (#   1188:10  Unique         4.25, 4.48 A)
 &rst
  ixpk= 1188, nxpk= 10, iat=1175,1194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HA           76 ARG  HN          4.50    (#   1192:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 1192, nxpk= 10, iat=1196,1194, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 TYR  HA           76 ARG  HN          5.50    (#   1194:10  Unique         4.74, 4.92 A)
 &rst
  ixpk= 1194, nxpk= 10, iat=1220,1194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HD+          76 ARG  HN          5.50    (#   1196:10  Unique         1.85, 3.15 A)
 &rst
  ixpk= 1196, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#   76 ARG  HD-          76 ARG  HN          5.50    (#   1197:10  Unique         1.85, 3.15 A)
 &rst
  ixpk= 1197, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#    0 AMB  10-2:1198    76 ARG  HN          5.50    (#   1198:10  Single Ambig)
 &rst
  ixpk= 1198, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2412,2413,2412,2413,2415,2416,
 &end
#
#   76 ARG  HB+          76 ARG  HN          4.50    (#   1200:10  Unique         2.44, 3.53 A)
 &rst
  ixpk= 1200, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1198,1199,
 &end
#
#   76 ARG  HB-          76 ARG  HN          3.50    (#   1201:10  Unique         2.44, 3.53 A)
 &rst
  ixpk= 1201, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1198,1199,
 &end
#
#    0 AMB  10-2:1202    76 ARG  HN          5.50    (#   1202:10  Single Ambig)
 &rst
  ixpk= 1202, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#    0 AMB  10-2:1203    76 ARG  HN          3.50    (#   1203:10  Single Ambig)
 &rst
  ixpk= 1203, nxpk= 10, iat=  -1,1194, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   78 LYS  HN           77 TYR  HN          5.50    (#   1205:10  Unique         4.35, 4.36 A)
 &rst
  ixpk= 1205, nxpk= 10, iat=1239,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 GLN  HN           77 TYR  HN          5.50    (#   1206:10  Unique         2.26, 2.52 A)
 &rst
  ixpk= 1206, nxpk= 10, iat=1538,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HD           77 TYR  HN          5.50    (#   1207:10  Unique         2.42, 3.79 A)
 &rst
  ixpk= 1207, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1235,
 &end
#
#    7 TYR  HD           77 TYR  HN          5.50    (#   1209:10  Unique         4.38, 5.31 A)
 &rst
  ixpk= 1209, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#    7 TYR  HE           77 TYR  HN          5.50    (#   1210:10  Unique         3.67, 4.72 A)
 &rst
  ixpk= 1210, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#   96 LYS  HA           77 TYR  HN          5.50    (#   1211:10  Unique         4.83, 5.19 A)
 &rst
  ixpk= 1211, nxpk= 10, iat=1557,1218, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ARG  HA           77 TYR  HN          3.50    (#   1212:10  Unique         2.34, 2.48 A)
 &rst
  ixpk= 1212, nxpk= 10, iat=1196,1218, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 TYR  HA           77 TYR  HN          4.50    (#   1213:10  Unique         2.85, 2.86 A)
 &rst
  ixpk= 1213, nxpk= 10, iat=1220,1218, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 TYR  HB+          77 TYR  HN          5.50    (#   1215:10  Unique         3.55, 3.78 A)
 &rst
  ixpk= 1215, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1222,1223,
 &end
#
#   77 TYR  HB-          77 TYR  HN          5.50    (#   1216:10  Unique         3.55, 3.78 A)
 &rst
  ixpk= 1216, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1222,1223,
 &end
#
#   76 ARG  HD-          77 TYR  HN          5.50    (#   1217:10  Unique         2.60, 5.02 A)
 &rst
  ixpk= 1217, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#    0 AMB  10-2:1218    77 TYR  HN          5.50    (#   1218:10  Single Ambig)
 &rst
  ixpk= 1218, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1542,1543,1243,1244,1179,1180,
 &end
#
#    0 AMB  10-2:1219    77 TYR  HN          5.50    (#   1219:10  Single Ambig)
 &rst
  ixpk= 1219, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1249,1250,1249,1250,1243,1244,
 &end
#
#   76 ARG  HB+          77 TYR  HN          5.50    (#   1220:10  Unique         2.19, 2.92 A)
 &rst
  ixpk= 1220, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1198,1199,
 &end
#
#   76 ARG  HB-          77 TYR  HN          4.50    (#   1221:10  Unique         2.19, 2.92 A)
 &rst
  ixpk= 1221, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1198,1199,
 &end
#
#   76 ARG  HG-          77 TYR  HN          5.50    (#   1223:10  Unique         1.89, 4.43 A)
 &rst
  ixpk= 1223, nxpk= 10, iat=  -1,1218, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1201,1202,
 &end
#
#   79 LEU  HN           78 LYS  HN          5.50    (#   1224:10  Unique         4.07, 4.30 A)
 &rst
  ixpk= 1224, nxpk= 10, iat=1261,1239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HD           78 LYS  HN          5.50    (#   1225:10  Unique         3.09, 4.33 A)
 &rst
  ixpk= 1225, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1235,
 &end
#
#   77 TYR  HE           78 LYS  HN          5.50    (#   1226:10  Unique         5.41, 6.44 A)
 &rst
  ixpk= 1226, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1228,1233,
 &end
#
#    7 TYR  HE           78 LYS  HN          5.50    (#   1227:10  Unique         4.69, 6.90 A)
 &rst
  ixpk= 1227, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#   77 TYR  HA           78 LYS  HN          3.50    (#   1229:10  Unique         2.50, 2.62 A)
 &rst
  ixpk= 1229, nxpk= 10, iat=1220,1239, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 LYS  HA           78 LYS  HN          5.50    (#   1230:10  Unique         2.91, 2.94 A)
 &rst
  ixpk= 1230, nxpk= 10, iat=1241,1239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HA+          78 LYS  HN          5.50    (#   1231:10  Unique         4.72, 5.22 A)
 &rst
  ixpk= 1231, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1533,1534,
 &end
#
#   77 TYR  HB+          78 LYS  HN          4.50    (#   1232:10  Unique         1.92, 2.68 A)
 &rst
  ixpk= 1232, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1222,1223,
 &end
#
#   77 TYR  HB-          78 LYS  HN          4.50    (#   1234:10  Unique         1.92, 2.68 A)
 &rst
  ixpk= 1234, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1222,1223,
 &end
#
#   78 LYS  HB+          78 LYS  HN          4.50    (#   1235:10  Unique         2.18, 2.85 A)
 &rst
  ixpk= 1235, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1243,1244,
 &end
#
#   78 LYS  HG+          78 LYS  HN          4.50    (#   1236:10  Unique         3.51, 4.36 A)
 &rst
  ixpk= 1236, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1246,1247,
 &end
#
#    0 AMB  10-2:1237    78 LYS  HN          3.50    (#   1237:10  Single Ambig)
 &rst
  ixpk= 1237, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1243,1244,1249,1250,1249,1250,
 &end
#
#   78 LYS  HG-          78 LYS  HN          5.50    (#   1238:10  Unique         3.51, 4.36 A)
 &rst
  ixpk= 1238, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1246,1247,
 &end
#
#    0 AMB  10-2:1239    78 LYS  HN          5.50    (#   1239:10  Single Ambig)
 &rst
  ixpk= 1239, nxpk= 10, iat=  -1,1239, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,1265,1266,
 &end
#
#   77 TYR  HN           78 LYS  HN          5.50    (#   1240:10  Unique         4.35, 4.36 A)
 &rst
  ixpk= 1240, nxpk= 10, iat=1218,1239, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   78 LYS  HN           79 LEU  HN          5.50    (#   1241:10  Unique         4.07, 4.30 A)
 &rst
  ixpk= 1241, nxpk= 10, iat=1239,1261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   95 GLN  HN           79 LEU  HN          5.50    (#   1242:10  Unique         4.77, 5.29 A)
 &rst
  ixpk= 1242, nxpk= 10, iat=1538,1261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HN           79 LEU  HN          5.50    (#   1243:10  Unique         4.07, 4.59 A)
 &rst
  ixpk= 1243, nxpk= 10, iat=1531,1261, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HE           79 LEU  HN          5.50    (#   1245:10  Unique         4.24, 6.68 A)
 &rst
  ixpk= 1245, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1228,1233,
 &end
#
#    7 TYR  HE           79 LEU  HN          5.50    (#   1247:10  Unique         4.20, 7.16 A)
 &rst
  ixpk= 1247, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#   78 LYS  HA           79 LEU  HN          3.50    (#   1249:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1249, nxpk= 10, iat=1241,1261, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   94 GLY  HA+          79 LEU  HN          4.50    (#   1250:10  Unique         2.34, 3.37 A)
 &rst
  ixpk= 1250, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1533,1534,
 &end
#
#   94 GLY  HA-          79 LEU  HN          4.50    (#   1252:10  Unique         2.34, 3.37 A)
 &rst
  ixpk= 1252, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1533,1534,
 &end
#
#    0 AMB  10-2:1253    79 LEU  HN          5.50    (#   1253:10  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1252,1253,1252,1253,1281,1282,
 &end
#
#   80 PRO  HD+          79 LEU  HN          5.50    (#   1254:10  Unique         4.66, 4.88 A)
 &rst
  ixpk= 1254, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1281,1282,
 &end
#
#   78 LYS  HB+          79 LEU  HN          4.50    (#   1255:10  Unique         3.38, 4.13 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1243,1244,
 &end
#
#   78 LYS  HG+          79 LEU  HN          4.50    (#   1256:10  Unique         3.04, 4.48 A)
 &rst
  ixpk= 1256, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1246,1247,
 &end
#
#    0 AMB  10-2:1257    79 LEU  HN          3.50    (#   1257:10  Single Ambig)
 &rst
  ixpk= 1257, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1249,1250,1249,1250,
 &end
#
#   78 LYS  HG-          79 LEU  HN          4.50    (#   1258:10  Unique         3.04, 4.48 A)
 &rst
  ixpk= 1258, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1246,1247,
 &end
#
#   79 LEU  HG           79 LEU  HN          3.50    (#   1259:10  Unique         1.80, 2.29 A)
 &rst
  ixpk= 1259, nxpk= 10, iat=1268,1261, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   79 LEU  MDY          79 LEU  HN          3.50    (#   1261:10  Unique         1.94, 3.92 A)
 &rst
  ixpk= 1261, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  10-2:1262    79 LEU  HN          5.50    (#   1262:10  Single Ambig)
 &rst
  ixpk= 1262, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1525,1526,1527,1522,1523,
 &end
#
#   79 LEU  MDX          79 LEU  HN          3.50    (#   1263:10  Unique         1.94, 3.92 A)
 &rst
  ixpk= 1263, nxpk= 10, iat=  -1,1261, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#   83 LEU  HN           81 LYS  HN          5.50    (#   1265:10  Unique         3.73, 4.15 A)
 &rst
  ixpk= 1265, nxpk= 10, iat=1340,1294, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HN           81 LYS  HN          5.50    (#   1267:10  Unique         3.99, 4.43 A)
 &rst
  ixpk= 1267, nxpk= 10, iat=1359,1294, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 PRO  HA           81 LYS  HN          2.80    (#   1268:10  Unique         2.22, 2.87 A)
 &rst
  ixpk= 1268, nxpk= 10, iat=1290,1294, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   81 LYS  HA           81 LYS  HN          3.50    (#   1269:10  Unique         2.27, 2.36 A)
 &rst
  ixpk= 1269, nxpk= 10, iat=1296,1294, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1270    81 LYS  HN          5.50    (#   1270:10  Single Ambig)
 &rst
  ixpk= 1270, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1307,1308,1307,1308,
 &end
#
#   80 PRO  HB+          81 LYS  HN          4.50    (#   1271:10  Unique         2.64, 4.27 A)
 &rst
  ixpk= 1271, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1287,1288,
 &end
#
#    0 AMB  10-2:1272    81 LYS  HN          2.80    (#   1272:10  Single Ambig)
 &rst
  ixpk= 1272, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1298,1299,1298,1299,
 &end
#
#   81 LYS  HG-          81 LYS  HN          3.50    (#   1273:10  Unique         2.15, 3.58 A)
 &rst
  ixpk= 1273, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1301,1302,
 &end
#
#   81 LYS  HG+          81 LYS  HN          3.50    (#   1274:10  Unique         2.15, 3.58 A)
 &rst
  ixpk= 1274, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1301,1302,
 &end
#
#   84 VAL  MGX          81 LYS  HN          5.50    (#   1276:10  Unique         2.67, 5.36 A)
 &rst
  ixpk= 1276, nxpk= 10, iat=  -1,1294, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   83 LEU  HN           82 ARG  HN          3.50    (#   1277:10  Unique         1.86, 2.14 A)
 &rst
  ixpk= 1277, nxpk= 10, iat=1340,1316, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   82 ARG  HE           82 ARG  HN          5.50    (#   1278:10  Unique         2.28, 3.97 A)
 &rst
  ixpk= 1278, nxpk= 10, iat=1329,1316, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HN           82 ARG  HN          5.50    (#   1279:10  Unique         2.94, 3.38 A)
 &rst
  ixpk= 1279, nxpk= 10, iat=1359,1316, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HA           82 ARG  HN          2.80    (#   1280:10  Unique         2.73, 2.90 A)
 &rst
  ixpk= 1280, nxpk= 10, iat=1318,1316, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   81 LYS  HA           82 ARG  HN          4.50    (#   1281:10  Unique         2.79, 3.01 A)
 &rst
  ixpk= 1281, nxpk= 10, iat=1296,1316, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1282    82 ARG  HN          4.50    (#   1282:10  Single Ambig)
 &rst
  ixpk= 1282, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1326,1327,1326,1327,
 &end
#
#    0 AMB  10-2:1283    82 ARG  HN          5.50    (#   1283:10  Single Ambig)
 &rst
  ixpk= 1283, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1307,1308,1307,1308,
 &end
#
#   80 PRO  HB+          82 ARG  HN          5.50    (#   1284:10  Unique         2.18, 4.31 A)
 &rst
  ixpk= 1284, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1287,1288,
 &end
#
#    0 AMB  10-2:1285    82 ARG  HN          2.80    (#   1285:10  Single Ambig)
 &rst
  ixpk= 1285, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1320,1321,1298,1299,
 &end
#
#    0 AMB  10-2:1286    82 ARG  HN          2.80    (#   1286:10  Single Ambig)
 &rst
  ixpk= 1286, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1320,1321,1284,1285,
 &end
#
#    0 AMB  10-2:1287    82 ARG  HN          2.80    (#   1287:10  Single Ambig)
 &rst
  ixpk= 1287, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1323,1324,1301,1302,
 &end
#
#   82 ARG  HG-          82 ARG  HN          2.80    (#   1288:10  Unique         2.13, 2.98 A)
 &rst
  ixpk= 1288, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1323,1324,
 &end
#
#    0 AMB  10-2:1289    82 ARG  HN          5.50    (#   1289:10  Single Ambig)
 &rst
  ixpk= 1289, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,
 &end
#
#   84 VAL  MGX          82 ARG  HN          5.50    (#   1290:10  Unique         3.28, 5.97 A)
 &rst
  ixpk= 1290, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   82 ARG  HN           83 LEU  HN          3.50    (#   1291:10  Unique         1.86, 2.14 A)
 &rst
  ixpk= 1291, nxpk= 10, iat=1316,1340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   84 VAL  HN           83 LEU  HN          2.80    (#   1292:10  Unique         1.81, 2.04 A)
 &rst
  ixpk= 1292, nxpk= 10, iat=1359,1340, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 ARG  HA           83 LEU  HN          3.50    (#   1293:10  Unique         3.32, 3.45 A)
 &rst
  ixpk= 1293, nxpk= 10, iat=1318,1340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   83 LEU  HA           83 LEU  HN          3.50    (#   1294:10  Unique         2.76, 2.93 A)
 &rst
  ixpk= 1294, nxpk= 10, iat=1342,1340, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 LYS  HA           83 LEU  HN          5.50    (#   1295:10  Unique         3.50, 3.79 A)
 &rst
  ixpk= 1295, nxpk= 10, iat=1296,1340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HA           83 LEU  HN          5.50    (#   1296:10  Unique         4.39, 4.66 A)
 &rst
  ixpk= 1296, nxpk= 10, iat=1361,1340, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1297    83 LEU  HN          5.50    (#   1297:10  Single Ambig)
 &rst
  ixpk= 1297, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1326,1327,1326,1327,
 &end
#
#   80 PRO  HD-          83 LEU  HN          5.50    (#   1298:10  Unique         3.48, 4.92 A)
 &rst
  ixpk= 1298, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1281,1282,
 &end
#
#    0 AMB  10-2:1299     0 AMB  10-1:1299   5.50    (#   1299:10  Double Ambig)
 &rst
  ixpk= 1299, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1287,1288, 881, 882,
 igr2=1340, 585,
 &end
#
#    0 AMB  10-2:1300     0 AMB  10-1:1300   4.50    (#   1300:10  Double Ambig)
 &rst
  ixpk= 1300, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1298,1299,1298,1299,1542,1543,1542,1543,
 igr2=1340, 585,
 &end
#
#   83 LEU  HB+          83 LEU  HN          3.50    (#   1301:10  Unique         2.09, 3.13 A)
 &rst
  ixpk= 1301, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1344,1345,
 &end
#
#    0 AMB  10-2:1302    83 LEU  HN          2.80    (#   1302:10  Single Ambig)
 &rst
  ixpk= 1302, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1323,1324,1344,1345,
 &end
#
#    0 AMB  10-2:1303    83 LEU  HN          3.50    (#   1303:10  Single Ambig)
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,1349,1350,1351,1353,1354,1355,
 &end
#
#   84 VAL  MGX          83 LEU  HN          5.50    (#   1304:10  Unique         2.72, 5.35 A)
 &rst
  ixpk= 1304, nxpk= 10, iat=  -1,1340, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   86 TRP  HE1          84 VAL  HN          5.50    (#   1305:10  Unique         3.90, 4.21 A)
 &rst
  ixpk= 1305, nxpk= 10, iat=1409,1359, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ARG  HN           84 VAL  HN          4.50    (#   1306:10  Unique         2.94, 3.38 A)
 &rst
  ixpk= 1306, nxpk= 10, iat=1316,1359, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1307    84 VAL  HN          4.50    (#   1307:10  Single Ambig)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1375,1501,
 &end
#
#   83 LEU  HN           84 VAL  HN          2.80    (#   1308:10  Unique         1.81, 2.04 A)
 &rst
  ixpk= 1308, nxpk= 10, iat=1340,1359, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   82 ARG  HA           84 VAL  HN          4.50    (#   1310:10  Unique         3.97, 4.40 A)
 &rst
  ixpk= 1310, nxpk= 10, iat=1318,1359, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   83 LEU  HA           84 VAL  HN          3.50    (#   1311:10  Unique         3.27, 3.42 A)
 &rst
  ixpk= 1311, nxpk= 10, iat=1342,1359, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 LYS  HA           84 VAL  HN          4.50    (#   1312:10  Unique         2.60, 3.25 A)
 &rst
  ixpk= 1312, nxpk= 10, iat=1296,1359, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 VAL  HA           84 VAL  HN          3.50    (#   1313:10  Unique         2.75, 2.82 A)
 &rst
  ixpk= 1313, nxpk= 10, iat=1361,1359, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1314    84 VAL  HN          5.50    (#   1314:10  Single Ambig)
 &rst
  ixpk= 1314, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1385,1386,1385,1386,
 &end
#
#    0 AMB  10-2:1315    84 VAL  HN          5.50    (#   1315:10  Single Ambig)
 &rst
  ixpk= 1315, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1307,1308,1307,1308,1252,1253,1252,1253,
 &end
#
#    0 AMB  10-2:1316    84 VAL  HN          5.50    (#   1316:10  Single Ambig)
 &rst
  ixpk= 1316, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1298,1299,1320,1321,
 &end
#
#    0 AMB  10-2:1317    84 VAL  HN          3.50    (#   1317:10  Single Ambig)
 &rst
  ixpk= 1317, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1284,1285,1304,1305,1304,1305,1379,1380,
 &end
#
#   84 VAL  HB           84 VAL  HN          2.80    (#   1318:10  Unique         2.48, 2.65 A)
 &rst
  ixpk= 1318, nxpk= 10, iat=1363,1359, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   84 VAL  MGY          84 VAL  HN          2.80    (#   1321:10  Unique         1.92, 3.70 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          84 VAL  HN          3.50    (#   1322:10  Unique         1.92, 3.70 A)
 &rst
  ixpk= 1322, nxpk= 10, iat=  -1,1359, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   87 ASP  HN           85 ARG  HN          5.50    (#   1323:10  Unique         3.96, 4.29 A)
 &rst
  ixpk= 1323, nxpk= 10, iat=1423,1375, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HN           85 ARG  HN          5.50    (#   1324:10  Unique         1.92, 2.41 A)
 &rst
  ixpk= 1324, nxpk= 10, iat=1399,1375, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HD1          85 ARG  HN          5.50    (#   1325:10  Unique         3.45, 4.13 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=1407,1375, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HN           85 ARG  HN          4.50    (#   1326:10  Unique         4.53, 4.60 A)
 &rst
  ixpk= 1326, nxpk= 10, iat=1359,1375, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 ARG  HA           85 ARG  HN          3.50    (#   1327:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 1327, nxpk= 10, iat=1377,1375, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HA           85 ARG  HN          5.50    (#   1328:10  Unique         4.15, 4.44 A)
 &rst
  ixpk= 1328, nxpk= 10, iat=1401,1375, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   84 VAL  HA           85 ARG  HN          2.80    (#   1331:10  Unique         2.15, 2.26 A)
 &rst
  ixpk= 1331, nxpk= 10, iat=1361,1375, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1332    85 ARG  HN          5.50    (#   1332:10  Single Ambig)
 &rst
  ixpk= 1332, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1385,1386,1385,1386,
 &end
#
#   85 ARG  HB+          85 ARG  HN          3.50    (#   1334:10  Unique         2.55, 3.28 A)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1379,1380,
 &end
#
#    0 AMB  10-2:1335    85 ARG  HN          2.80    (#   1335:10  Single Ambig)
 &rst
  ixpk= 1335, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1382,1383,1379,1380,
 &end
#
#   85 ARG  HG-          85 ARG  HN          4.50    (#   1336:10  Unique         1.87, 3.09 A)
 &rst
  ixpk= 1336, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   84 VAL  MGY          85 ARG  HN          3.50    (#   1339:10  Unique         1.95, 3.93 A)
 &rst
  ixpk= 1339, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          85 ARG  HN          2.80    (#   1340:10  Unique         1.95, 3.93 A)
 &rst
  ixpk= 1340, nxpk= 10, iat=  -1,1375, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   86 TRP  HE1          86 TRP  HN          5.50    (#   1341:10  Unique         4.26, 4.85 A)
 &rst
  ixpk= 1341, nxpk= 10, iat=1409,1399, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HN           86 TRP  HN          2.80    (#   1342:10  Unique         2.62, 2.79 A)
 &rst
  ixpk= 1342, nxpk= 10, iat=1423,1399, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   85 ARG  HN           86 TRP  HN          4.50    (#   1343:10  Unique         1.92, 2.41 A)
 &rst
  ixpk= 1343, nxpk= 10, iat=1375,1399, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   86 TRP  HE3          86 TRP  HN          5.50    (#   1345:10  Unique         4.22, 5.20 A)
 &rst
  ixpk= 1345, nxpk= 10, iat=1418,1399, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HD1          86 TRP  HN          3.50    (#   1346:10  Unique         2.10, 3.16 A)
 &rst
  ixpk= 1346, nxpk= 10, iat=1407,1399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   85 ARG  HA           86 TRP  HN          3.50    (#   1349:10  Unique         2.16, 3.28 A)
 &rst
  ixpk= 1349, nxpk= 10, iat=1377,1399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HA           86 TRP  HN          3.50    (#   1350:10  Unique         2.27, 2.37 A)
 &rst
  ixpk= 1350, nxpk= 10, iat=1401,1399, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1353    86 TRP  HN          3.50    (#   1353:10  Single Ambig)
 &rst
  ixpk= 1353, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1403,1404,1361,
 &end
#
#    0 AMB  10-2:1354    86 TRP  HN          4.50    (#   1354:10  Single Ambig)
 &rst
  ixpk= 1354, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1385,1386,1385,1386,
 &end
#
#   86 TRP  HB-          86 TRP  HN          3.50    (#   1355:10  Unique         2.56, 3.71 A)
 &rst
  ixpk= 1355, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1403,1404,
 &end
#
#   87 ASP  HB+          86 TRP  HN          5.50    (#   1356:10  Unique         4.06, 5.23 A)
 &rst
  ixpk= 1356, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1427,1428,
 &end
#
#   87 ASP  HB-          86 TRP  HN          5.50    (#   1357:10  Unique         4.06, 5.23 A)
 &rst
  ixpk= 1357, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1427,1428,
 &end
#
#   85 ARG  HB+          86 TRP  HN          4.50    (#   1358:10  Unique         2.93, 3.93 A)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1379,1380,
 &end
#
#   85 ARG  HG+          86 TRP  HN          4.50    (#   1359:10  Unique         1.94, 3.65 A)
 &rst
  ixpk= 1359, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   85 ARG  HG-          86 TRP  HN          4.50    (#   1360:10  Unique         1.94, 3.65 A)
 &rst
  ixpk= 1360, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   91 VAL  MGY          86 TRP  HN          5.50    (#   1361:10  Unique         2.53, 5.36 A)
 &rst
  ixpk= 1361, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGY          86 TRP  HN          5.50    (#   1362:10  Unique         1.89, 4.43 A)
 &rst
  ixpk= 1362, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          86 TRP  HN          5.50    (#   1363:10  Unique         2.53, 5.36 A)
 &rst
  ixpk= 1363, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          86 TRP  HN          4.50    (#   1364:10  Unique         1.89, 4.43 A)
 &rst
  ixpk= 1364, nxpk= 10, iat=  -1,1399, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#    0 AMB  10-2:1366    87 ASP  HN          5.50    (#   1366:10  Single Ambig)
 &rst
  ixpk= 1366, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1375,1501,
 &end
#
#   86 TRP  HN           87 ASP  HN          2.80    (#   1367:10  Unique         2.62, 2.79 A)
 &rst
  ixpk= 1367, nxpk= 10, iat=1399,1423, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   85 ARG  HE           87 ASP  HN          5.50    (#   1368:10  Unique         3.96, 5.27 A)
 &rst
  ixpk= 1368, nxpk= 10, iat=1388,1423, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HD1          87 ASP  HN          5.50    (#   1370:10  Unique         4.98, 5.32 A)
 &rst
  ixpk= 1370, nxpk= 10, iat=1407,1423, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   88 THR  HN           87 ASP  HN          2.80    (#   1371:10  Unique         1.85, 1.97 A)
 &rst
  ixpk= 1371, nxpk= 10, iat=1435,1423, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   87 ASP  HA           87 ASP  HN          3.50    (#   1373:10  Unique         2.85, 2.92 A)
 &rst
  ixpk= 1373, nxpk= 10, iat=1425,1423, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   86 TRP  HA           87 ASP  HN          3.50    (#   1374:10  Unique         2.59, 2.82 A)
 &rst
  ixpk= 1374, nxpk= 10, iat=1401,1423, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 THR  HB           87 ASP  HN          5.50    (#   1375:10  Unique         3.43, 4.70 A)
 &rst
  ixpk= 1375, nxpk= 10, iat=1439,1423, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   91 VAL  HA           87 ASP  HN          5.50    (#   1376:10  Unique         3.17, 4.17 A)
 &rst
  ixpk= 1376, nxpk= 10, iat=1487,1423, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   86 TRP  HB+          87 ASP  HN          3.50    (#   1377:10  Unique         3.83, 4.32 A)
 &rst
  ixpk= 1377, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1403,1404,
 &end
#
#    0 AMB  10-2:1378    87 ASP  HN          5.50    (#   1378:10  Single Ambig)
 &rst
  ixpk= 1378, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1385,1386,1385,1386,
 &end
#
#    0 AMB  10-2:1379    87 ASP  HN          3.50    (#   1379:10  Single Ambig)
 &rst
  ixpk= 1379, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1403,1404,1462,1463,1462,1463,
 &end
#
#   87 ASP  HB+          87 ASP  HN          2.80    (#   1380:10  Unique         2.41, 3.11 A)
 &rst
  ixpk= 1380, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1427,1428,
 &end
#
#   87 ASP  HB-          87 ASP  HN          2.80    (#   1381:10  Unique         2.41, 3.11 A)
 &rst
  ixpk= 1381, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1427,1428,
 &end
#
#   85 ARG  HB+          87 ASP  HN          4.50    (#   1382:10  Unique         2.31, 3.90 A)
 &rst
  ixpk= 1382, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1379,1380,
 &end
#
#    0 AMB  10-2:1383    87 ASP  HN          3.50    (#   1383:10  Single Ambig)
 &rst
  ixpk= 1383, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1382,1383,1379,1380,
 &end
#
#   85 ARG  HG-          87 ASP  HN          5.50    (#   1384:10  Unique         1.89, 3.49 A)
 &rst
  ixpk= 1384, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1382,1383,
 &end
#
#   88 THR  MG2          87 ASP  HN          4.50    (#   1385:10  Unique         2.78, 4.05 A)
 &rst
  ixpk= 1385, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1441,1442,1443,
 &end
#
#   91 VAL  MGX          87 ASP  HN          5.50    (#   1386:10  Unique         3.12, 6.07 A)
 &rst
  ixpk= 1386, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          87 ASP  HN          5.50    (#   1387:10  Unique         4.43, 6.85 A)
 &rst
  ixpk= 1387, nxpk= 10, iat=  -1,1423, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   87 ASP  HN           88 THR  HN          2.80    (#   1388:10  Unique         1.85, 1.97 A)
 &rst
  ixpk= 1388, nxpk= 10, iat=1423,1435, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1389    88 THR  HN          5.50    (#   1389:10  Single Ambig)
 &rst
  ixpk= 1389, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1501,1485,1375,
 &end
#
#   89 LYS  HN           88 THR  HN          4.50    (#   1390:10  Unique         1.96, 2.46 A)
 &rst
  ixpk= 1390, nxpk= 10, iat=1449,1435, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   87 ASP  HA           88 THR  HN          3.50    (#   1391:10  Unique         2.70, 3.13 A)
 &rst
  ixpk= 1391, nxpk= 10, iat=1425,1435, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1392    88 THR  HN          2.80    (#   1392:10  Single Ambig)
 &rst
  ixpk= 1392, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1437,1401,
 &end
#
#   88 THR  HB           88 THR  HN          3.50    (#   1394:10  Unique         2.30, 3.38 A)
 &rst
  ixpk= 1394, nxpk= 10, iat=1439,1435, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   91 VAL  HA           88 THR  HN          5.50    (#   1395:10  Unique         2.47, 3.52 A)
 &rst
  ixpk= 1395, nxpk= 10, iat=1487,1435, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1396    88 THR  HN          5.50    (#   1396:10  Single Ambig)
 &rst
  ixpk= 1396, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1403,1404,1361,1472,1473,1472,1473,
 &end
#
#    0 AMB  10-2:1397    88 THR  HN          5.50    (#   1397:10  Single Ambig)
 &rst
  ixpk= 1397, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1385,1386,1385,1386,
 &end
#
#    0 AMB  10-2:1398    88 THR  HN          5.50    (#   1398:10  Single Ambig)
 &rst
  ixpk= 1398, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1462,1463,1462,1463,1403,1404,
 &end
#
#   87 ASP  HB+          88 THR  HN          4.50    (#   1399:10  Unique         3.09, 3.99 A)
 &rst
  ixpk= 1399, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1427,1428,
 &end
#
#    0 AMB  10-2:1400    88 THR  HN          4.50    (#   1400:10  Single Ambig)
 &rst
  ixpk= 1400, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1427,1428,1505,1506,
 &end
#
#   85 ARG  HB+          88 THR  HN          4.50    (#   1401:10  Unique         3.08, 5.32 A)
 &rst
  ixpk= 1401, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1379,1380,
 &end
#
#    0 AMB  10-2:1402    88 THR  HN          3.50    (#   1402:10  Single Ambig)
 &rst
  ixpk= 1402, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1382,1383,1379,1380,
 &end
#
#   85 ARG  HG-          88 THR  HN          5.50    (#   1403:10  Unique         2.13, 4.56 A)
 &rst
  ixpk= 1403, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1382,1383,
 &end
#
#   88 THR  MG2          88 THR  HN          2.80    (#   1405:10  Unique         1.85, 3.16 A)
 &rst
  ixpk= 1405, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1441,1442,1443,
 &end
#
#   91 VAL  MGX          88 THR  HN          5.50    (#   1406:10  Unique         2.22, 6.02 A)
 &rst
  ixpk= 1406, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          88 THR  HN          5.50    (#   1407:10  Unique         5.36, 7.74 A)
 &rst
  ixpk= 1407, nxpk= 10, iat=  -1,1435, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   88 THR  MG2          89 LYS  HN          4.50    (#   1408:10  Unique         1.92, 3.77 A)
 &rst
  ixpk= 1408, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1441,1442,1443,
 &end
#
#   89 LYS  HG+          89 LYS  HN          3.50    (#   1409:10  Unique         2.65, 3.32 A)
 &rst
  ixpk= 1409, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1456,1457,
 &end
#
#    0 AMB  10-2:1410    89 LYS  HN          3.50    (#   1410:10  Single Ambig)
 &rst
  ixpk= 1410, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1453,1454,1382,1383,
 &end
#
#    0 AMB  10-2:1411    89 LYS  HN          5.50    (#   1411:10  Single Ambig)
 &rst
  ixpk= 1411, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1478,1479,1475,1476,
 &end
#
#    0 AMB  10-2:1413    89 LYS  HN          5.50    (#   1413:10  Single Ambig)
 &rst
  ixpk= 1413, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1462,1463,1462,1463,
 &end
#
#    0 AMB  10-2:1414    89 LYS  HN          5.50    (#   1414:10  Single Ambig)
 &rst
  ixpk= 1414, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1472,1473,1472,1473,
 &end
#
#   91 VAL  HA           89 LYS  HN          5.50    (#   1415:10  Unique         2.28, 2.82 A)
 &rst
  ixpk= 1415, nxpk= 10, iat=1487,1449, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   88 THR  HB           89 LYS  HN          3.50    (#   1416:10  Unique         1.83, 3.54 A)
 &rst
  ixpk= 1416, nxpk= 10, iat=1439,1449, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1417    89 LYS  HN          3.50    (#   1417:10  Single Ambig)
 &rst
  ixpk= 1417, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1437,1401,
 &end
#
#   89 LYS  HA           89 LYS  HN          3.50    (#   1419:10  Unique         2.27, 2.30 A)
 &rst
  ixpk= 1419, nxpk= 10, iat=1451,1449, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   88 THR  HN           89 LYS  HN          4.50    (#   1420:10  Unique         1.96, 2.46 A)
 &rst
  ixpk= 1420, nxpk= 10, iat=1435,1449, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   89 LYS  HG-          91 VAL  HN          5.50    (#   1423:10  Unique         3.94, 5.50 A)
 &rst
  ixpk= 1423, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1456,1457,
 &end
#
#    2 ILE  HG1-         91 VAL  HN          5.50    (#   1424:10  Unique         4.74, 6.36 A)
 &rst
  ixpk= 1424, nxpk= 10, iat=  -1,1485, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  31,  32,
 &end
#
#    0 AMB  10-2:1425     0 AMB  10-1:1425   5.50    (#   1425:10  Double Ambig)
 &rst
  ixpk= 1425, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1512,1423,
 igr2=1501,1375,
 &end
#
#    0 AMB  10-2:1426     0 AMB  10-1:1426   5.50    (#   1426:10  Double Ambig)
 &rst
  ixpk= 1426, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1531,1418,
 igr2=1501,1375,
 &end
#
#   91 VAL  HA           92 CYS  HN          3.50    (#   1428:10  Unique         2.16, 2.43 A)
 &rst
  ixpk= 1428, nxpk= 10, iat=1487,1501, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   92 CYS  HB-           0 AMB  10-1:1429   3.50    (#   1429:10  Single Ambig)
 &rst
  ixpk= 1429, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1505,1506,
 igr2=1375,1501,
 &end
#
#    0 AMB  10-2:1430     0 AMB  10-1:1430   3.50    (#   1430:10  Double Ambig)
 &rst
  ixpk= 1430, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1505,1506,1505,1506,
 igr2=1375,1501,
 &end
#
#   91 VAL  HB           92 CYS  HN          4.50    (#   1431:10  Unique         1.75, 3.63 A)
 &rst
  ixpk= 1431, nxpk= 10, iat=1489,1501, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1432    92 CYS  HN          5.50    (#   1432:10  Single Ambig)
 &rst
  ixpk= 1432, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1478,1479,1379,1380,
 &end
#
#    0 AMB  10-2:1433    92 CYS  HN          5.50    (#   1433:10  Single Ambig)
 &rst
  ixpk= 1433, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1382,1383,1363,
 &end
#
#   91 VAL  MGY          92 CYS  HN          3.50    (#   1434:10  Unique         1.94, 4.21 A)
 &rst
  ixpk= 1434, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#    0 AMB  10-2:1435    92 CYS  HN          4.50    (#   1435:10  Single Ambig)
 &rst
  ixpk= 1435, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1365,1366,1367,1369,1370,1371,  34,  35,  36,
 &end
#
#   93 ILE  QG2          92 CYS  HN          4.50    (#   1436:10  Unique         3.30, 5.47 A)
 &rst
  ixpk= 1436, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1518,1519,1520,
 &end
#
#   91 VAL  MGX          92 CYS  HN          3.50    (#   1437:10  Unique         1.94, 4.21 A)
 &rst
  ixpk= 1437, nxpk= 10, iat=  -1,1501, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   92 CYS  HN           93 ILE  HN          5.50    (#   1438:10  Unique         3.24, 4.07 A)
 &rst
  ixpk= 1438, nxpk= 10, iat=1501,1512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HN           93 ILE  HN          4.50    (#   1439:10  Unique         1.98, 2.50 A)
 &rst
  ixpk= 1439, nxpk= 10, iat=1531,1512, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 TYR  HA           93 ILE  HN          5.50    (#   1441:10  Unique         3.66, 4.12 A)
 &rst
  ixpk= 1441, nxpk= 10, iat=  85,1512, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   93 ILE  HA           93 ILE  HN          4.50    (#   1442:10  Unique         2.81, 2.91 A)
 &rst
  ixpk= 1442, nxpk= 10, iat=1514,1512, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 GLY  HA+          93 ILE  HN          5.50    (#   1443:10  Unique         1.83, 3.23 A)
 &rst
  ixpk= 1443, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#   94 GLY  HA-          93 ILE  HN          5.50    (#   1444:10  Unique         4.31, 4.87 A)
 &rst
  ixpk= 1444, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1533,1534,
 &end
#
#    6 GLY  HA-          93 ILE  HN          5.50    (#   1445:10  Unique         1.83, 3.23 A)
 &rst
  ixpk= 1445, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#   92 CYS  HB+          93 ILE  HN          5.50    (#   1446:10  Unique         3.57, 4.23 A)
 &rst
  ixpk= 1446, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1505,1506,
 &end
#
#   92 CYS  HB-          93 ILE  HN          5.50    (#   1447:10  Unique         3.57, 4.23 A)
 &rst
  ixpk= 1447, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1505,1506,
 &end
#
#    0 AMB  10-2:1448    93 ILE  HN          5.50    (#   1448:10  Single Ambig)
 &rst
  ixpk= 1448, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1516,1475,1476,
 &end
#
#   93 ILE  HG1-         93 ILE  HN          3.50    (#   1449:10  Unique         1.90, 2.78 A)
 &rst
  ixpk= 1449, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1522,1523,
 &end
#
#    0 AMB  10-2:1450    93 ILE  HN          3.50    (#   1450:10  Single Ambig)
 &rst
  ixpk= 1450, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1525,1526,1527,1522,1523,
 &end
#
#   91 VAL  MGX          93 ILE  HN          5.50    (#   1451:10  Unique         3.15, 5.71 A)
 &rst
  ixpk= 1451, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          93 ILE  HN          5.50    (#   1452:10  Unique         4.15, 5.73 A)
 &rst
  ixpk= 1452, nxpk= 10, iat=  -1,1512, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   84 VAL  MGX          94 GLY  HN          5.50    (#   1453:10  Unique         3.45, 5.59 A)
 &rst
  ixpk= 1453, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   79 LEU  MDY          94 GLY  HN          3.50    (#   1454:10  Unique         2.58, 4.92 A)
 &rst
  ixpk= 1454, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#   93 ILE  HG1-         94 GLY  HN          3.50    (#   1455:10  Unique         2.30, 3.80 A)
 &rst
  ixpk= 1455, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1522,1523,
 &end
#
#   79 LEU  MDX          94 GLY  HN          3.50    (#   1456:10  Unique         2.58, 4.92 A)
 &rst
  ixpk= 1456, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#    0 AMB  10-2:1457    94 GLY  HN          3.50    (#   1457:10  Single Ambig)
 &rst
  ixpk= 1457, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1525,1526,1527,1522,1523,
 &end
#
#   79 LEU  HB-          94 GLY  HN          5.50    (#   1458:10  Unique         3.67, 5.89 A)
 &rst
  ixpk= 1458, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1265,1266,
 &end
#
#   79 LEU  HG           94 GLY  HN          5.50    (#   1459:10  Unique         3.40, 3.95 A)
 &rst
  ixpk= 1459, nxpk= 10, iat=1268,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1460    94 GLY  HN          5.50    (#   1460:10  Single Ambig)
 &rst
  ixpk= 1460, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=  31,  32,1198,1199,1347,1559,1560,
 &end
#
#    0 AMB  10-2:1462    94 GLY  HN          4.50    (#   1462:10  Single Ambig)
 &rst
  ixpk= 1462, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1516,1304,1305,
 &end
#
#    0 AMB  10-2:1463    94 GLY  HN          5.50    (#   1463:10  Single Ambig)
 &rst
  ixpk= 1463, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 111, 112, 108, 109, 108, 109,1542,1543,
 &end
#
#    6 GLY  HA-          94 GLY  HN          5.50    (#   1465:10  Unique         2.97, 5.00 A)
 &rst
  ixpk= 1465, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#   94 GLY  HA-          94 GLY  HN          4.50    (#   1466:10  Unique         2.65, 2.80 A)
 &rst
  ixpk= 1466, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1533,1534,
 &end
#
#   94 GLY  HA+          94 GLY  HN          3.50    (#   1467:10  Unique         2.65, 2.80 A)
 &rst
  ixpk= 1467, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1533,1534,
 &end
#
#   93 ILE  HA           94 GLY  HN          3.50    (#   1468:10  Unique         2.91, 3.18 A)
 &rst
  ixpk= 1468, nxpk= 10, iat=1514,1531, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 TYR  HA           94 GLY  HN          5.50    (#   1469:10  Unique         2.70, 3.19 A)
 &rst
  ixpk= 1469, nxpk= 10, iat=  85,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   92 CYS  HA           94 GLY  HN          4.50    (#   1470:10  Unique         3.04, 3.32 A)
 &rst
  ixpk= 1470, nxpk= 10, iat=1503,1531, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   95 GLN  HA           94 GLY  HN          5.50    (#   1471:10  Unique         4.53, 4.63 A)
 &rst
  ixpk= 1471, nxpk= 10, iat=1540,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 TYR  HE           94 GLY  HN          5.50    (#   1472:10  Unique         3.12, 5.70 A)
 &rst
  ixpk= 1472, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#   79 LEU  HN           94 GLY  HN          5.50    (#   1475:10  Unique         4.07, 4.59 A)
 &rst
  ixpk= 1475, nxpk= 10, iat=1261,1531, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1476    94 GLY  HN          4.50    (#   1476:10  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 10, iat=  -1,1531, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1538,1501,1375,
 &end
#
#   93 ILE  HN           94 GLY  HN          3.50    (#   1478:10  Unique         1.98, 2.50 A)
 &rst
  ixpk= 1478, nxpk= 10, iat=1512,1531, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 TYR  HN           95 GLN  HN          5.50    (#   1479:10  Unique         2.26, 2.52 A)
 &rst
  ixpk= 1479, nxpk= 10, iat=1218,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 LYS  HN           95 GLN  HN          5.50    (#   1480:10  Unique         4.00, 4.11 A)
 &rst
  ixpk= 1480, nxpk= 10, iat=1555,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 LEU  HN           95 GLN  HN          5.50    (#   1481:10  Unique         4.77, 5.29 A)
 &rst
  ixpk= 1481, nxpk= 10, iat=1261,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HN           95 GLN  HN          5.50    (#   1482:10  Unique         4.12, 4.28 A)
 &rst
  ixpk= 1482, nxpk= 10, iat=1531,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    7 TYR  HD           95 GLN  HN          5.50    (#   1484:10  Unique         2.15, 4.48 A)
 &rst
  ixpk= 1484, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#    7 TYR  HE           95 GLN  HN          5.50    (#   1485:10  Unique         2.73, 5.02 A)
 &rst
  ixpk= 1485, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#    0 AMB  10-2:1486    95 GLN  HN          5.50    (#   1486:10  Single Ambig)
 &rst
  ixpk= 1486, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1540,1196,
 &end
#
#   78 LYS  HA           95 GLN  HN          5.50    (#   1487:10  Unique         4.53, 5.08 A)
 &rst
  ixpk= 1487, nxpk= 10, iat=1241,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   94 GLY  HA+          95 GLN  HN          4.50    (#   1488:10  Unique         2.19, 2.58 A)
 &rst
  ixpk= 1488, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1533,1534,
 &end
#
#   94 GLY  HA-          95 GLN  HN          4.50    (#   1489:10  Unique         2.19, 2.58 A)
 &rst
  ixpk= 1489, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1533,1534,
 &end
#
#   95 GLN  HG+          95 GLN  HN          5.50    (#   1490:10  Unique         2.89, 3.91 A)
 &rst
  ixpk= 1490, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1546,
 &end
#
#    0 AMB  10-2:1491    95 GLN  HN          5.50    (#   1491:10  Single Ambig)
 &rst
  ixpk= 1491, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1545,1546,1204,1205,
 &end
#
#   95 GLN  HB+          95 GLN  HN          5.50    (#   1492:10  Unique         2.68, 3.32 A)
 &rst
  ixpk= 1492, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1542,1543,
 &end
#
#   95 GLN  HB-          95 GLN  HN          5.50    (#   1493:10  Unique         2.68, 3.32 A)
 &rst
  ixpk= 1493, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1542,1543,
 &end
#
#   79 LEU  HG           95 GLN  HN          5.50    (#   1494:10  Unique         4.11, 5.09 A)
 &rst
  ixpk= 1494, nxpk= 10, iat=1268,1538, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   79 LEU  MDY          95 GLN  HN          5.50    (#   1495:10  Unique         3.11, 5.21 A)
 &rst
  ixpk= 1495, nxpk= 10, iat=  -1,1538, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1270,1271,1272,1274,1275,1276,
 &end
#
#   10 ASN  HD2+         96 LYS  HN          5.50    (#   1497:10  Unique         2.51, 3.78 A)
 &rst
  ixpk= 1497, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#  127 VAL  HN          126 TRP  HN          5.50    (#   1498:10  Unique         4.43, 4.53 A)
 &rst
  ixpk= 1498, nxpk= 10, iat=2062,2038, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HE2-        126 TRP  HN          5.50    (#   1499:10  Unique         5.75, 6.49 A)
 &rst
  ixpk= 1499, nxpk= 10, iat=  -1,2038, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 294, 295,
 &end
#
#   96 LYS  HD-          96 LYS  HN          5.50    (#   1500:10  Unique         3.66, 5.27 A)
 &rst
  ixpk= 1500, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1565,1566,
 &end
#
#    0 AMB  10-2:1501    96 LYS  HN          5.50    (#   1501:10  Single Ambig)
 &rst
  ixpk= 1501, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1=1562,1563,  27,  28,  29,1270,1271,1272,1274,1275,
      1276,
 &end
#
#   96 LYS  HB+          96 LYS  HN          5.50    (#   1502:10  Unique         2.26, 2.73 A)
 &rst
  ixpk= 1502, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1559,1560,
 &end
#
#   95 GLN  HB-          96 LYS  HN          5.50    (#   1503:10  Unique         2.13, 3.88 A)
 &rst
  ixpk= 1503, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1542,1543,
 &end
#
#    0 AMB  10-2:1504    96 LYS  HN          4.50    (#   1504:10  Single Ambig)
 &rst
  ixpk= 1504, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1542,1543, 111, 112, 108, 109,
 &end
#
#   95 GLN  HG+          96 LYS  HN          5.50    (#   1505:10  Unique         2.89, 4.66 A)
 &rst
  ixpk= 1505, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1545,1546,
 &end
#
#   10 ASN  HD2+         96 LYS  HN          5.50    (#   1506:10  Unique         2.51, 3.78 A)
 &rst
  ixpk= 1506, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#    7 TYR  HD           96 LYS  HN          5.50    (#   1507:10  Unique         4.56, 5.11 A)
 &rst
  ixpk= 1507, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  91, 100,
 &end
#
#   10 ASN  HD2-         96 LYS  HN          5.50    (#   1508:10  Unique         2.51, 3.78 A)
 &rst
  ixpk= 1508, nxpk= 10, iat=  -1,1555, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   10 ASN  HN           97 GLN  HN          5.50    (#   1510:10  Unique         4.51, 4.77 A)
 &rst
  ixpk= 1510, nxpk= 10, iat= 142,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 LEU  HN           97 GLN  HN          5.50    (#   1511:10  Unique         2.79, 3.46 A)
 &rst
  ixpk= 1511, nxpk= 10, iat=1175,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HN           97 GLN  HN          5.50    (#   1513:10  Unique         4.25, 4.36 A)
 &rst
  ixpk= 1513, nxpk= 10, iat=1594,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HD2+         97 GLN  HN          5.50    (#   1515:10  Unique         3.80, 5.62 A)
 &rst
  ixpk= 1515, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 151, 152,
 &end
#
#   99 TRP  HD1          97 GLN  HN          5.50    (#   1516:10  Unique         4.34, 5.04 A)
 &rst
  ixpk= 1516, nxpk= 10, iat=1624,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HA           97 GLN  HN          5.50    (#   1517:10  Unique         2.89, 2.91 A)
 &rst
  ixpk= 1517, nxpk= 10, iat=1579,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   96 LYS  HA           97 GLN  HN          4.50    (#   1518:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1518, nxpk= 10, iat=1557,1577, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1519    97 GLN  HN          5.50    (#   1519:10  Single Ambig)
 &rst
  ixpk= 1519, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1196, 138,
 &end
#
#   74 TRP  HA           97 GLN  HN          5.50    (#   1520:10  Unique         3.94, 4.34 A)
 &rst
  ixpk= 1520, nxpk= 10, iat=1153,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HB-          97 GLN  HN          5.50    (#   1521:10  Unique         3.15, 4.42 A)
 &rst
  ixpk= 1521, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#   74 TRP  HB+          97 GLN  HN          5.50    (#   1522:10  Unique         3.15, 4.42 A)
 &rst
  ixpk= 1522, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#    0 AMB  10-2:1523    97 GLN  HN          4.50    (#   1523:10  Single Ambig)
 &rst
  ixpk= 1523, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1204,1205,1581,1582,
 &end
#
#    0 AMB  10-2:1524    97 GLN  HN          5.50    (#   1524:10  Single Ambig)
 &rst
  ixpk= 1524, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1179,1180,1542,1543,
 &end
#
#   97 GLN  HB-          97 GLN  HN          4.50    (#   1525:10  Unique         2.87, 3.60 A)
 &rst
  ixpk= 1525, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#    0 AMB  10-2:1526    97 GLN  HN          5.50    (#   1526:10  Single Ambig)
 &rst
  ixpk= 1526, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1198,1199,1559,1560,
 &end
#
#   96 LYS  HB-          97 GLN  HN          5.50    (#   1527:10  Unique         4.18, 4.38 A)
 &rst
  ixpk= 1527, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1559,1560,
 &end
#
#    0 AMB  10-2:1528    97 GLN  HN          5.50    (#   1528:10  Single Ambig)
 &rst
  ixpk= 1528, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=1598,1599,2353,2354,2355,2357,2358,2359,2353,2354,
      2355,2357,2358,2359,
 &end
#
#    0 AMB  10-2:1529    97 GLN  HN          4.50    (#   1529:10  Single Ambig)
 &rst
  ixpk= 1529, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1201,1202,1565,1566,
 &end
#
#   97 GLN  HN           98 LYS  HN          5.50    (#   1530:10  Unique         4.25, 4.36 A)
 &rst
  ixpk= 1530, nxpk= 10, iat=1577,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   10 ASN  HN           98 LYS  HN          5.50    (#   1531:10  Unique         4.46, 4.91 A)
 &rst
  ixpk= 1531, nxpk= 10, iat= 142,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 VAL  HN           98 LYS  HN          5.50    (#   1532:10  Unique         4.43, 4.87 A)
 &rst
  ixpk= 1532, nxpk= 10, iat= 156,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HA           98 LYS  HN          4.50    (#   1535:10  Unique         2.18, 2.28 A)
 &rst
  ixpk= 1535, nxpk= 10, iat=1579,1594, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1536    98 LYS  HN          5.50    (#   1536:10  Single Ambig)
 &rst
  ixpk= 1536, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 144, 138,
 &end
#
#   11 VAL  HA           98 LYS  HN          5.50    (#   1537:10  Unique         1.89, 2.21 A)
 &rst
  ixpk= 1537, nxpk= 10, iat= 158,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HA           98 LYS  HN          5.50    (#   1538:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 1538, nxpk= 10, iat=1596,1594, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   97 GLN  HB+          98 LYS  HN          5.50    (#   1539:10  Unique         2.54, 3.31 A)
 &rst
  ixpk= 1539, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#   97 GLN  HB-          98 LYS  HN          5.50    (#   1541:10  Unique         2.54, 3.31 A)
 &rst
  ixpk= 1541, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1581,1582,
 &end
#
#   98 LYS  HB+          98 LYS  HN          5.50    (#   1542:10  Unique         2.32, 3.01 A)
 &rst
  ixpk= 1542, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#   11 VAL  MGY          98 LYS  HN          5.50    (#   1543:10  Unique         2.34, 4.81 A)
 &rst
  ixpk= 1543, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  10-2:1544    98 LYS  HN          5.50    (#   1544:10  Single Ambig)
 &rst
  ixpk= 1544, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1601,1602, 162, 163, 164, 166, 167, 168,
 &end
#
#   98 LYS  HB-          98 LYS  HN          5.50    (#   1545:10  Unique         2.32, 3.01 A)
 &rst
  ixpk= 1545, nxpk= 10, iat=  -1,1594, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#    0 AMB  10-2:1546    99 TRP  HN          5.50    (#   1546:10  Single Ambig)
 &rst
  ixpk= 1546, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1099,1640,
 &end
#
#   99 TRP  HD1          99 TRP  HN          4.50    (#   1549:10  Unique         1.93, 2.17 A)
 &rst
  ixpk= 1549, nxpk= 10, iat=1624,1616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HA           99 TRP  HN          5.50    (#   1550:10  Unique         2.81, 2.87 A)
 &rst
  ixpk= 1550, nxpk= 10, iat=1618,1616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HB           99 TRP  HN          5.50    (#   1552:10  Unique         2.26, 3.67 A)
 &rst
  ixpk= 1552, nxpk= 10, iat=1103,1616, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   98 LYS  HA           99 TRP  HN          4.50    (#   1553:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1553, nxpk= 10, iat=1596,1616, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HB+          99 TRP  HN          5.50    (#   1554:10  Unique         2.25, 3.05 A)
 &rst
  ixpk= 1554, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#   99 TRP  HB-          99 TRP  HN          5.50    (#   1555:10  Unique         2.25, 3.05 A)
 &rst
  ixpk= 1555, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#    0 AMB  10-2:1556    99 TRP  HN          5.50    (#   1556:10  Single Ambig)
 &rst
  ixpk= 1556, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#   71 THR  MG2          99 TRP  HN          3.50    (#   1557:10  Unique         1.94, 3.43 A)
 &rst
  ixpk= 1557, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1105,1106,1107,
 &end
#
#   98 LYS  HG-          99 TRP  HN          5.50    (#   1558:10  Unique         3.00, 4.35 A)
 &rst
  ixpk= 1558, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1601,1602,
 &end
#
#   98 LYS  HB-          99 TRP  HN          5.50    (#   1559:10  Unique         3.05, 4.14 A)
 &rst
  ixpk= 1559, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1598,1599,
 &end
#
#   98 LYS  HG+          99 TRP  HN          5.50    (#   1560:10  Unique         3.00, 4.35 A)
 &rst
  ixpk= 1560, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1601,1602,
 &end
#
#  147 VAL  MGX          99 TRP  HN          5.50    (#   1561:10  Unique         4.48, 6.33 A)
 &rst
  ixpk= 1561, nxpk= 10, iat=  -1,1616, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#   14 VAL  HN          100 PHE  HN          5.50    (#   1562:10  Unique         3.63, 3.99 A)
 &rst
  ixpk= 1562, nxpk= 10, iat= 198,1640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HN          100 PHE  HN          5.50    (#   1563:10  Unique         4.24, 4.41 A)
 &rst
  ixpk= 1563, nxpk= 10, iat=1660,1640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   12 GLY  HN          100 PHE  HN          5.50    (#   1564:10  Unique         4.01, 4.55 A)
 &rst
  ixpk= 1564, nxpk= 10, iat= 172,1640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HE3         100 PHE  HN          5.50    (#   1565:10  Unique         4.41, 4.83 A)
 &rst
  ixpk= 1565, nxpk= 10, iat=1635,1640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HA          100 PHE  HN          4.50    (#   1569:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1569, nxpk= 10, iat=1618,1640, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 ILE  HA          100 PHE  HN          5.50    (#   1571:10  Unique         3.30, 3.81 A)
 &rst
  ixpk= 1571, nxpk= 10, iat= 181,1640, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   99 TRP  HB+         100 PHE  HN          5.50    (#   1572:10  Unique         3.19, 3.98 A)
 &rst
  ixpk= 1572, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#   99 TRP  HB-         100 PHE  HN          5.50    (#   1573:10  Unique         3.19, 3.98 A)
 &rst
  ixpk= 1573, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1620,1621,
 &end
#
#    0 AMB  10-2:1574   100 PHE  HN          4.50    (#   1574:10  Single Ambig)
 &rst
  ixpk= 1574, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1644,1645,1644,1645,
 &end
#
#   50 MET  HG-         100 PHE  HN          5.50    (#   1575:10  Unique         3.29, 4.39 A)
 &rst
  ixpk= 1575, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 755, 756,
 &end
#
#   11 VAL  MGY         100 PHE  HN          5.50    (#   1576:10  Unique         4.47, 7.44 A)
 &rst
  ixpk= 1576, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 162, 163, 164, 166, 167, 168,
 &end
#
#    0 AMB  10-2:1577   100 PHE  HN          4.50    (#   1577:10  Single Ambig)
 &rst
  ixpk= 1577, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 174, 175,1604,1605, 185, 186, 187,
 &end
#
#    0 AMB  10-2:1578   100 PHE  HN          4.50    (#   1578:10  Single Ambig)
 &rst
  ixpk= 1578, nxpk= 10, iat=  -1,1640, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1=1601,1602, 192, 193, 194, 162, 163, 164, 166, 167,
       168,
 &end
#
#  101 LEU  HB-         101 LEU  HN          5.50    (#   1579:10  Unique         2.20, 2.58 A)
 &rst
  ixpk= 1579, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1664,1665,
 &end
#
#    0 AMB  10-2:1580   101 LEU  HN          4.50    (#   1580:10  Single Ambig)
 &rst
  ixpk= 1580, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 204, 205, 206, 208, 209, 210, 759, 760, 761,
 &end
#
#  101 LEU  MDX         101 LEU  HN          4.50    (#   1581:10  Unique         3.76, 5.13 A)
 &rst
  ixpk= 1581, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  102 LEU  MDY         101 LEU  HN          4.50    (#   1582:10  Unique         3.56, 6.39 A)
 &rst
  ixpk= 1582, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1688,1689,1690,1692,1693,1694,
 &end
#
#  101 LEU  HB+         101 LEU  HN          4.50    (#   1583:10  Unique         2.20, 2.58 A)
 &rst
  ixpk= 1583, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1664,1665,
 &end
#
#   69 ALA  MB          101 LEU  HN          5.50    (#   1584:10  Unique         2.52, 4.17 A)
 &rst
  ixpk= 1584, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1082,1083,1084,
 &end
#
#   14 VAL  HB          101 LEU  HN          5.50    (#   1586:10  Unique         3.75, 4.39 A)
 &rst
  ixpk= 1586, nxpk= 10, iat= 202,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1587   101 LEU  HN          5.50    (#   1587:10  Single Ambig)
 &rst
  ixpk= 1587, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1644,1645,1644,1645,
 &end
#
#   70 SER  HB-         101 LEU  HN          5.50    (#   1588:10  Unique         3.55, 4.90 A)
 &rst
  ixpk= 1588, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#   70 SER  HB+         101 LEU  HN          5.50    (#   1589:10  Unique         3.55, 4.90 A)
 &rst
  ixpk= 1589, nxpk= 10, iat=  -1,1660, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1092,1093,
 &end
#
#   69 ALA  HA          101 LEU  HN          5.50    (#   1590:10  Unique         4.52, 4.87 A)
 &rst
  ixpk= 1590, nxpk= 10, iat=1080,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HA          101 LEU  HN          5.50    (#   1592:10  Unique         2.85, 2.89 A)
 &rst
  ixpk= 1592, nxpk= 10, iat=1662,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   70 SER  HA          101 LEU  HN          5.50    (#   1593:10  Unique         2.05, 2.86 A)
 &rst
  ixpk= 1593, nxpk= 10, iat=1090,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 ALA  HN          101 LEU  HN          5.50    (#   1596:10  Unique         3.07, 3.71 A)
 &rst
  ixpk= 1596, nxpk= 10, iat=1078,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   71 THR  HN          101 LEU  HN          5.50    (#   1597:10  Unique         3.94, 4.36 A)
 &rst
  ixpk= 1597, nxpk= 10, iat=1099,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HN          101 LEU  HN          5.50    (#   1599:10  Unique         3.99, 4.23 A)
 &rst
  ixpk= 1599, nxpk= 10, iat=1679,1660, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN          102 LEU  HN          5.50    (#   1600:10  Unique         3.07, 3.97 A)
 &rst
  ixpk= 1600, nxpk= 10, iat= 233,1679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 LEU  HN          102 LEU  HN          5.50    (#   1601:10  Unique         4.76, 5.10 A)
 &rst
  ixpk= 1601, nxpk= 10, iat=1059,1679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1602   102 LEU  HN          5.50    (#   1602:10  Single Ambig)
 &rst
  ixpk= 1602, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 198,1698,
 &end
#
#  101 LEU  HN          102 LEU  HN          5.50    (#   1603:10  Unique         3.99, 4.23 A)
 &rst
  ixpk= 1603, nxpk= 10, iat=1660,1679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HA          102 LEU  HN          5.50    (#   1605:10  Unique         2.89, 2.92 A)
 &rst
  ixpk= 1605, nxpk= 10, iat=1681,1679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  101 LEU  HA          102 LEU  HN          3.50    (#   1606:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 1606, nxpk= 10, iat=1662,1679, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 VAL  HB          102 LEU  HN          5.50    (#   1607:10  Unique         2.80, 3.17 A)
 &rst
  ixpk= 1607, nxpk= 10, iat= 202,1679, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1608   102 LEU  HN          5.50    (#   1608:10  Single Ambig)
 &rst
  ixpk= 1608, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 218,1702,1703,1722,
 &end
#
#  102 LEU  HB+         102 LEU  HN          4.50    (#   1609:10  Unique         2.12, 2.98 A)
 &rst
  ixpk= 1609, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1683,1684,
 &end
#
#    0 AMB  10-2:1610   102 LEU  HN          5.50    (#   1610:10  Single Ambig)
 &rst
  ixpk= 1610, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1= 755, 756,1023,1024, 824, 825, 183,
 &end
#
#  102 LEU  HB-         102 LEU  HN          5.50    (#   1611:10  Unique         2.12, 2.98 A)
 &rst
  ixpk= 1611, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#    0 AMB  10-2:1612   102 LEU  HN          4.50    (#   1612:10  Single Ambig)
 &rst
  ixpk= 1612, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1664,1665,1068,1069,1070,1072,1073,1074,
 &end
#
#  101 LEU  MDX         102 LEU  HN          3.50    (#   1613:10  Unique         1.94, 4.57 A)
 &rst
  ixpk= 1613, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#    0 AMB  10-2:1614   102 LEU  HN          4.50    (#   1614:10  Single Ambig)
 &rst
  ixpk= 1614, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 227, 228, 229,1068,1069,1070,1072,1073,1074,
 &end
#
#  101 LEU  HB-         102 LEU  HN          5.50    (#   1615:10  Unique         3.75, 4.38 A)
 &rst
  ixpk= 1615, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1664,1665,
 &end
#
#    0 AMB  10-2:1616   103 GLN  HN          4.50    (#   1616:10  Single Ambig)
 &rst
  ixpk= 1616, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#   68 LEU  MDX         103 GLN  HN          4.50    (#   1617:10  Unique         1.99, 6.18 A)
 &rst
  ixpk= 1617, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#  102 LEU  MDX         103 GLN  HN          2.80    (#   1618:10  Unique         2.22, 5.00 A)
 &rst
  ixpk= 1618, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1688,1689,1690,1692,1693,1694,
 &end
#
#  102 LEU  HB-         103 GLN  HN          5.50    (#   1619:10  Unique         2.58, 3.62 A)
 &rst
  ixpk= 1619, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1683,1684,
 &end
#
#   66 ARG  HG+         103 GLN  HN          3.50    (#   1620:10  Unique         3.07, 4.17 A)
 &rst
  ixpk= 1620, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1023,1024,
 &end
#
#   66 ARG  HB+         103 GLN  HN          3.50    (#   1622:10  Unique         2.63, 3.84 A)
 &rst
  ixpk= 1622, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1020,1021,
 &end
#
#    0 AMB  10-2:1623   103 GLN  HN          4.50    (#   1623:10  Single Ambig)
 &rst
  ixpk= 1623, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1705,1706,1705,1706,
 &end
#
#    0 AMB  10-2:1624   103 GLN  HN          5.50    (#   1624:10  Single Ambig)
 &rst
  ixpk= 1624, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 237, 238,1026,1027,1026,1027,
 &end
#
#   67 ILE  HA          103 GLN  HN          5.50    (#   1625:10  Unique         3.64, 3.87 A)
 &rst
  ixpk= 1625, nxpk= 10, iat=1042,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1626   103 GLN  HN          5.50    (#   1626:10  Single Ambig)
 &rst
  ixpk= 1626, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1061,1736,
 &end
#
#  103 GLN  HA          103 GLN  HN          5.50    (#   1628:10  Unique         2.90, 2.92 A)
 &rst
  ixpk= 1628, nxpk= 10, iat=1700,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HA          103 GLN  HN          4.50    (#   1629:10  Unique         2.16, 2.21 A)
 &rst
  ixpk= 1629, nxpk= 10, iat=1681,1698, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HA          103 GLN  HN          5.50    (#   1630:10  Unique         4.35, 4.80 A)
 &rst
  ixpk= 1630, nxpk= 10, iat=1002,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HE2+        103 GLN  HN          5.50    (#   1631:10  Unique         3.48, 4.97 A)
 &rst
  ixpk= 1631, nxpk= 10, iat=  -1,1698, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   66 ARG  HN          103 GLN  HN          5.50    (#   1633:10  Unique         2.16, 2.69 A)
 &rst
  ixpk= 1633, nxpk= 10, iat=1016,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HN          103 GLN  HN          5.50    (#   1634:10  Unique         4.39, 4.49 A)
 &rst
  ixpk= 1634, nxpk= 10, iat=1715,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   68 LEU  HN          103 GLN  HN          5.50    (#   1635:10  Unique         3.46, 3.77 A)
 &rst
  ixpk= 1635, nxpk= 10, iat=1059,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN          103 GLN  HN          5.50    (#   1636:10  Unique         4.60, 4.95 A)
 &rst
  ixpk= 1636, nxpk= 10, iat= 233,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  102 LEU  HN          103 GLN  HN          5.50    (#   1637:10  Unique         4.33, 4.51 A)
 &rst
  ixpk= 1637, nxpk= 10, iat=1679,1698, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 CYS  HN          104 LEU  HN          5.50    (#   1638:10  Unique         2.51, 3.63 A)
 &rst
  ixpk= 1638, nxpk= 10, iat= 233,1715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HN          104 LEU  HN          5.50    (#   1639:10  Unique         4.39, 4.49 A)
 &rst
  ixpk= 1639, nxpk= 10, iat=1698,1715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  105 VAL  HN          104 LEU  HN          5.50    (#   1640:10  Unique         4.09, 4.33 A)
 &rst
  ixpk= 1640, nxpk= 10, iat=1734,1715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1641   104 LEU  HN          5.50    (#   1641:10  Single Ambig)
 &rst
  ixpk= 1641, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1016,1761,
 &end
#
#  103 GLN  HE2+        104 LEU  HN          5.50    (#   1642:10  Unique         3.26, 4.65 A)
 &rst
  ixpk= 1642, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1710,1711,
 &end
#
#   17 ASN  HD2+        104 LEU  HN          5.50    (#   1643:10  Unique         4.41, 6.06 A)
 &rst
  ixpk= 1643, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#  103 GLN  HA          104 LEU  HN          3.50    (#   1644:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1644, nxpk= 10, iat=1700,1715, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   17 ASN  HA          104 LEU  HN          5.50    (#   1645:10  Unique         2.59, 3.43 A)
 &rst
  ixpk= 1645, nxpk= 10, iat= 246,1715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HA          104 LEU  HN          5.50    (#   1646:10  Unique         2.77, 2.83 A)
 &rst
  ixpk= 1646, nxpk= 10, iat=1717,1715, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 ASN  HB+         104 LEU  HN          5.50    (#   1647:10  Unique         4.03, 5.84 A)
 &rst
  ixpk= 1647, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 248, 249,
 &end
#
#    0 AMB  10-2:1649   104 LEU  HN          3.50    (#   1649:10  Single Ambig)
 &rst
  ixpk= 1649, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1702,1703,1722,
 &end
#
#   18 ARG  HG-         104 LEU  HN          5.50    (#   1650:10  Unique         3.54, 5.52 A)
 &rst
  ixpk= 1650, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 265, 266,
 &end
#
#  104 LEU  HB-         104 LEU  HN          4.50    (#   1651:10  Unique         2.05, 2.55 A)
 &rst
  ixpk= 1651, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1719,1720,
 &end
#
#    0 AMB  10-2:1652   104 LEU  HN          5.50    (#   1652:10  Single Ambig)
 &rst
  ixpk= 1652, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
 igr1=2565,2566,2567,2569,2570,2571,1667,2549,2550,2551,
      2553,2554,2555,
 &end
#
#   15 ILE  QG2         104 LEU  HN          3.50    (#   1653:10  Unique         2.79, 4.24 A)
 &rst
  ixpk= 1653, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 220, 221, 222,
 &end
#
#    0 AMB  10-2:1654   104 LEU  HN          4.50    (#   1654:10  Single Ambig)
 &rst
  ixpk= 1654, nxpk= 10, iat=  -1,1715, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 227, 228, 229,1740,1741,1742,1744,1745,1746,2612,
      2613,2614,2616,2617,2618,
 &end
#
#  104 LEU  HN          105 VAL  HN          5.50    (#   1655:10  Unique         4.09, 4.33 A)
 &rst
  ixpk= 1655, nxpk= 10, iat=1715,1734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HN          105 VAL  HN          4.50    (#   1656:10  Unique         1.99, 2.34 A)
 &rst
  ixpk= 1656, nxpk= 10, iat=1750,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HA          105 VAL  HN          5.50    (#   1657:10  Unique         2.53, 2.96 A)
 &rst
  ixpk= 1657, nxpk= 10, iat=1002,1734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HA          105 VAL  HN          4.50    (#   1658:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 1658, nxpk= 10, iat=1717,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 VAL  HA          105 VAL  HN          4.50    (#   1659:10  Unique         2.86, 2.91 A)
 &rst
  ixpk= 1659, nxpk= 10, iat=1736,1734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 SER  HB+         105 VAL  HN          5.50    (#   1660:10  Unique         3.67, 5.02 A)
 &rst
  ixpk= 1660, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1754,1755,
 &end
#
#    0 AMB  10-2:1661   105 VAL  HN          4.50    (#   1661:10  Single Ambig)
 &rst
  ixpk= 1661, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1738,1719,1720,
 &end
#
#   65 VAL  HB          105 VAL  HN          5.50    (#   1662:10  Unique         4.49, 5.07 A)
 &rst
  ixpk= 1662, nxpk= 10, iat=1004,1734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HG          105 VAL  HN          5.50    (#   1663:10  Unique         2.71, 3.86 A)
 &rst
  ixpk= 1663, nxpk= 10, iat=1722,1734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  104 LEU  HB-         105 VAL  HN          5.50    (#   1664:10  Unique         3.67, 4.37 A)
 &rst
  ixpk= 1664, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1719,1720,
 &end
#
#   60 LEU  MDX         105 VAL  HN          5.50    (#   1665:10  Unique         3.51, 5.77 A)
 &rst
  ixpk= 1665, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#  105 VAL  MGX         105 VAL  HN          3.50    (#   1666:10  Unique         1.98, 3.73 A)
 &rst
  ixpk= 1666, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  104 LEU  MDX         105 VAL  HN          3.50    (#   1667:10  Unique         2.20, 4.99 A)
 &rst
  ixpk= 1667, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  105 VAL  MGY         105 VAL  HN          3.50    (#   1668:10  Unique         1.98, 3.73 A)
 &rst
  ixpk= 1668, nxpk= 10, iat=  -1,1734, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#  105 VAL  HN          106 SER  HN          3.50    (#   1669:10  Unique         1.99, 2.34 A)
 &rst
  ixpk= 1669, nxpk= 10, iat=1734,1750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 GLY  HN          106 SER  HN          4.50    (#   1671:10  Unique         2.55, 2.84 A)
 &rst
  ixpk= 1671, nxpk= 10, iat=1761,1750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HA          106 SER  HN          5.50    (#   1674:10  Unique         4.39, 4.84 A)
 &rst
  ixpk= 1674, nxpk= 10, iat=1002,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HA          106 SER  HN          3.50    (#   1675:10  Unique         2.79, 2.92 A)
 &rst
  ixpk= 1675, nxpk= 10, iat=1752,1750, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  105 VAL  HA          106 SER  HN          4.50    (#   1676:10  Unique         2.76, 3.33 A)
 &rst
  ixpk= 1676, nxpk= 10, iat=1736,1750, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 SER  HB+         106 SER  HN          4.50    (#   1677:10  Unique         2.13, 3.09 A)
 &rst
  ixpk= 1677, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1754,1755,
 &end
#
#  106 SER  HB-         106 SER  HN          4.50    (#   1678:10  Unique         2.13, 3.09 A)
 &rst
  ixpk= 1678, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1754,1755,
 &end
#
#    0 AMB  10-2:1679   106 SER  HN          5.50    (#   1679:10  Single Ambig)
 &rst
  ixpk= 1679, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 992, 993, 992, 993,
 &end
#
#    0 AMB  10-2:1680   106 SER  HN          3.50    (#   1680:10  Single Ambig)
 &rst
  ixpk= 1680, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1738,1719,1720,
 &end
#
#  104 LEU  HG          106 SER  HN          5.50    (#   1682:10  Unique         1.93, 3.13 A)
 &rst
  ixpk= 1682, nxpk= 10, iat=1722,1750, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1683   106 SER  HN          5.50    (#   1683:10  Single Ambig)
 &rst
  ixpk= 1683, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 916, 917,1784,1785,1786, 919, 248, 249,
 &end
#
#  104 LEU  HB-         106 SER  HN          5.50    (#   1684:10  Unique         3.09, 4.66 A)
 &rst
  ixpk= 1684, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1719,1720,
 &end
#
#  105 VAL  MGY         106 SER  HN          3.50    (#   1685:10  Unique         2.18, 4.81 A)
 &rst
  ixpk= 1685, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  10-2:1686   106 SER  HN          3.50    (#   1686:10  Single Ambig)
 &rst
  ixpk= 1686, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1006,1007,1008,1010,1011,1012, 220, 221, 222,
 &end
#
#  105 VAL  MGX         106 SER  HN          3.50    (#   1687:10  Unique         2.18, 4.81 A)
 &rst
  ixpk= 1687, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1740,1741,1742,1744,1745,1746,
 &end
#
#    0 AMB  10-2:1688   106 SER  HN          5.50    (#   1688:10  Single Ambig)
 &rst
  ixpk= 1688, nxpk= 10, iat=  -1,1750, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  105 VAL  HN          107 GLY  HN          5.50    (#   1689:10  Unique         4.32, 4.84 A)
 &rst
  ixpk= 1689, nxpk= 10, iat=1734,1761, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 GLU  HN          107 GLY  HN          5.50    (#   1691:10  Unique         3.57, 4.16 A)
 &rst
  ixpk= 1691, nxpk= 10, iat=1790,1761, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  106 SER  HN          107 GLY  HN          4.50    (#   1692:10  Unique         2.55, 2.84 A)
 &rst
  ixpk= 1692, nxpk= 10, iat=1750,1761, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 SER  HA          107 GLY  HN          3.50    (#   1693:10  Unique         2.19, 3.42 A)
 &rst
  ixpk= 1693, nxpk= 10, iat=1752,1761, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  107 GLY  HA+         107 GLY  HN          2.80    (#   1695:10  Unique         2.30, 2.73 A)
 &rst
  ixpk= 1695, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1763,1764,
 &end
#
#    0 AMB  10-2:1696   107 GLY  HN          2.80    (#   1696:10  Single Ambig)
 &rst
  ixpk= 1696, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1754,1755,1763,1764,
 &end
#
#  106 SER  HB-         107 GLY  HN          3.50    (#   1697:10  Unique         1.95, 2.66 A)
 &rst
  ixpk= 1697, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1754,1755,
 &end
#
#    0 AMB  10-2:1698   107 GLY  HN          5.50    (#   1698:10  Single Ambig)
 &rst
  ixpk= 1698, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1772,1773,1772,1773,
 &end
#
#  110 GLU  HG+         107 GLY  HN          5.50    (#   1699:10  Unique         3.50, 5.24 A)
 &rst
  ixpk= 1699, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#  110 GLU  HG-         107 GLY  HN          5.50    (#   1700:10  Unique         3.50, 5.24 A)
 &rst
  ixpk= 1700, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#    0 AMB  10-2:1701   107 GLY  HN          5.50    (#   1701:10  Single Ambig)
 &rst
  ixpk= 1701, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1794,1795,1719,1720,
 &end
#
#  109 ALA  MB          107 GLY  HN          5.50    (#   1703:10  Unique         3.60, 6.64 A)
 &rst
  ixpk= 1703, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1784,1785,1786,
 &end
#
#  104 LEU  MDX         107 GLY  HN          4.50    (#   1705:10  Unique         1.95, 3.51 A)
 &rst
  ixpk= 1705, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#    0 AMB  10-2:1707   107 GLY  HN          5.50    (#   1707:10  Single Ambig)
 &rst
  ixpk= 1707, nxpk= 10, iat=  -1,1761, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  126 TRP  HE1         108 ASP  HN          5.50    (#   1708:10  Unique         3.19, 4.05 A)
 &rst
  ixpk= 1708, nxpk= 10, iat=2048,1768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 ALA  HN          108 ASP  HN          3.50    (#   1709:10  Unique         2.68, 2.77 A)
 &rst
  ixpk= 1709, nxpk= 10, iat=1780,1768, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 GLU  HN          108 ASP  HN          5.50    (#   1710:10  Unique         4.19, 4.37 A)
 &rst
  ixpk= 1710, nxpk= 10, iat=1790,1768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HZ2         108 ASP  HN          5.50    (#   1711:10  Unique         3.00, 3.44 A)
 &rst
  ixpk= 1711, nxpk= 10, iat=2051,1768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  111 ILE  HN          108 ASP  HN          5.50    (#   1713:10  Unique         4.46, 4.67 A)
 &rst
  ixpk= 1713, nxpk= 10, iat=1805,1768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HH2         108 ASP  HN          5.50    (#   1714:10  Unique         4.96, 5.50 A)
 &rst
  ixpk= 1714, nxpk= 10, iat=2053,1768, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 ASP  HA          108 ASP  HN          2.80    (#   1716:10  Unique         2.72, 2.76 A)
 &rst
  ixpk= 1716, nxpk= 10, iat=1770,1768, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  107 GLY  HA+         108 ASP  HN          2.80    (#   1717:10  Unique         2.14, 2.62 A)
 &rst
  ixpk= 1717, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1763,1764,
 &end
#
#  107 GLY  HA-         108 ASP  HN          2.80    (#   1718:10  Unique         2.14, 2.62 A)
 &rst
  ixpk= 1718, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1763,1764,
 &end
#
#    0 AMB  10-2:1720   108 ASP  HN          2.80    (#   1720:10  Single Ambig)
 &rst
  ixpk= 1720, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1772,1773,1772,1773,
 &end
#
#    0 AMB  10-2:1722   108 ASP  HN          5.50    (#   1722:10  Single Ambig)
 &rst
  ixpk= 1722, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 248, 249,1784,1785,1786,
 &end
#
#  104 LEU  MDY         108 ASP  HN          4.50    (#   1723:10  Unique         2.03, 4.65 A)
 &rst
  ixpk= 1723, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  QG2         108 ASP  HN          5.50    (#   1724:10  Unique         5.41, 6.76 A)
 &rst
  ixpk= 1724, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  QD1         108 ASP  HN          5.50    (#   1725:10  Unique         3.12, 4.60 A)
 &rst
  ixpk= 1725, nxpk= 10, iat=  -1,1768, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  108 ASP  HN          109 ALA  HN          3.50    (#   1726:10  Unique         2.68, 2.77 A)
 &rst
  ixpk= 1726, nxpk= 10, iat=1768,1780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 GLU  HN          109 ALA  HN          3.50    (#   1727:10  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1727, nxpk= 10, iat=1790,1780, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  111 ILE  HN          109 ALA  HN          5.50    (#   1729:10  Unique         3.37, 3.83 A)
 &rst
  ixpk= 1729, nxpk= 10, iat=1805,1780, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1730   109 ALA  HN          2.80    (#   1730:10  Single Ambig)
 &rst
  ixpk= 1730, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1782,1770,
 &end
#
#  110 GLU  HA          109 ALA  HN          5.50    (#   1731:10  Unique         4.92, 5.26 A)
 &rst
  ixpk= 1731, nxpk= 10, iat=1792,1780, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1732   109 ALA  HN          3.50    (#   1732:10  Single Ambig)
 &rst
  ixpk= 1732, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1772,1773,1772,1773,
 &end
#
#  110 GLU  HG-         109 ALA  HN          5.50    (#   1733:10  Unique         4.50, 5.68 A)
 &rst
  ixpk= 1733, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#  110 GLU  HB+         109 ALA  HN          5.50    (#   1734:10  Unique         4.36, 5.47 A)
 &rst
  ixpk= 1734, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1794,1795,
 &end
#
#  110 GLU  HB-         109 ALA  HN          5.50    (#   1735:10  Unique         4.36, 5.47 A)
 &rst
  ixpk= 1735, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1794,1795,
 &end
#
#  109 ALA  MB          109 ALA  HN          2.80    (#   1736:10  Unique         2.07, 2.89 A)
 &rst
  ixpk= 1736, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1784,1785,1786,
 &end
#
#  104 LEU  MDY         109 ALA  HN          5.50    (#   1737:10  Unique         4.61, 6.60 A)
 &rst
  ixpk= 1737, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  QD1         109 ALA  HN          5.50    (#   1738:10  Unique         4.39, 5.94 A)
 &rst
  ixpk= 1738, nxpk= 10, iat=  -1,1780, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  108 ASP  HN          110 GLU  HN          5.50    (#   1739:10  Unique         4.19, 4.37 A)
 &rst
  ixpk= 1739, nxpk= 10, iat=1768,1790, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 ALA  HN          110 GLU  HN          3.50    (#   1740:10  Unique         2.28, 2.63 A)
 &rst
  ixpk= 1740, nxpk= 10, iat=1780,1790, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  111 ILE  HN          110 GLU  HN          3.50    (#   1741:10  Unique         2.07, 2.20 A)
 &rst
  ixpk= 1741, nxpk= 10, iat=1805,1790, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1742   110 GLU  HN          3.50    (#   1742:10  Single Ambig)
 &rst
  ixpk= 1742, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1782,1770,
 &end
#
#  110 GLU  HA          110 GLU  HN          2.80    (#   1743:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 1743, nxpk= 10, iat=1792,1790, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  111 ILE  HA          110 GLU  HN          5.50    (#   1744:10  Unique         4.51, 4.70 A)
 &rst
  ixpk= 1744, nxpk= 10, iat=1807,1790, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1745   110 GLU  HN          5.50    (#   1745:10  Single Ambig)
 &rst
  ixpk= 1745, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1772,1773,1772,1773,
 &end
#
#  110 GLU  HG+         110 GLU  HN          3.50    (#   1746:10  Unique         2.31, 3.52 A)
 &rst
  ixpk= 1746, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1797,1798,
 &end
#
#  110 GLU  HG-         110 GLU  HN          3.50    (#   1747:10  Unique         2.31, 3.52 A)
 &rst
  ixpk= 1747, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1797,1798,
 &end
#
#  110 GLU  HB+         110 GLU  HN          3.50    (#   1748:10  Unique         2.19, 2.97 A)
 &rst
  ixpk= 1748, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1794,1795,
 &end
#
#  110 GLU  HB-         110 GLU  HN          3.50    (#   1749:10  Unique         2.19, 2.97 A)
 &rst
  ixpk= 1749, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1794,1795,
 &end
#
#  109 ALA  MB          110 GLU  HN          3.50    (#   1750:10  Unique         2.59, 3.54 A)
 &rst
  ixpk= 1750, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1784,1785,1786,
 &end
#
#  111 ILE  HG1-        110 GLU  HN          5.50    (#   1751:10  Unique         3.39, 5.28 A)
 &rst
  ixpk= 1751, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  10-2:1753   110 GLU  HN          4.50    (#   1753:10  Single Ambig)
 &rst
  ixpk= 1753, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  111 ILE  QG2         110 GLU  HN          5.50    (#   1754:10  Unique         5.17, 6.38 A)
 &rst
  ixpk= 1754, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  QD1         110 GLU  HN          5.50    (#   1755:10  Unique         3.64, 5.61 A)
 &rst
  ixpk= 1755, nxpk= 10, iat=  -1,1790, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QD1         111 ILE  HN          4.50    (#   1756:10  Unique         2.24, 4.18 A)
 &rst
  ixpk= 1756, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  QG2         111 ILE  HN          4.50    (#   1757:10  Unique         3.12, 4.31 A)
 &rst
  ixpk= 1757, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  HG1+        111 ILE  HN          5.50    (#   1758:10  Unique         1.88, 3.51 A)
 &rst
  ixpk= 1758, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  10-2:1759   111 ILE  HN          5.50    (#   1759:10  Single Ambig)
 &rst
  ixpk= 1759, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  10-2:1760   111 ILE  HN          5.50    (#   1760:10  Single Ambig)
 &rst
  ixpk= 1760, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#  104 LEU  MDY         111 ILE  HN          5.50    (#   1761:10  Unique         4.39, 6.44 A)
 &rst
  ixpk= 1761, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  HG1-        111 ILE  HN          4.50    (#   1762:10  Unique         1.88, 3.51 A)
 &rst
  ixpk= 1762, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1815,1816,
 &end
#
#  111 ILE  HB          111 ILE  HN          3.50    (#   1763:10  Unique         2.11, 2.33 A)
 &rst
  ixpk= 1763, nxpk= 10, iat=1809,1805, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  110 GLU  HB-         111 ILE  HN          5.50    (#   1764:10  Unique         2.63, 3.64 A)
 &rst
  ixpk= 1764, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1794,1795,
 &end
#
#  110 GLU  HB+         111 ILE  HN          5.50    (#   1765:10  Unique         2.63, 3.64 A)
 &rst
  ixpk= 1765, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1794,1795,
 &end
#
#  110 GLU  HG-         111 ILE  HN          5.50    (#   1766:10  Unique         2.36, 4.67 A)
 &rst
  ixpk= 1766, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1797,1798,
 &end
#
#    0 AMB  10-2:1767   111 ILE  HN          5.50    (#   1767:10  Single Ambig)
 &rst
  ixpk= 1767, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1772,1773,1772,1773,
 &end
#
#  111 ILE  HA          111 ILE  HN          5.50    (#   1768:10  Unique         2.69, 2.76 A)
 &rst
  ixpk= 1768, nxpk= 10, iat=1807,1805, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 GLU  HA          111 ILE  HN          4.50    (#   1769:10  Unique         3.12, 3.39 A)
 &rst
  ixpk= 1769, nxpk= 10, iat=1792,1805, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1770   111 ILE  HN          4.50    (#   1770:10  Single Ambig)
 &rst
  ixpk= 1770, nxpk= 10, iat=  -1,1805, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1770,1782,
 &end
#
#  110 GLU  HN          111 ILE  HN          4.50    (#   1773:10  Unique         2.07, 2.20 A)
 &rst
  ixpk= 1773, nxpk= 10, iat=1790,1805, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  112 ASN  HN          111 ILE  HN          5.50    (#   1774:10  Unique         4.26, 4.53 A)
 &rst
  ixpk= 1774, nxpk= 10, iat=1824,1805, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  109 ALA  HN          111 ILE  HN          5.50    (#   1775:10  Unique         3.37, 3.83 A)
 &rst
  ixpk= 1775, nxpk= 10, iat=1780,1805, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  113 MET  HN          112 ASN  HN          5.50    (#   1776:10  Unique         2.01, 2.92 A)
 &rst
  ixpk= 1776, nxpk= 10, iat=1838,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1777   112 ASN  HN          5.50    (#   1777:10  Single Ambig)
 &rst
  ixpk= 1777, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1833,1834, 905,
 &end
#
#  111 ILE  HN          112 ASN  HN          5.50    (#   1779:10  Unique         4.26, 4.53 A)
 &rst
  ixpk= 1779, nxpk= 10, iat=1805,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1782   112 ASN  HN          5.50    (#   1782:10  Single Ambig)
 &rst
  ixpk= 1782, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1840,1770,
 &end
#
#   59 GLY  HA+         112 ASN  HN          5.50    (#   1783:10  Unique         2.65, 4.17 A)
 &rst
  ixpk= 1783, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 907, 908,
 &end
#
#  111 ILE  HA          112 ASN  HN          3.50    (#   1784:10  Unique         2.14, 2.19 A)
 &rst
  ixpk= 1784, nxpk= 10, iat=1807,1824, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  112 ASN  HB-         112 ASN  HN          3.50    (#   1785:10  Unique         2.25, 3.03 A)
 &rst
  ixpk= 1785, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1828,1829,
 &end
#
#   58 VAL  HB          112 ASN  HN          5.50    (#   1786:10  Unique         2.88, 4.11 A)
 &rst
  ixpk= 1786, nxpk= 10, iat= 893,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1787   112 ASN  HN          5.50    (#   1787:10  Single Ambig)
 &rst
  ixpk= 1787, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1842,1843,1842,1843,1849,1850,1851,1794,1795,
 &end
#
#  111 ILE  HB          112 ASN  HN          5.50    (#   1788:10  Unique         4.02, 4.31 A)
 &rst
  ixpk= 1788, nxpk= 10, iat=1809,1824, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1789   112 ASN  HN          4.50    (#   1789:10  Single Ambig)
 &rst
  ixpk= 1789, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,
 &end
#
#    0 AMB  10-2:1790   112 ASN  HN          5.50    (#   1790:10  Single Ambig)
 &rst
  ixpk= 1790, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927,
 &end
#
#  111 ILE  HG1+        112 ASN  HN          5.50    (#   1791:10  Unique         2.55, 4.16 A)
 &rst
  ixpk= 1791, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#  111 ILE  QG2         112 ASN  HN          4.50    (#   1792:10  Unique         2.13, 3.68 A)
 &rst
  ixpk= 1792, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1811,1812,1813,
 &end
#
#  111 ILE  QD1         112 ASN  HN          5.50    (#   1793:10  Unique         3.72, 5.47 A)
 &rst
  ixpk= 1793, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#  111 ILE  HG1-        112 ASN  HN          5.50    (#   1794:10  Unique         2.55, 4.16 A)
 &rst
  ixpk= 1794, nxpk= 10, iat=  -1,1824, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1815,1816,
 &end
#
#    0 AMB  10-2:1795   113 MET  HN          3.50    (#   1795:10  Single Ambig)
 &rst
  ixpk= 1795, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1824,1855,
 &end
#
#  115 THR  HN          113 MET  HN          5.50    (#   1796:10  Unique         3.44, 3.97 A)
 &rst
  ixpk= 1796, nxpk= 10, iat=1872,1838, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   59 GLY  HN          113 MET  HN          5.50    (#   1797:10  Unique         3.26, 4.94 A)
 &rst
  ixpk= 1797, nxpk= 10, iat= 905,1838, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1798   113 MET  HN          5.50    (#   1798:10  Single Ambig)
 &rst
  ixpk= 1798, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1857, 876, 914,
 &end
#
#  113 MET  HA          113 MET  HN          4.50    (#   1800:10  Unique         2.27, 2.56 A)
 &rst
  ixpk= 1800, nxpk= 10, iat=1840,1838, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 ILE  HA          113 MET  HN          5.50    (#   1801:10  Unique         3.79, 4.63 A)
 &rst
  ixpk= 1801, nxpk= 10, iat=1807,1838, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1802   113 MET  HN          3.50    (#   1802:10  Single Ambig)
 &rst
  ixpk= 1802, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1828,1829,1828,1829,
 &end
#
#  113 MET  HG-         113 MET  HN          2.80    (#   1803:10  Unique         2.12, 3.03 A)
 &rst
  ixpk= 1803, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1845,1846,
 &end
#
#    0 AMB  10-2:1804   113 MET  HN          5.50    (#   1804:10  Single Ambig)
 &rst
  ixpk= 1804, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1862,1863,1862,1863,1859,1860,
 &end
#
#  114 GLN  HB-         113 MET  HN          5.50    (#   1805:10  Unique         3.95, 5.56 A)
 &rst
  ixpk= 1805, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1859,1860,
 &end
#
#    0 AMB  10-2:1806   113 MET  HN          4.50    (#   1806:10  Single Ambig)
 &rst
  ixpk= 1806, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1842,1843,1842,1843,
 &end
#
#    0 AMB  10-2:1807   113 MET  HN          5.50    (#   1807:10  Single Ambig)
 &rst
  ixpk= 1807, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 895, 896, 897, 899, 900, 901, 895, 896, 897, 899,
       900, 901,1878,1879,1880,
 &end
#
#  111 ILE  QG2         113 MET  HN          5.50    (#   1808:10  Unique         1.94, 4.06 A)
 &rst
  ixpk= 1808, nxpk= 10, iat=  -1,1838, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#  113 MET  HN          115 THR  HN          5.50    (#   1810:10  Unique         3.44, 3.97 A)
 &rst
  ixpk= 1810, nxpk= 10, iat=1838,1872, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  114 GLN  HN          115 THR  HN          2.80    (#   1811:10  Unique         1.80, 2.25 A)
 &rst
  ixpk= 1811, nxpk= 10, iat=1855,1872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  116 SER  HN          115 THR  HN          2.80    (#   1812:10  Unique         2.45, 2.69 A)
 &rst
  ixpk= 1812, nxpk= 10, iat=1886,1872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   55 PHE  HE          115 THR  HN          5.50    (#   1813:10  Unique         5.50,10.16 A)
 &rst
  ixpk= 1813, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 849, 853,
 &end
#
#  112 ASN  HD2-        115 THR  HN          5.50    (#   1815:10  Unique         1.90, 5.01 A)
 &rst
  ixpk= 1815, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1833,1834,
 &end
#
#  114 GLN  HA          115 THR  HN          2.80    (#   1817:10  Unique         2.79, 3.03 A)
 &rst
  ixpk= 1817, nxpk= 10, iat=1857,1872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  113 MET  HA          115 THR  HN          5.50    (#   1818:10  Unique         3.52, 3.86 A)
 &rst
  ixpk= 1818, nxpk= 10, iat=1840,1872, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  115 THR  HA          115 THR  HN          2.80    (#   1819:10  Unique         2.75, 2.79 A)
 &rst
  ixpk= 1819, nxpk= 10, iat=1874,1872, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  116 SER  HB-         115 THR  HN          5.50    (#   1820:10  Unique         4.71, 5.13 A)
 &rst
  ixpk= 1820, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1890,1891,
 &end
#
#  119 PRO  HD+         115 THR  HN          5.50    (#   1821:10  Unique         4.35, 5.16 A)
 &rst
  ixpk= 1821, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#  113 MET  HG+         115 THR  HN          5.50    (#   1823:10  Unique         5.61, 6.23 A)
 &rst
  ixpk= 1823, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1845,1846,
 &end
#
#    0 AMB  10-2:1824   115 THR  HN          3.50    (#   1824:10  Single Ambig)
 &rst
  ixpk= 1824, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1859,1860,1862,1863,1862,1863,
 &end
#
#    0 AMB  10-2:1825   115 THR  HN          4.50    (#   1825:10  Single Ambig)
 &rst
  ixpk= 1825, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1859,1860,1929,1930,
 &end
#
#  119 PRO  HG+         115 THR  HN          5.50    (#   1826:10  Unique         3.10, 4.66 A)
 &rst
  ixpk= 1826, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1926,1927,
 &end
#
#  119 PRO  HG-         115 THR  HN          5.50    (#   1827:10  Unique         3.10, 4.66 A)
 &rst
  ixpk= 1827, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1926,1927,
 &end
#
#  115 THR  MG2         115 THR  HN          4.50    (#   1828:10  Unique         1.97, 3.31 A)
 &rst
  ixpk= 1828, nxpk= 10, iat=  -1,1872, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1878,1879,1880,
 &end
#
#  115 THR  MG2         116 SER  HN          4.50    (#   1829:10  Unique         2.14, 3.82 A)
 &rst
  ixpk= 1829, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1878,1879,1880,
 &end
#
#    0 AMB  10-2:1830   116 SER  HN          4.50    (#   1830:10  Single Ambig)
 &rst
  ixpk= 1830, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1929,1930,1859,1860,
 &end
#
#  119 PRO  HB+         116 SER  HN          5.50    (#   1831:10  Unique         3.08, 4.40 A)
 &rst
  ixpk= 1831, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1929,1930,
 &end
#
#    0 AMB  10-2:1832   116 SER  HN          4.50    (#   1832:10  Single Ambig)
 &rst
  ixpk= 1832, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1859,1860,1862,1863,1862,1863,
 &end
#
#  119 PRO  HD-         116 SER  HN          5.50    (#   1834:10  Unique         2.63, 3.80 A)
 &rst
  ixpk= 1834, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#  116 SER  HB-         116 SER  HN          3.50    (#   1835:10  Unique         2.32, 2.71 A)
 &rst
  ixpk= 1835, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1890,1891,
 &end
#
#  116 SER  HB+         116 SER  HN          2.80    (#   1836:10  Unique         2.32, 2.71 A)
 &rst
  ixpk= 1836, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1890,1891,
 &end
#
#    0 AMB  10-2:1837   116 SER  HN          5.50    (#   1837:10  Single Ambig)
 &rst
  ixpk= 1837, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1840,1910, 841,
 &end
#
#    0 AMB  10-2:1838   116 SER  HN          2.80    (#   1838:10  Single Ambig)
 &rst
  ixpk= 1838, nxpk= 10, iat=  -1,1886, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1888,1857,
 &end
#
#  115 THR  HN          116 SER  HN          2.80    (#   1839:10  Unique         2.45, 2.69 A)
 &rst
  ixpk= 1839, nxpk= 10, iat=1872,1886, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  117 SER  HN          116 SER  HN          4.50    (#   1840:10  Unique         2.15, 2.46 A)
 &rst
  ixpk= 1840, nxpk= 10, iat=1897,1886, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  116 SER  HN          117 SER  HN          4.50    (#   1841:10  Unique         2.15, 2.46 A)
 &rst
  ixpk= 1841, nxpk= 10, iat=1886,1897, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  118 THR  HN          117 SER  HN          3.50    (#   1842:10  Unique         3.54, 3.58 A)
 &rst
  ixpk= 1842, nxpk= 10, iat=1908,1897, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1843   117 SER  HN          3.50    (#   1843:10  Single Ambig)
 &rst
  ixpk= 1843, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1888,1857,
 &end
#
#  117 SER  HA          117 SER  HN          2.80    (#   1844:10  Unique         2.29, 2.29 A)
 &rst
  ixpk= 1844, nxpk= 10, iat=1899,1897, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  117 SER  HB-         117 SER  HN          3.50    (#   1845:10  Unique         3.20, 3.52 A)
 &rst
  ixpk= 1845, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1901,1902,
 &end
#
#    0 AMB  10-2:1846   117 SER  HN          3.50    (#   1846:10  Single Ambig)
 &rst
  ixpk= 1846, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1901,1902,1874,1890,1891,
 &end
#
#  116 SER  HB-         117 SER  HN          3.50    (#   1847:10  Unique         3.64, 4.09 A)
 &rst
  ixpk= 1847, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1890,1891,
 &end
#
#  119 PRO  HD+         117 SER  HN          5.50    (#   1848:10  Unique         2.76, 3.89 A)
 &rst
  ixpk= 1848, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#  119 PRO  HD-         117 SER  HN          5.50    (#   1849:10  Unique         2.76, 3.89 A)
 &rst
  ixpk= 1849, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#  119 PRO  HG+         117 SER  HN          5.50    (#   1850:10  Unique         3.89, 5.26 A)
 &rst
  ixpk= 1850, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1926,1927,
 &end
#
#  118 THR  MG2         117 SER  HN          5.50    (#   1851:10  Unique         5.60, 6.69 A)
 &rst
  ixpk= 1851, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1914,1915,1916,
 &end
#
#  115 THR  MG2         117 SER  HN          5.50    (#   1852:10  Unique         4.33, 5.63 A)
 &rst
  ixpk= 1852, nxpk= 10, iat=  -1,1897, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1878,1879,1880,
 &end
#
#  118 THR  MG2         118 THR  HN          4.50    (#   1853:10  Unique         2.46, 4.09 A)
 &rst
  ixpk= 1853, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1914,1915,1916,
 &end
#
#    0 AMB  10-2:1854     0 AMB  10-1:1854   5.50    (#   1854:10  Double Ambig)
 &rst
  ixpk= 1854, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 418, 419,1926,1927,
 igr2= 403,1908,
 &end
#
#  119 PRO  HG+         118 THR  HN          5.50    (#   1855:10  Unique         4.78, 5.30 A)
 &rst
  ixpk= 1855, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1926,1927,
 &end
#
#    0 AMB  10-2:1856   118 THR  HN          5.50    (#   1856:10  Single Ambig)
 &rst
  ixpk= 1856, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1929,1930,1859,1860,
 &end
#
#  119 PRO  HB+         118 THR  HN          5.50    (#   1857:10  Unique         4.68, 5.49 A)
 &rst
  ixpk= 1857, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1929,1930,
 &end
#
#  119 PRO  HD-         118 THR  HN          4.50    (#   1859:10  Unique         2.51, 3.26 A)
 &rst
  ixpk= 1859, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1923,1924,
 &end
#
#  119 PRO  HD+         118 THR  HN          4.50    (#   1860:10  Unique         2.51, 3.26 A)
 &rst
  ixpk= 1860, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1923,1924,
 &end
#
#  116 SER  HB-         118 THR  HN          5.50    (#   1861:10  Unique         3.14, 4.07 A)
 &rst
  ixpk= 1861, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1890,1891,
 &end
#
#  117 SER  HB+         118 THR  HN          2.80    (#   1862:10  Unique         2.17, 2.81 A)
 &rst
  ixpk= 1862, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1901,1902,
 &end
#
#  117 SER  HB+         118 THR  HN          2.80    (#   1863:10  Unique         2.17, 2.81 A)
 &rst
  ixpk= 1863, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1901,1902,
 &end
#
#  118 THR  HA          118 THR  HN          3.50    (#   1864:10  Unique         2.86, 2.93 A)
 &rst
  ixpk= 1864, nxpk= 10, iat=1910,1908, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   28 PHE  HE          118 THR  HN          5.50    (#   1866:10  Unique         5.02, 6.49 A)
 &rst
  ixpk= 1866, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 448, 452,
 &end
#
#  117 SER  HN          118 THR  HN          3.50    (#   1867:10  Unique         3.54, 3.58 A)
 &rst
  ixpk= 1867, nxpk= 10, iat=1897,1908, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  121 PHE  HN          120 GLU  HN          4.50    (#   1868:10  Unique         1.84, 2.27 A)
 &rst
  ixpk= 1868, nxpk= 10, iat=1951,1936, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 PHE  HD          120 GLU  HN          5.50    (#   1870:10  Unique         2.83, 5.57 A)
 &rst
  ixpk= 1870, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 446, 454,
 &end
#
#  119 PRO  HA          120 GLU  HN          3.50    (#   1873:10  Unique         2.70, 3.38 A)
 &rst
  ixpk= 1873, nxpk= 10, iat=1932,1936, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  120 GLU  HA          120 GLU  HN          4.50    (#   1874:10  Unique         2.66, 2.82 A)
 &rst
  ixpk= 1874, nxpk= 10, iat=1938,1936, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  116 SER  HB-         120 GLU  HN          5.50    (#   1875:10  Unique         4.87, 5.95 A)
 &rst
  ixpk= 1875, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1890,1891,
 &end
#
#   27 ARG  HD+         120 GLU  HN          5.50    (#   1876:10  Unique         5.00, 6.33 A)
 &rst
  ixpk= 1876, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 424, 425,
 &end
#
#    0 AMB  10-2:1877   120 GLU  HN          5.50    (#   1877:10  Single Ambig)
 &rst
  ixpk= 1877, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1923,1924,1955,1956,
 &end
#
#  119 PRO  HD-         120 GLU  HN          5.50    (#   1878:10  Unique         2.75, 3.91 A)
 &rst
  ixpk= 1878, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1923,1924,
 &end
#
#  119 PRO  HB+         120 GLU  HN          4.50    (#   1879:10  Unique         1.76, 2.95 A)
 &rst
  ixpk= 1879, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1929,1930,
 &end
#
#    0 AMB  10-2:1880   120 GLU  HN          5.50    (#   1880:10  Single Ambig)
 &rst
  ixpk= 1880, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1975,1976,1862,1863,1862,1863,
 &end
#
#    0 AMB  10-2:1881   120 GLU  HN          4.50    (#   1881:10  Single Ambig)
 &rst
  ixpk= 1881, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1929,1930, 863, 864,
 &end
#
#  120 GLU  HB+         120 GLU  HN          4.50    (#   1883:10  Unique         2.35, 3.41 A)
 &rst
  ixpk= 1883, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1940,1941,
 &end
#
#  120 GLU  HG+         120 GLU  HN          4.50    (#   1884:10  Unique         2.14, 3.88 A)
 &rst
  ixpk= 1884, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1943,1944,
 &end
#
#  120 GLU  HB-         120 GLU  HN          4.50    (#   1885:10  Unique         2.35, 3.41 A)
 &rst
  ixpk= 1885, nxpk= 10, iat=  -1,1936, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1940,1941,
 &end
#
#  122 ASP  HN          121 PHE  HN          5.50    (#   1886:10  Unique         4.13, 4.39 A)
 &rst
  ixpk= 1886, nxpk= 10, iat=1971,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 GLU  HN          121 PHE  HN          4.50    (#   1887:10  Unique         1.84, 2.27 A)
 &rst
  ixpk= 1887, nxpk= 10, iat=1936,1951, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 PHE  HA          121 PHE  HN          5.50    (#   1889:10  Unique         2.84, 2.93 A)
 &rst
  ixpk= 1889, nxpk= 10, iat=1953,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  119 PRO  HA          121 PHE  HN          5.50    (#   1890:10  Unique         4.36, 5.29 A)
 &rst
  ixpk= 1890, nxpk= 10, iat=1932,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  120 GLU  HA          121 PHE  HN          5.50    (#   1891:10  Unique         2.62, 3.49 A)
 &rst
  ixpk= 1891, nxpk= 10, iat=1938,1951, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HB+         121 PHE  HN          5.50    (#   1892:10  Unique         2.57, 3.38 A)
 &rst
  ixpk= 1892, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#  121 PHE  HB-         121 PHE  HN          5.50    (#   1893:10  Unique         2.57, 3.38 A)
 &rst
  ixpk= 1893, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#  119 PRO  HB+         121 PHE  HN          5.50    (#   1894:10  Unique         2.30, 4.19 A)
 &rst
  ixpk= 1894, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1929,1930,
 &end
#
#  119 PRO  HB-         121 PHE  HN          5.50    (#   1895:10  Unique         2.30, 4.19 A)
 &rst
  ixpk= 1895, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1929,1930,
 &end
#
#  120 GLU  HB+         121 PHE  HN          5.50    (#   1896:10  Unique         2.26, 3.22 A)
 &rst
  ixpk= 1896, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1940,1941,
 &end
#
#    0 AMB  10-2:1897   121 PHE  HN          5.50    (#   1897:10  Single Ambig)
 &rst
  ixpk= 1897, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1943,1944,1926,1927,
 &end
#
#  120 GLU  HB-         121 PHE  HN          5.50    (#   1898:10  Unique         2.26, 3.22 A)
 &rst
  ixpk= 1898, nxpk= 10, iat=  -1,1951, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1940,1941,
 &end
#
#   25 ALA  MB          122 ASP  HN          5.50    (#   1899:10  Unique         2.85, 4.93 A)
 &rst
  ixpk= 1899, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#    0 AMB  10-2:1900   122 ASP  HN          5.50    (#   1900:10  Single Ambig)
 &rst
  ixpk= 1900, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1842,1843,1842,1843,
 &end
#
#   28 PHE  HB-         122 ASP  HN          5.50    (#   1901:10  Unique         2.12, 4.38 A)
 &rst
  ixpk= 1901, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#  122 ASP  HB-         122 ASP  HN          5.50    (#   1902:10  Unique         2.25, 2.98 A)
 &rst
  ixpk= 1902, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#    0 AMB  10-2:1903   122 ASP  HN          4.50    (#   1903:10  Single Ambig)
 &rst
  ixpk= 1903, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1955,1956, 400, 401, 400, 401,
 &end
#
#   28 PHE  HB+         122 ASP  HN          5.50    (#   1904:10  Unique         2.12, 4.38 A)
 &rst
  ixpk= 1904, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 442, 443,
 &end
#
#  121 PHE  HB+         122 ASP  HN          5.50    (#   1905:10  Unique         2.14, 3.19 A)
 &rst
  ixpk= 1905, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#   28 PHE  HA          122 ASP  HN          5.50    (#   1906:10  Unique         2.83, 4.00 A)
 &rst
  ixpk= 1906, nxpk= 10, iat= 440,1971, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   27 ARG  HA          122 ASP  HN          5.50    (#   1907:10  Unique         3.08, 3.64 A)
 &rst
  ixpk= 1907, nxpk= 10, iat= 416,1971, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HA          122 ASP  HN          4.50    (#   1908:10  Unique         2.85, 2.91 A)
 &rst
  ixpk= 1908, nxpk= 10, iat=1973,1971, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  121 PHE  HA          122 ASP  HN          4.50    (#   1909:10  Unique         2.16, 2.35 A)
 &rst
  ixpk= 1909, nxpk= 10, iat=1953,1971, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  123 GLY  HN          122 ASP  HN          4.50    (#   1911:10  Unique         1.64, 2.44 A)
 &rst
  ixpk= 1911, nxpk= 10, iat=1983,1971, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 PHE  HN          122 ASP  HN          5.50    (#   1912:10  Unique         1.89, 3.19 A)
 &rst
  ixpk= 1912, nxpk= 10, iat= 438,1971, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  121 PHE  HN          122 ASP  HN          5.50    (#   1914:10  Unique         4.13, 4.39 A)
 &rst
  ixpk= 1914, nxpk= 10, iat=1951,1971, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HN          123 GLY  HN          4.50    (#   1915:10  Unique         1.64, 2.44 A)
 &rst
  ixpk= 1915, nxpk= 10, iat=1971,1983, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1917   123 GLY  HN          5.50    (#   1917:10  Single Ambig)
 &rst
  ixpk= 1917, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1990,1855,
 &end
#
#  121 PHE  HA          123 GLY  HN          5.50    (#   1919:10  Unique         3.67, 4.16 A)
 &rst
  ixpk= 1919, nxpk= 10, iat=1953,1983, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  122 ASP  HA          123 GLY  HN          5.50    (#   1920:10  Unique         2.53, 3.05 A)
 &rst
  ixpk= 1920, nxpk= 10, iat=1973,1983, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HA+         123 GLY  HN          4.50    (#   1921:10  Unique         2.29, 2.57 A)
 &rst
  ixpk= 1921, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1985,1986,
 &end
#
#  123 GLY  HA-         123 GLY  HN          4.50    (#   1922:10  Unique         2.29, 2.57 A)
 &rst
  ixpk= 1922, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1985,1986,
 &end
#
#  121 PHE  HB+         123 GLY  HN          5.50    (#   1923:10  Unique         2.34, 3.46 A)
 &rst
  ixpk= 1923, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1955,1956,
 &end
#
#    0 AMB  10-2:1924   123 GLY  HN          5.50    (#   1924:10  Single Ambig)
 &rst
  ixpk= 1924, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1955,1956, 400, 401, 400, 401,
 &end
#
#  122 ASP  HB+         123 GLY  HN          5.50    (#   1925:10  Unique         1.95, 4.11 A)
 &rst
  ixpk= 1925, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#  122 ASP  HB-         123 GLY  HN          5.50    (#   1926:10  Unique         1.95, 4.11 A)
 &rst
  ixpk= 1926, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#    0 AMB  10-2:1927   123 GLY  HN          5.50    (#   1927:10  Single Ambig)
 &rst
  ixpk= 1927, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1842,1843,1842,1843,1849,1850,1851,
 &end
#
#    0 AMB  10-2:1928   123 GLY  HN          5.50    (#   1928:10  Single Ambig)
 &rst
  ixpk= 1928, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 394, 395, 394, 395,
 &end
#
#   25 ALA  MB          123 GLY  HN          5.50    (#   1929:10  Unique         1.92, 3.54 A)
 &rst
  ixpk= 1929, nxpk= 10, iat=  -1,1983, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#  125 ARG  HN          124 TRP  HN          5.50    (#   1931:10  Unique         1.60, 2.18 A)
 &rst
  ixpk= 1931, nxpk= 10, iat=2014,1990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HN          124 TRP  HN          5.50    (#   1934:10  Unique         4.01, 4.38 A)
 &rst
  ixpk= 1934, nxpk= 10, iat=1983,1990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HA          124 TRP  HN          5.50    (#   1938:10  Unique         2.66, 2.77 A)
 &rst
  ixpk= 1938, nxpk= 10, iat=1992,1990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HA          124 TRP  HN          5.50    (#   1939:10  Unique         2.76, 3.18 A)
 &rst
  ixpk= 1939, nxpk= 10, iat= 382,1990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HA+         124 TRP  HN          2.80    (#   1940:10  Unique         2.18, 2.58 A)
 &rst
  ixpk= 1940, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1985,1986,
 &end
#
#  123 GLY  HA-         124 TRP  HN          3.50    (#   1941:10  Unique         2.18, 2.58 A)
 &rst
  ixpk= 1941, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1985,1986,
 &end
#
#  124 TRP  HB-         124 TRP  HN          5.50    (#   1942:10  Unique         2.75, 3.73 A)
 &rst
  ixpk= 1942, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  124 TRP  HB+         124 TRP  HN          5.50    (#   1943:10  Unique         2.75, 3.73 A)
 &rst
  ixpk= 1943, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  113 MET  HG-         124 TRP  HN          5.50    (#   1944:10  Unique         4.04, 5.94 A)
 &rst
  ixpk= 1944, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1845,1846,
 &end
#
#  113 MET  ME          124 TRP  HN          5.50    (#   1945:10  Unique         2.32, 4.18 A)
 &rst
  ixpk= 1945, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1849,1850,1851,
 &end
#
#    0 AMB  10-2:1946   124 TRP  HN          5.50    (#   1946:10  Single Ambig)
 &rst
  ixpk= 1946, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 394, 395, 394, 395,
 &end
#
#   25 ALA  MB          124 TRP  HN          5.50    (#   1947:10  Unique         2.54, 5.02 A)
 &rst
  ixpk= 1947, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#  111 ILE  QG2         124 TRP  HN          5.50    (#   1948:10  Unique         4.88, 6.65 A)
 &rst
  ixpk= 1948, nxpk= 10, iat=  -1,1990, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1811,1812,1813,
 &end
#
#   24 TRP  HN          125 ARG  HN          5.50    (#   1949:10  Unique         3.79, 4.78 A)
 &rst
  ixpk= 1949, nxpk= 10, iat= 356,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HN          125 ARG  HN          5.50    (#   1950:10  Unique         4.07, 4.32 A)
 &rst
  ixpk= 1950, nxpk= 10, iat=2038,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HN          125 ARG  HN          5.50    (#   1951:10  Unique         1.60, 2.18 A)
 &rst
  ixpk= 1951, nxpk= 10, iat=1990,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1952   125 ARG  HN          5.50    (#   1952:10  Single Ambig)
 &rst
  ixpk= 1952, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 390, 380,
 &end
#
#   33 TRP  HH2         125 ARG  HN          5.50    (#   1953:10  Unique         3.05, 3.77 A)
 &rst
  ixpk= 1953, nxpk= 10, iat= 525,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HA          125 ARG  HN          5.50    (#   1957:10  Unique         2.49, 3.04 A)
 &rst
  ixpk= 1957, nxpk= 10, iat=1992,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   25 ALA  HA          125 ARG  HN          5.50    (#   1958:10  Unique         2.98, 4.09 A)
 &rst
  ixpk= 1958, nxpk= 10, iat= 382,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  123 GLY  HA+         125 ARG  HN          5.50    (#   1959:10  Unique         3.60, 4.52 A)
 &rst
  ixpk= 1959, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1985,1986,
 &end
#
#  125 ARG  HA          125 ARG  HN          5.50    (#   1960:10  Unique         2.83, 2.88 A)
 &rst
  ixpk= 1960, nxpk= 10, iat=2016,2014, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  124 TRP  HB+         125 ARG  HN          5.50    (#   1961:10  Unique         1.82, 4.03 A)
 &rst
  ixpk= 1961, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  124 TRP  HB-         125 ARG  HN          5.50    (#   1962:10  Unique         1.82, 4.03 A)
 &rst
  ixpk= 1962, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1994,1995,
 &end
#
#  113 MET  ME          125 ARG  HN          5.50    (#   1964:10  Unique         3.09, 4.80 A)
 &rst
  ixpk= 1964, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1849,1850,1851,
 &end
#
#  125 ARG  HG-         125 ARG  HN          5.50    (#   1966:10  Unique         2.58, 4.15 A)
 &rst
  ixpk= 1966, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2021,2022,
 &end
#
#   25 ALA  MB          125 ARG  HN          5.50    (#   1967:10  Unique         3.86, 6.04 A)
 &rst
  ixpk= 1967, nxpk= 10, iat=  -1,2014, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 384, 385, 386,
 &end
#
#  126 TRP  HE1         126 TRP  HN          5.50    (#   1968:10  Unique         4.16, 4.81 A)
 &rst
  ixpk= 1968, nxpk= 10, iat=2048,2038, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HD1         126 TRP  HN          4.50    (#   1969:10  Unique         2.34, 3.58 A)
 &rst
  ixpk= 1969, nxpk= 10, iat=2046,2038, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  126 TRP  HA          126 TRP  HN          5.50    (#   1972:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 1972, nxpk= 10, iat=2040,2038, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  125 ARG  HA          126 TRP  HN          3.50    (#   1973:10  Unique         2.16, 2.30 A)
 &rst
  ixpk= 1973, nxpk= 10, iat=2016,2038, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    3 ASP  HB+           2 ILE  HN          5.50    (#   1974:10  Unique         4.87, 6.17 A)
 &rst
  ixpk= 1974, nxpk= 10, iat=  -1,  21, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  44,  45,
 &end
#
#    0 AMB  10-2:1975   126 TRP  HN          3.50    (#   1975:10  Single Ambig)
 &rst
  ixpk= 1975, nxpk= 10, iat=  -1,2038, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2042,2043,2042,2043,
 &end
#
#  125 ARG  HB+         126 TRP  HN          4.50    (#   1976:10  Unique         2.14, 3.71 A)
 &rst
  ixpk= 1976, nxpk= 10, iat=  -1,2038, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2018,2019,
 &end
#
#  125 ARG  HG-         126 TRP  HN          5.50    (#   1977:10  Unique         2.08, 3.30 A)
 &rst
  ixpk= 1977, nxpk= 10, iat=  -1,2038, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2021,2022,
 &end
#
#  127 VAL  MGY         126 TRP  HN          5.50    (#   1978:10  Unique         4.67, 6.63 A)
 &rst
  ixpk= 1978, nxpk= 10, iat=  -1,2038, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   22 VAL  HN          127 VAL  HN          5.50    (#   1979:10  Unique         2.48, 3.30 A)
 &rst
  ixpk= 1979, nxpk= 10, iat= 323,2062, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  126 TRP  HN          127 VAL  HN          5.50    (#   1980:10  Unique         4.43, 4.53 A)
 &rst
  ixpk= 1980, nxpk= 10, iat=2038,2062, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1981   127 VAL  HN          5.50    (#   1981:10  Single Ambig)
 &rst
  ixpk= 1981, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2078, 299,
 &end
#
#  126 TRP  HA          127 VAL  HN          4.50    (#   1985:10  Unique         2.41, 2.49 A)
 &rst
  ixpk= 1985, nxpk= 10, iat=2040,2062, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   23 MET  HA          127 VAL  HN          5.50    (#   1987:10  Unique         4.47, 5.06 A)
 &rst
  ixpk= 1987, nxpk= 10, iat= 341,2062, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1988   127 VAL  HN          4.50    (#   1988:10  Single Ambig)
 &rst
  ixpk= 1988, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2042,2043,2042,2043,
 &end
#
#   21 GLN  HB+         127 VAL  HN          5.50    (#   1989:10  Unique         1.95, 3.58 A)
 &rst
  ixpk= 1989, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 310, 311,
 &end
#
#  127 VAL  HB          127 VAL  HN          5.50    (#   1991:10  Unique         3.12, 3.69 A)
 &rst
  ixpk= 1991, nxpk= 10, iat=2066,2062, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   22 VAL  MGX         127 VAL  HN          5.50    (#   1992:10  Unique         2.84, 5.86 A)
 &rst
  ixpk= 1992, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  127 VAL  MGX         127 VAL  HN          4.50    (#   1993:10  Unique         2.13, 3.70 A)
 &rst
  ixpk= 1993, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY         127 VAL  HN          4.50    (#   1994:10  Unique         2.13, 3.70 A)
 &rst
  ixpk= 1994, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  HN          128 SER  HN          5.50    (#   1995:10  Unique         4.17, 4.38 A)
 &rst
  ixpk= 1995, nxpk= 10, iat=2062,2078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  131 TYR  HD          128 SER  HN          5.50    (#   1996:10  Unique         1.95, 4.63 A)
 &rst
  ixpk= 1996, nxpk= 10, iat=  -1,2078, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2142,2151,
 &end
#
#  128 SER  HA          128 SER  HN          5.50    (#   1998:10  Unique         2.72, 2.77 A)
 &rst
  ixpk= 1998, nxpk= 10, iat=2080,2078, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1999   128 SER  HN          3.50    (#   1999:10  Single Ambig)
 &rst
  ixpk= 1999, nxpk= 10, iat=  -1,2078, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2082,2083,2082,2083,
 &end
#
#  131 TYR  HB-         128 SER  HN          5.50    (#   2000:10  Unique         2.55, 3.40 A)
 &rst
  ixpk= 2000, nxpk= 10, iat=  -1,2078, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2138,2139,
 &end
#
#  127 VAL  HB          128 SER  HN          4.50    (#   2001:10  Unique         1.90, 2.81 A)
 &rst
  ixpk= 2001, nxpk= 10, iat=2066,2078, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  127 VAL  MGX         128 SER  HN          4.50    (#   2002:10  Unique         1.94, 4.11 A)
 &rst
  ixpk= 2002, nxpk= 10, iat=  -1,2078, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY         128 SER  HN          4.50    (#   2003:10  Unique         1.94, 4.11 A)
 &rst
  ixpk= 2003, nxpk= 10, iat=  -1,2078, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#   22 VAL  MGY         129 TYR  HN          5.50    (#   2004:10  Unique         4.08, 7.03 A)
 &rst
  ixpk= 2004, nxpk= 10, iat=  -1,2089, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 329, 330, 331, 333, 334, 335,
 &end
#
#  129 TYR  HB-         129 TYR  HN          4.50    (#   2006:10  Unique         2.08, 2.68 A)
 &rst
  ixpk= 2006, nxpk= 10, iat=  -1,2089, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2093,2094,
 &end
#
#  129 TYR  HB+         129 TYR  HN          4.50    (#   2007:10  Unique         2.08, 2.68 A)
 &rst
  ixpk= 2007, nxpk= 10, iat=  -1,2089, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2093,2094,
 &end
#
#  129 TYR  HA          129 TYR  HN          4.50    (#   2008:10  Unique         2.27, 2.84 A)
 &rst
  ixpk= 2008, nxpk= 10, iat=2091,2089, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2009   129 TYR  HN          4.50    (#   2009:10  Single Ambig)
 &rst
  ixpk= 2009, nxpk= 10, iat=  -1,2089, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2082,2083,2082,2083,
 &end
#
#  128 SER  HA          129 TYR  HN          4.50    (#   2010:10  Unique         2.20, 2.46 A)
 &rst
  ixpk= 2010, nxpk= 10, iat=2080,2089, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  129 TYR  HD          129 TYR  HN          4.50    (#   2012:10  Unique         3.16, 4.60 A)
 &rst
  ixpk= 2012, nxpk= 10, iat=  -1,2089, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2097,2106,
 &end
#
#  130 TRP  HN          129 TYR  HN          5.50    (#   2013:10  Unique         2.22, 3.31 A)
 &rst
  ixpk= 2013, nxpk= 10, iat=2110,2089, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HE1         130 TRP  HN          5.50    (#   2014:10  Unique         4.26, 5.06 A)
 &rst
  ixpk= 2014, nxpk= 10, iat=2120,2110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HN          130 TRP  HN          5.50    (#   2015:10  Unique         2.22, 3.31 A)
 &rst
  ixpk= 2015, nxpk= 10, iat=2089,2110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HD1         130 TRP  HN          5.50    (#   2016:10  Unique         2.37, 3.60 A)
 &rst
  ixpk= 2016, nxpk= 10, iat=2118,2110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HD          130 TRP  HN          5.50    (#   2017:10  Unique         1.76, 4.62 A)
 &rst
  ixpk= 2017, nxpk= 10, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2097,2106,
 &end
#
#  130 TRP  HA          130 TRP  HN          5.50    (#   2018:10  Unique         2.28, 2.67 A)
 &rst
  ixpk= 2018, nxpk= 10, iat=2112,2110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2019   130 TRP  HN          5.50    (#   2019:10  Single Ambig)
 &rst
  ixpk= 2019, nxpk= 10, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2082,2083,2082,2083,
 &end
#
#  129 TYR  HA          130 TRP  HN          5.50    (#   2020:10  Unique         2.20, 2.94 A)
 &rst
  ixpk= 2020, nxpk= 10, iat=2091,2110, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2021   130 TRP  HN          5.50    (#   2021:10  Single Ambig)
 &rst
  ixpk= 2021, nxpk= 10, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2156,2157,2114,2115,
 &end
#
#  130 TRP  HB-         130 TRP  HN          4.50    (#   2022:10  Unique         2.70, 3.55 A)
 &rst
  ixpk= 2022, nxpk= 10, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2114,2115,
 &end
#
#  129 TYR  HB-         130 TRP  HN          5.50    (#   2023:10  Unique         2.11, 3.58 A)
 &rst
  ixpk= 2023, nxpk= 10, iat=  -1,2110, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#  130 TRP  HN          131 TYR  HN          4.50    (#   2025:10  Unique         1.65, 2.36 A)
 &rst
  ixpk= 2025, nxpk= 10, iat=2110,2134, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 TYR  HD          131 TYR  HN          4.50    (#   2026:10  Unique         4.16, 4.66 A)
 &rst
  ixpk= 2026, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2142,2151,
 &end
#
#  130 TRP  HA          131 TYR  HN          5.50    (#   2027:10  Unique         2.88, 3.24 A)
 &rst
  ixpk= 2027, nxpk= 10, iat=2112,2134, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  131 TYR  HA          131 TYR  HN          4.50    (#   2028:10  Unique         2.83, 2.86 A)
 &rst
  ixpk= 2028, nxpk= 10, iat=2136,2134, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2029   131 TYR  HN          5.50    (#   2029:10  Single Ambig)
 &rst
  ixpk= 2029, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2082,2083,2082,2083,
 &end
#
#  132 PRO  HD+         131 TYR  HN          5.50    (#   2030:10  Unique         1.64, 2.26 A)
 &rst
  ixpk= 2030, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2156,2157,
 &end
#
#  132 PRO  HD-         131 TYR  HN          4.50    (#   2031:10  Unique         1.64, 2.26 A)
 &rst
  ixpk= 2031, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2156,2157,
 &end
#
#  130 TRP  HB-         131 TYR  HN          5.50    (#   2032:10  Unique         2.93, 3.99 A)
 &rst
  ixpk= 2032, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2114,2115,
 &end
#
#    0 AMB  10-2:2033   131 TYR  HN          4.50    (#   2033:10  Single Ambig)
 &rst
  ixpk= 2033, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2138,2139,2138,2139,
 &end
#
#    0 AMB  10-2:2034   131 TYR  HN          5.50    (#   2034:10  Single Ambig)
 &rst
  ixpk= 2034, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2159,2160,2066,
 &end
#
#    0 AMB  10-2:2035   131 TYR  HN          5.50    (#   2035:10  Single Ambig)
 &rst
  ixpk= 2035, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=2459,2460,2461,2162,2163,
 &end
#
#  133 VAL  MGY         131 TYR  HN          5.50    (#   2036:10  Unique         3.62, 6.03 A)
 &rst
  ixpk= 2036, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  127 VAL  MGX         131 TYR  HN          5.50    (#   2037:10  Unique         3.30, 6.11 A)
 &rst
  ixpk= 2037, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  127 VAL  MGY         131 TYR  HN          5.50    (#   2038:10  Unique         3.30, 6.11 A)
 &rst
  ixpk= 2038, nxpk= 10, iat=  -1,2134, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  134 ARG  HN          133 VAL  HN          3.50    (#   2040:10  Unique         2.34, 2.64 A)
 &rst
  ixpk= 2040, nxpk= 10, iat=2185,2169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  131 TYR  HD          133 VAL  HN          5.50    (#   2041:10  Unique         4.35, 5.64 A)
 &rst
  ixpk= 2041, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2142,2151,
 &end
#
#  130 TRP  HA          133 VAL  HN          5.50    (#   2043:10  Unique         3.35, 3.54 A)
 &rst
  ixpk= 2043, nxpk= 10, iat=2112,2169, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2044   133 VAL  HN          5.50    (#   2044:10  Single Ambig)
 &rst
  ixpk= 2044, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2187,2211,
 &end
#
#  133 VAL  HA          133 VAL  HN          4.50    (#   2045:10  Unique         2.73, 2.81 A)
 &rst
  ixpk= 2045, nxpk= 10, iat=2171,2169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  132 PRO  HA          133 VAL  HN          4.50    (#   2046:10  Unique         3.23, 3.35 A)
 &rst
  ixpk= 2046, nxpk= 10, iat=2165,2169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  133 VAL  HB          133 VAL  HN          3.50    (#   2047:10  Unique         2.28, 2.57 A)
 &rst
  ixpk= 2047, nxpk= 10, iat=2173,2169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2048   133 VAL  HN          5.50    (#   2048:10  Single Ambig)
 &rst
  ixpk= 2048, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2192,2193,2391,2392,
 &end
#
#    0 AMB  10-2:2049   133 VAL  HN          4.50    (#   2049:10  Single Ambig)
 &rst
  ixpk= 2049, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=2459,2460,2461,2162,2163,
 &end
#
#    0 AMB  10-2:2050   133 VAL  HN          2.80    (#   2050:10  Single Ambig)
 &rst
  ixpk= 2050, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2175,2176,2177,2179,2180,2181,2175,2176,2177,2179,
      2180,2181,
 &end
#
#    0 AMB  10-2:2051   133 VAL  HN          5.50    (#   2051:10  Single Ambig)
 &rst
  ixpk= 2051, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2232,2233,2234,2236,2237,2238,2068,2069,2070,2072,
      2073,2074,
 &end
#
#  136 VAL  HN          134 ARG  HN          5.50    (#   2053:10  Unique         3.61, 4.03 A)
 &rst
  ixpk= 2053, nxpk= 10, iat=2226,2185, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  HN          134 ARG  HN          3.50    (#   2054:10  Unique         2.34, 2.64 A)
 &rst
  ixpk= 2054, nxpk= 10, iat=2169,2185, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  134 ARG  HA          134 ARG  HN          3.50    (#   2055:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 2055, nxpk= 10, iat=2187,2185, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  133 VAL  HA          134 ARG  HN          5.50    (#   2056:10  Unique         3.31, 3.41 A)
 &rst
  ixpk= 2056, nxpk= 10, iat=2171,2185, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2057   134 ARG  HN          5.50    (#   2057:10  Single Ambig)
 &rst
  ixpk= 2057, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2195,2196,2195,2196,
 &end
#
#  132 PRO  HA          134 ARG  HN          5.50    (#   2058:10  Unique         3.24, 3.43 A)
 &rst
  ixpk= 2058, nxpk= 10, iat=2165,2185, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  HB          134 ARG  HN          4.50    (#   2060:10  Unique         2.86, 3.30 A)
 &rst
  ixpk= 2060, nxpk= 10, iat=2173,2185, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  134 ARG  HB+         134 ARG  HN          3.50    (#   2061:10  Unique         2.46, 3.24 A)
 &rst
  ixpk= 2061, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2189,2190,
 &end
#
#    0 AMB  10-2:2062   134 ARG  HN          4.50    (#   2062:10  Single Ambig)
 &rst
  ixpk= 2062, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2192,2193,2216,2217,
 &end
#
#  134 ARG  HG+         134 ARG  HN          4.50    (#   2063:10  Unique         2.39, 3.70 A)
 &rst
  ixpk= 2063, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2192,2193,
 &end
#
#  135 GLN  HG-         134 ARG  HN          5.50    (#   2064:10  Unique         3.21, 5.22 A)
 &rst
  ixpk= 2064, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2216,2217,
 &end
#
#    0 AMB  10-2:2065   134 ARG  HN          4.50    (#   2065:10  Single Ambig)
 &rst
  ixpk= 2065, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2175,2176,2177,2179,2180,2181,2175,2176,2177,2179,
      2180,2181,
 &end
#
#  136 VAL  MGX         134 ARG  HN          5.50    (#   2066:10  Unique         4.11, 6.37 A)
 &rst
  ixpk= 2066, nxpk= 10, iat=  -1,2185, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  HN          135 GLN  HN          4.50    (#   2067:10  Unique         2.04, 2.27 A)
 &rst
  ixpk= 2067, nxpk= 10, iat=2226,2209, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  135 GLN  HE2+        135 GLN  HN          5.50    (#   2068:10  Unique         3.90, 5.59 A)
 &rst
  ixpk= 2068, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2221,2222,
 &end
#
#  134 ARG  HN          135 GLN  HN          4.50    (#   2069:10  Unique         1.85, 2.04 A)
 &rst
  ixpk= 2069, nxpk= 10, iat=2185,2209, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 TYR  HD          135 GLN  HN          5.50    (#   2070:10  Unique         4.34, 6.50 A)
 &rst
  ixpk= 2070, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2142,2151,
 &end
#
#    0 AMB  10-2:2071   135 GLN  HN          3.50    (#   2071:10  Single Ambig)
 &rst
  ixpk= 2071, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2211,2187,
 &end
#
#  133 VAL  HA          135 GLN  HN          5.50    (#   2072:10  Unique         4.04, 4.23 A)
 &rst
  ixpk= 2072, nxpk= 10, iat=2171,2209, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2073   135 GLN  HN          5.50    (#   2073:10  Single Ambig)
 &rst
  ixpk= 2073, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2321,2322,2195,2196,2195,2196,
 &end
#
#  132 PRO  HA          135 GLN  HN          5.50    (#   2074:10  Unique         2.60, 2.85 A)
 &rst
  ixpk= 2074, nxpk= 10, iat=2165,2209, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 GLN  HB+         135 GLN  HN          4.50    (#   2076:10  Unique         2.07, 2.84 A)
 &rst
  ixpk= 2076, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2213,2214,
 &end
#
#    0 AMB  10-2:2077   135 GLN  HN          5.50    (#   2077:10  Single Ambig)
 &rst
  ixpk= 2077, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2189,2190,2315,2316,
 &end
#
#    0 AMB  10-2:2078   135 GLN  HN          4.50    (#   2078:10  Single Ambig)
 &rst
  ixpk= 2078, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2216,2217,2318,2319,
 &end
#
#    0 AMB  10-2:2079   135 GLN  HN          4.50    (#   2079:10  Single Ambig)
 &rst
  ixpk= 2079, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2192,2193,2159,2160,
 &end
#
#    0 AMB  10-2:2080   135 GLN  HN          5.50    (#   2080:10  Single Ambig)
 &rst
  ixpk= 2080, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=2459,2460,2461, 514, 515,
 &end
#
#    0 AMB  10-2:2081   135 GLN  HN          5.50    (#   2081:10  Single Ambig)
 &rst
  ixpk= 2081, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2162,2163,2175,2176,2177,2179,2180,2181,
 &end
#
#  136 VAL  MGY         135 GLN  HN          5.50    (#   2082:10  Unique         2.80, 5.07 A)
 &rst
  ixpk= 2082, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  MGX         135 GLN  HN          5.50    (#   2083:10  Unique         2.80, 5.07 A)
 &rst
  ixpk= 2083, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  136 VAL  MGY         136 VAL  HN          2.80    (#   2084:10  Unique         1.77, 3.39 A)
 &rst
  ixpk= 2084, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#    0 AMB  10-2:2085   136 VAL  HN          5.50    (#   2085:10  Single Ambig)
 &rst
  ixpk= 2085, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,2296,2297,
      
 &end
#
#  132 PRO  HB-         136 VAL  HN          5.50    (#   2086:10  Unique         3.60, 4.91 A)
 &rst
  ixpk= 2086, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2162,2163,
 &end
#
#  137 VAL  MGY         136 VAL  HN          5.50    (#   2087:10  Unique         4.37, 7.12 A)
 &rst
  ixpk= 2087, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  141 ARG  HG-         136 VAL  HN          5.50    (#   2089:10  Unique         3.00, 5.22 A)
 &rst
  ixpk= 2089, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2318,2319,
 &end
#
#    0 AMB  10-2:2090   136 VAL  HN          5.50    (#   2090:10  Single Ambig)
 &rst
  ixpk= 2090, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2318,2319,2315,2316,
 &end
#
#  135 GLN  HB+         136 VAL  HN          4.50    (#   2091:10  Unique         2.45, 3.39 A)
 &rst
  ixpk= 2091, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2213,2214,
 &end
#
#  136 VAL  HB          136 VAL  HN          3.50    (#   2092:10  Unique         2.64, 3.22 A)
 &rst
  ixpk= 2092, nxpk= 10, iat=2230,2226, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  132 PRO  HA          136 VAL  HN          5.50    (#   2093:10  Unique         2.62, 3.87 A)
 &rst
  ixpk= 2093, nxpk= 10, iat=2165,2226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  HA          136 VAL  HN          5.50    (#   2095:10  Unique         4.31, 4.92 A)
 &rst
  ixpk= 2095, nxpk= 10, iat=2171,2226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2096   136 VAL  HN          4.50    (#   2096:10  Single Ambig)
 &rst
  ixpk= 2096, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2211,2187,
 &end
#
#  136 VAL  HA          136 VAL  HN          4.50    (#   2097:10  Unique         2.71, 2.85 A)
 &rst
  ixpk= 2097, nxpk= 10, iat=2228,2226, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 TRP  HH2         136 VAL  HN          4.50    (#   2098:10  Unique         3.35, 4.35 A)
 &rst
  ixpk= 2098, nxpk= 10, iat= 371,2226, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 VAL  HN          136 VAL  HN          5.50    (#   2100:10  Unique         2.19, 3.92 A)
 &rst
  ixpk= 2100, nxpk= 10, iat=2242,2226, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  135 GLN  HN          136 VAL  HN          3.50    (#   2102:10  Unique         2.04, 2.27 A)
 &rst
  ixpk= 2102, nxpk= 10, iat=2209,2226, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2103   137 VAL  HN          5.50    (#   2103:10  Single Ambig)
 &rst
  ixpk= 2103, nxpk= 10, iat=  -1,2242, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2258, 510,
 &end
#
#    0 AMB  10-2:2104   137 VAL  HN          5.50    (#   2104:10  Single Ambig)
 &rst
  ixpk= 2104, nxpk= 10, iat=  -1,2242, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2226,2311,
 &end
#
#  137 VAL  HA          137 VAL  HN          4.50    (#   2105:10  Unique         2.28, 2.60 A)
 &rst
  ixpk= 2105, nxpk= 10, iat=2244,2242, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  136 VAL  HA          137 VAL  HN          3.50    (#   2106:10  Unique         2.19, 2.70 A)
 &rst
  ixpk= 2106, nxpk= 10, iat=2228,2242, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2107   137 VAL  HN          3.50    (#   2107:10  Single Ambig)
 &rst
  ixpk= 2107, nxpk= 10, iat=  -1,2242, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2230,2246,
 &end
#
#  137 VAL  MGY         137 VAL  HN          4.50    (#   2108:10  Unique         1.94, 3.89 A)
 &rst
  ixpk= 2108, nxpk= 10, iat=  -1,2242, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  10-2:2109     0 AMB  10-1:2109   2.80    (#   2109:10  Double Ambig)
 &rst
  ixpk= 2109, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.88, r4= 5.38,
 igr1=2232,2233,2234,2236,2237,2238,2248,2249,2250,2252,
      2253,2254, 189, 190,
 igr2=2242, 179,
 &end
#
#  138 SER  HN          139 PHE  HN          5.50    (#   2111:10  Unique         2.25, 2.55 A)
 &rst
  ixpk= 2111, nxpk= 10, iat=2258,2269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  139 PHE  HD          139 PHE  HN          3.50    (#   2112:10  Unique         1.95, 3.86 A)
 &rst
  ixpk= 2112, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2277,2285,
 &end
#
#  137 VAL  HA          139 PHE  HN          4.50    (#   2114:10  Unique         3.84, 4.36 A)
 &rst
  ixpk= 2114, nxpk= 10, iat=2244,2269, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  138 SER  HB+         139 PHE  HN          4.50    (#   2115:10  Unique         2.13, 3.56 A)
 &rst
  ixpk= 2115, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2262,2263,
 &end
#
#  138 SER  HA          139 PHE  HN          5.50    (#   2116:10  Unique         3.38, 3.50 A)
 &rst
  ixpk= 2116, nxpk= 10, iat=2260,2269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  139 PHE  HB+         139 PHE  HN          4.50    (#   2117:10  Unique         2.20, 2.98 A)
 &rst
  ixpk= 2117, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2273,2274,
 &end
#
#  139 PHE  HB-         139 PHE  HN          4.50    (#   2118:10  Unique         2.20, 2.98 A)
 &rst
  ixpk= 2118, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2273,2274,
 &end
#
#  137 VAL  HB          139 PHE  HN          5.50    (#   2119:10  Unique         2.53, 3.09 A)
 &rst
  ixpk= 2119, nxpk= 10, iat=2246,2269, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2120   139 PHE  HN          5.50    (#   2120:10  Single Ambig)
 &rst
  ixpk= 2120, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2318,2319,1284,1285,2315,2316,
 &end
#
#   80 PRO  HG+         139 PHE  HN          5.50    (#   2121:10  Unique         4.00, 5.84 A)
 &rst
  ixpk= 2121, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1284,1285,
 &end
#
#  140 LYS  HB-         139 PHE  HN          5.50    (#   2122:10  Unique         3.77, 4.53 A)
 &rst
  ixpk= 2122, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2293,2294,
 &end
#
#    0 AMB  10-2:2123   139 PHE  HN          5.50    (#   2123:10  Single Ambig)
 &rst
  ixpk= 2123, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2293,2294,2299,2300,
 &end
#
#  137 VAL  MGY         139 PHE  HN          4.50    (#   2124:10  Unique         1.92, 4.38 A)
 &rst
  ixpk= 2124, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  MGX         139 PHE  HN          4.50    (#   2125:10  Unique         1.92, 4.38 A)
 &rst
  ixpk= 2125, nxpk= 10, iat=  -1,2269, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  142 ASP  HN          140 LYS  HN          5.50    (#   2126:10  Unique         3.83, 4.27 A)
 &rst
  ixpk= 2126, nxpk= 10, iat=2335,2289, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HN          140 LYS  HN          3.50    (#   2127:10  Unique         2.10, 2.47 A)
 &rst
  ixpk= 2127, nxpk= 10, iat=2311,2289, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  140 LYS  HA          140 LYS  HN          4.50    (#   2129:10  Unique         2.78, 2.86 A)
 &rst
  ixpk= 2129, nxpk= 10, iat=2291,2289, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2130   140 LYS  HN          5.50    (#   2130:10  Single Ambig)
 &rst
  ixpk= 2130, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2273,2274,2321,2322,
 &end
#
#  139 PHE  HB+         140 LYS  HN          5.50    (#   2131:10  Unique         2.76, 3.93 A)
 &rst
  ixpk= 2131, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2273,2274,
 &end
#
#  140 LYS  HB+         140 LYS  HN          4.50    (#   2132:10  Unique         2.07, 2.61 A)
 &rst
  ixpk= 2132, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2293,2294,
 &end
#
#  140 LYS  HB-         140 LYS  HN          5.50    (#   2133:10  Unique         2.07, 2.61 A)
 &rst
  ixpk= 2133, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2293,2294,
 &end
#
#  137 VAL  MGY         140 LYS  HN          5.50    (#   2134:10  Unique         1.99, 4.15 A)
 &rst
  ixpk= 2134, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  137 VAL  MGX         140 LYS  HN          3.50    (#   2135:10  Unique         1.99, 4.15 A)
 &rst
  ixpk= 2135, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#  142 ASP  HN          141 ARG  HN          4.50    (#   2136:10  Unique         2.25, 2.76 A)
 &rst
  ixpk= 2136, nxpk= 10, iat=2335,2311, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  143 VAL  HN          141 ARG  HN          5.50    (#   2137:10  Unique         4.09, 4.47 A)
 &rst
  ixpk= 2137, nxpk= 10, iat=2347,2311, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  140 LYS  HN          141 ARG  HN          3.50    (#   2138:10  Unique         2.10, 2.47 A)
 &rst
  ixpk= 2138, nxpk= 10, iat=2289,2311, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2142   141 ARG  HN          4.50    (#   2142:10  Single Ambig)
 &rst
  ixpk= 2142, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2291,2244,
 &end
#
#  138 SER  HA          141 ARG  HN          5.50    (#   2143:10  Unique         3.43, 4.08 A)
 &rst
  ixpk= 2143, nxpk= 10, iat=2260,2311, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HA          141 ARG  HN          4.50    (#   2144:10  Unique         2.74, 2.77 A)
 &rst
  ixpk= 2144, nxpk= 10, iat=2313,2311, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2145   141 ARG  HN          4.50    (#   2145:10  Single Ambig)
 &rst
  ixpk= 2145, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2367,2368,1326,1327,
 &end
#
#    0 AMB  10-2:2146   141 ARG  HN          5.50    (#   2146:10  Single Ambig)
 &rst
  ixpk= 2146, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2339,2340,2339,2340,2302,2303,2302,2303,
 &end
#
#  137 VAL  HB          141 ARG  HN          5.50    (#   2148:10  Unique         1.95, 3.34 A)
 &rst
  ixpk= 2148, nxpk= 10, iat=2246,2311, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HB+         141 ARG  HN          3.50    (#   2149:10  Unique         2.06, 2.95 A)
 &rst
  ixpk= 2149, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2315,2316,
 &end
#
#    0 AMB  10-2:2150   141 ARG  HN          3.50    (#   2150:10  Single Ambig)
 &rst
  ixpk= 2150, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2318,2319,2315,2316,
 &end
#
#  141 ARG  HG-         141 ARG  HN          4.50    (#   2151:10  Unique         1.91, 3.30 A)
 &rst
  ixpk= 2151, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2318,2319,
 &end
#
#    0 AMB  10-2:2153   141 ARG  HN          3.50    (#   2153:10  Single Ambig)
 &rst
  ixpk= 2153, nxpk= 10, iat=  -1,2311, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1=2248,2249,2250,2252,2253,2254,2296,2297,2296,2297,
      
 &end
#
#  145 ARG  HN          142 ASP  HN          5.50    (#   2154:10  Unique         4.66, 4.83 A)
 &rst
  ixpk= 2154, nxpk= 10, iat=2384,2335, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HN          142 ASP  HN          4.50    (#   2155:10  Unique         2.47, 2.87 A)
 &rst
  ixpk= 2155, nxpk= 10, iat=2347,2335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2156   142 ASP  HN          5.50    (#   2156:10  Single Ambig)
 &rst
  ixpk= 2156, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2289,2421,
 &end
#
#  141 ARG  HN          142 ASP  HN          4.50    (#   2157:10  Unique         2.25, 2.76 A)
 &rst
  ixpk= 2157, nxpk= 10, iat=2311,2335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  142 ASP  HA          142 ASP  HN          3.50    (#   2160:10  Unique         2.68, 2.75 A)
 &rst
  ixpk= 2160, nxpk= 10, iat=2337,2335, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  140 LYS  HA          142 ASP  HN          4.50    (#   2161:10  Unique         3.60, 4.03 A)
 &rst
  ixpk= 2161, nxpk= 10, iat=2291,2335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2162   142 ASP  HN          5.50    (#   2162:10  Single Ambig)
 &rst
  ixpk= 2162, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2260,2386,
 &end
#
#  141 ARG  HA          142 ASP  HN          4.50    (#   2163:10  Unique         3.42, 3.51 A)
 &rst
  ixpk= 2163, nxpk= 10, iat=2313,2335, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2164   142 ASP  HN          4.50    (#   2164:10  Single Ambig)
 &rst
  ixpk= 2164, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2367,2368,2418,2419,2418,2419,
 &end
#
#    0 AMB  10-2:2165   142 ASP  HN          2.80    (#   2165:10  Single Ambig)
 &rst
  ixpk= 2165, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2339,2340,2339,2340,
 &end
#
#  141 ARG  HB+         142 ASP  HN          3.50    (#   2167:10  Unique         2.23, 3.56 A)
 &rst
  ixpk= 2167, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2315,2316,
 &end
#
#    0 AMB  10-2:2168   142 ASP  HN          3.50    (#   2168:10  Single Ambig)
 &rst
  ixpk= 2168, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2318,2319,2315,2316,
 &end
#
#  141 ARG  HG-         142 ASP  HN          5.50    (#   2169:10  Unique         1.95, 3.73 A)
 &rst
  ixpk= 2169, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2318,2319,
 &end
#
#    0 AMB  10-2:2170   142 ASP  HN          4.50    (#   2170:10  Single Ambig)
 &rst
  ixpk= 2170, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#    0 AMB  10-2:2171   142 ASP  HN          5.50    (#   2171:10  Single Ambig)
 &rst
  ixpk= 2171, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2232,2233,2234,2236,2237,2238,2296,2297,
 &end
#
#    0 AMB  10-2:2172   143 VAL  HN          5.50    (#   2172:10  Single Ambig)
 &rst
  ixpk= 2172, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  10-2:2173   143 VAL  HN          2.80    (#   2173:10  Single Ambig)
 &rst
  ixpk= 2173, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  143 VAL  HB          143 VAL  HN          3.50    (#   2174:10  Unique         2.35, 2.52 A)
 &rst
  ixpk= 2174, nxpk= 10, iat=2351,2347, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2175   143 VAL  HN          5.50    (#   2175:10  Single Ambig)
 &rst
  ixpk= 2175, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2388,2389,2388,2389,
 &end
#
#    0 AMB  10-2:2176   143 VAL  HN          5.50    (#   2176:10  Single Ambig)
 &rst
  ixpk= 2176, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2412,2413,2412,2413,2415,2416,
 &end
#
#    0 AMB  10-2:2177   143 VAL  HN          3.50    (#   2177:10  Single Ambig)
 &rst
  ixpk= 2177, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2339,2340,2339,2340,
 &end
#
#    0 AMB  10-2:2178   143 VAL  HN          5.50    (#   2178:10  Single Ambig)
 &rst
  ixpk= 2178, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2418,2419,2418,2419,2367,2368,
 &end
#
#  143 VAL  HA          143 VAL  HN          4.50    (#   2179:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 2179, nxpk= 10, iat=2349,2347, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  140 LYS  HA          143 VAL  HN          5.50    (#   2180:10  Unique         3.35, 3.59 A)
 &rst
  ixpk= 2180, nxpk= 10, iat=2291,2347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  142 ASP  HA          143 VAL  HN          5.50    (#   2181:10  Unique         3.51, 3.54 A)
 &rst
  ixpk= 2181, nxpk= 10, iat=2337,2347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 TYR  HD          143 VAL  HN          5.50    (#   2183:10  Unique         5.04, 6.18 A)
 &rst
  ixpk= 2183, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1226,1235,
 &end
#
#    0 AMB  10-2:2184   143 VAL  HN          5.50    (#   2184:10  Single Ambig)
 &rst
  ixpk= 2184, nxpk= 10, iat=  -1,2347, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2311,2279,2283,
 &end
#
#  142 ASP  HN          143 VAL  HN          3.50    (#   2185:10  Unique         2.47, 2.87 A)
 &rst
  ixpk= 2185, nxpk= 10, iat=2335,2347, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  145 ARG  HN          143 VAL  HN          5.50    (#   2186:10  Unique         3.73, 3.99 A)
 &rst
  ixpk= 2186, nxpk= 10, iat=2384,2347, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 ARG  HN          144 TYR  HN          5.50    (#   2187:10  Unique         2.72, 2.79 A)
 &rst
  ixpk= 2187, nxpk= 10, iat=2384,2363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  143 VAL  HN          144 TYR  HN          5.50    (#   2188:10  Unique         2.44, 2.77 A)
 &rst
  ixpk= 2188, nxpk= 10, iat=2347,2363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HD          144 TYR  HN          5.50    (#   2190:10  Unique         3.45, 4.24 A)
 &rst
  ixpk= 2190, nxpk= 10, iat=  -1,2363, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  144 TYR  HA          144 TYR  HN          4.50    (#   2191:10  Unique         2.74, 2.76 A)
 &rst
  ixpk= 2191, nxpk= 10, iat=2365,2363, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  141 ARG  HA          144 TYR  HN          5.50    (#   2192:10  Unique         2.98, 3.48 A)
 &rst
  ixpk= 2192, nxpk= 10, iat=2313,2363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HB+         144 TYR  HN          4.50    (#   2193:10  Unique         2.07, 2.71 A)
 &rst
  ixpk= 2193, nxpk= 10, iat=  -1,2363, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2367,2368,
 &end
#
#  144 TYR  HB-         144 TYR  HN          5.50    (#   2194:10  Unique         2.07, 2.71 A)
 &rst
  ixpk= 2194, nxpk= 10, iat=  -1,2363, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#  143 VAL  HB          144 TYR  HN          5.50    (#   2195:10  Unique         2.01, 2.43 A)
 &rst
  ixpk= 2195, nxpk= 10, iat=2351,2363, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2196   144 TYR  HN          5.50    (#   2196:10  Single Ambig)
 &rst
  ixpk= 2196, nxpk= 10, iat=  -1,2363, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2388,2389,2388,2389,
 &end
#
#    0 AMB  10-2:2197   144 TYR  HN          3.50    (#   2197:10  Single Ambig)
 &rst
  ixpk= 2197, nxpk= 10, iat=  -1,2363, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  144 TYR  HN          145 ARG  HN          4.50    (#   2199:10  Unique         2.72, 2.79 A)
 &rst
  ixpk= 2199, nxpk= 10, iat=2363,2384, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  146 ARG  HN          145 ARG  HN          5.50    (#   2200:10  Unique         2.51, 2.73 A)
 &rst
  ixpk= 2200, nxpk= 10, iat=2408,2384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  144 TYR  HD          145 ARG  HN          5.50    (#   2201:10  Unique         4.80, 5.25 A)
 &rst
  ixpk= 2201, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  142 ASP  HA          145 ARG  HN          5.50    (#   2202:10  Unique         3.56, 3.81 A)
 &rst
  ixpk= 2202, nxpk= 10, iat=2337,2384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 ARG  HA          145 ARG  HN          4.50    (#   2203:10  Unique         2.73, 2.77 A)
 &rst
  ixpk= 2203, nxpk= 10, iat=2386,2384, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  144 TYR  HA          145 ARG  HN          5.50    (#   2204:10  Unique         3.45, 3.51 A)
 &rst
  ixpk= 2204, nxpk= 10, iat=2365,2384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HA          145 ARG  HN          5.50    (#   2205:10  Unique         3.57, 4.05 A)
 &rst
  ixpk= 2205, nxpk= 10, iat=2313,2384, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2206   145 ARG  HN          4.50    (#   2206:10  Single Ambig)
 &rst
  ixpk= 2206, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2367,2368,2394,2395,2394,2395,
 &end
#
#    0 AMB  10-2:2207   145 ARG  HN          5.50    (#   2207:10  Single Ambig)
 &rst
  ixpk= 2207, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2339,2340,2339,2340,2302,2303,
 &end
#
#  144 TYR  HB-         145 ARG  HN          5.50    (#   2208:10  Unique         2.85, 3.16 A)
 &rst
  ixpk= 2208, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2367,2368,
 &end
#
#    0 AMB  10-2:2209   145 ARG  HN          2.80    (#   2209:10  Single Ambig)
 &rst
  ixpk= 2209, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2388,2389,2388,2389,
 &end
#
#  145 ARG  HG+         145 ARG  HN          3.50    (#   2210:10  Unique         1.94, 3.90 A)
 &rst
  ixpk= 2210, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2391,2392,
 &end
#
#    0 AMB  10-2:2211   145 ARG  HN          4.50    (#   2211:10  Single Ambig)
 &rst
  ixpk= 2211, nxpk= 10, iat=  -1,2384, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2175,2176,2177,2179,2180,2181,2175,2176,2177,2179,
      2180,2181,
 &end
#
#  145 ARG  HN          146 ARG  HN          4.50    (#   2212:10  Unique         2.51, 2.73 A)
 &rst
  ixpk= 2212, nxpk= 10, iat=2384,2408, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2213   146 ARG  HN          5.50    (#   2213:10  Single Ambig)
 &rst
  ixpk= 2213, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2363,2465,
 &end
#
#  147 VAL  HN          146 ARG  HN          4.50    (#   2214:10  Unique         2.20, 2.31 A)
 &rst
  ixpk= 2214, nxpk= 10, iat=2432,2408, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  144 TYR  HD          146 ARG  HN          5.50    (#   2216:10  Unique         5.25, 6.42 A)
 &rst
  ixpk= 2216, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  142 ASP  HA          146 ARG  HN          5.50    (#   2217:10  Unique         4.93, 5.24 A)
 &rst
  ixpk= 2217, nxpk= 10, iat=2337,2408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HA          146 ARG  HN          3.50    (#   2218:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 2218, nxpk= 10, iat=2410,2408, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  143 VAL  HA          146 ARG  HN          5.50    (#   2219:10  Unique         3.40, 3.66 A)
 &rst
  ixpk= 2219, nxpk= 10, iat=2349,2408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2220   146 ARG  HN          4.50    (#   2220:10  Single Ambig)
 &rst
  ixpk= 2220, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2418,2419,2418,2419,
 &end
#
#    0 AMB  10-2:2221   146 ARG  HN          5.50    (#   2221:10  Single Ambig)
 &rst
  ixpk= 2221, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2339,2340,2339,2340,
 &end
#
#    0 AMB  10-2:2222   146 ARG  HN          3.50    (#   2222:10  Single Ambig)
 &rst
  ixpk= 2222, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2388,2389,2388,2389,
 &end
#
#    0 AMB  10-2:2223   146 ARG  HN          2.80    (#   2223:10  Single Ambig)
 &rst
  ixpk= 2223, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2412,2413,2412,2413,2415,2416,
 &end
#
#  143 VAL  HB          146 ARG  HN          5.50    (#   2224:10  Unique         5.31, 5.47 A)
 &rst
  ixpk= 2224, nxpk= 10, iat=2351,2408, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HG-         146 ARG  HN          3.50    (#   2225:10  Unique         2.30, 3.37 A)
 &rst
  ixpk= 2225, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2415,2416,
 &end
#
#    0 AMB  10-2:2226   146 ARG  HN          4.50    (#   2226:10  Single Ambig)
 &rst
  ixpk= 2226, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,2436,
 &end
#
#    0 AMB  10-2:2227   146 ARG  HN          4.50    (#   2227:10  Single Ambig)
 &rst
  ixpk= 2227, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1184,1185,1186,1188,1189,1190,2175,2176,2177,2179,
      2180,2181,
 &end
#
#  147 VAL  MGY         146 ARG  HN          5.50    (#   2228:10  Unique         3.25, 5.72 A)
 &rst
  ixpk= 2228, nxpk= 10, iat=  -1,2408, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  146 ARG  HN          147 VAL  HN          4.50    (#   2230:10  Unique         2.20, 2.31 A)
 &rst
  ixpk= 2230, nxpk= 10, iat=2408,2432, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  144 TYR  HD          147 VAL  HN          5.50    (#   2231:10  Unique         4.17, 5.70 A)
 &rst
  ixpk= 2231, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#  146 ARG  HA          147 VAL  HN          4.50    (#   2232:10  Unique         3.35, 3.49 A)
 &rst
  ixpk= 2232, nxpk= 10, iat=2410,2432, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  144 TYR  HA          147 VAL  HN          4.50    (#   2233:10  Unique         2.82, 3.02 A)
 &rst
  ixpk= 2233, nxpk= 10, iat=2365,2432, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2234   147 VAL  HN          5.50    (#   2234:10  Single Ambig)
 &rst
  ixpk= 2234, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2418,2419,2418,2419,2367,2368,
 &end
#
#  147 VAL  HA          147 VAL  HN          4.50    (#   2235:10  Unique         2.73, 2.81 A)
 &rst
  ixpk= 2235, nxpk= 10, iat=2434,2432, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  148 MET  HG+         147 VAL  HN          5.50    (#   2236:10  Unique         3.66, 5.04 A)
 &rst
  ixpk= 2236, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2455,2456,
 &end
#
#    0 AMB  10-2:2237   147 VAL  HN          3.50    (#   2237:10  Single Ambig)
 &rst
  ixpk= 2237, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2415,2416,2412,2413,2412,2413,
 &end
#
#  146 ARG  HG-         147 VAL  HN          4.50    (#   2238:10  Unique         2.03, 4.17 A)
 &rst
  ixpk= 2238, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2415,2416,
 &end
#
#  147 VAL  HB          147 VAL  HN          3.50    (#   2239:10  Unique         2.49, 2.57 A)
 &rst
  ixpk= 2239, nxpk= 10, iat=2436,2432, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2240   147 VAL  HN          4.50    (#   2240:10  Single Ambig)
 &rst
  ixpk= 2240, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#  147 VAL  MGX         147 VAL  HN          4.50    (#   2241:10  Unique         1.90, 3.75 A)
 &rst
  ixpk= 2241, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         147 VAL  HN          3.50    (#   2242:10  Unique         1.90, 3.75 A)
 &rst
  ixpk= 2242, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         148 MET  HN          5.50    (#   2243:10  Unique         1.97, 4.64 A)
 &rst
  ixpk= 2243, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGX         148 MET  HN          5.50    (#   2244:10  Unique         1.97, 4.64 A)
 &rst
  ixpk= 2244, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  133 VAL  MGX         148 MET  HN          5.50    (#   2245:10  Unique         4.18, 6.33 A)
 &rst
  ixpk= 2245, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  147 VAL  HB          148 MET  HN          4.50    (#   2246:10  Unique         2.30, 2.98 A)
 &rst
  ixpk= 2246, nxpk= 10, iat=2436,2448, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  148 MET  HB-         148 MET  HN          5.50    (#   2247:10  Unique         2.20, 3.09 A)
 &rst
  ixpk= 2247, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2452,2453,
 &end
#
#    0 AMB  10-2:2248   148 MET  HN          5.50    (#   2248:10  Single Ambig)
 &rst
  ixpk= 2248, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2491,2492,2415,2416,
 &end
#
#  148 MET  HB+         148 MET  HN          4.50    (#   2249:10  Unique         2.20, 3.09 A)
 &rst
  ixpk= 2249, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2452,2453,
 &end
#
#  148 MET  HG-         148 MET  HN          4.50    (#   2250:10  Unique         1.92, 3.02 A)
 &rst
  ixpk= 2250, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2455,2456,
 &end
#
#  148 MET  HG+         148 MET  HN          5.50    (#   2251:10  Unique         1.92, 3.02 A)
 &rst
  ixpk= 2251, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2455,2456,
 &end
#
#  147 VAL  HA          148 MET  HN          5.50    (#   2252:10  Unique         3.37, 3.47 A)
 &rst
  ixpk= 2252, nxpk= 10, iat=2434,2448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2253   148 MET  HN          5.50    (#   2253:10  Single Ambig)
 &rst
  ixpk= 2253, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2367,2368,2418,2419,2418,2419,
 &end
#
#  144 TYR  HA          148 MET  HN          5.50    (#   2254:10  Unique         3.45, 4.31 A)
 &rst
  ixpk= 2254, nxpk= 10, iat=2365,2448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  145 ARG  HA          148 MET  HN          5.50    (#   2255:10  Unique         3.52, 4.01 A)
 &rst
  ixpk= 2255, nxpk= 10, iat=2386,2448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  148 MET  HA          148 MET  HN          5.50    (#   2256:10  Unique         2.77, 2.87 A)
 &rst
  ixpk= 2256, nxpk= 10, iat=2450,2448, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2257   148 MET  HN          5.50    (#   2257:10  Single Ambig)
 &rst
  ixpk= 2257, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2099,2104,2097,2106,
 &end
#
#  144 TYR  HD          148 MET  HN          5.50    (#   2258:10  Unique         3.10, 5.99 A)
 &rst
  ixpk= 2258, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2371,2380,
 &end
#
#    0 AMB  10-2:2261   148 MET  HN          5.50    (#   2261:10  Single Ambig)
 &rst
  ixpk= 2261, nxpk= 10, iat=  -1,2448, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2487,2408,
 &end
#
#  149 LYS  HN          148 MET  HN          4.50    (#   2262:10  Unique         2.36, 2.62 A)
 &rst
  ixpk= 2262, nxpk= 10, iat=2465,2448, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  148 MET  HN          149 LYS  HN          5.50    (#   2263:10  Unique         2.36, 2.62 A)
 &rst
  ixpk= 2263, nxpk= 10, iat=2448,2465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HN          149 LYS  HN          4.50    (#   2264:10  Unique         2.52, 2.67 A)
 &rst
  ixpk= 2264, nxpk= 10, iat=2487,2465, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  149 LYS  HA          149 LYS  HN          4.50    (#   2266:10  Unique         2.73, 2.80 A)
 &rst
  ixpk= 2266, nxpk= 10, iat=2467,2465, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  148 MET  HA          149 LYS  HN          5.50    (#   2267:10  Unique         3.53, 3.56 A)
 &rst
  ixpk= 2267, nxpk= 10, iat=2450,2465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HA          149 LYS  HN          5.50    (#   2268:10  Unique         5.04, 5.20 A)
 &rst
  ixpk= 2268, nxpk= 10, iat=2489,2465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HA          149 LYS  HN          5.50    (#   2269:10  Unique         3.11, 3.51 A)
 &rst
  ixpk= 2269, nxpk= 10, iat=2410,2465, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HB-         149 LYS  HN          2.80    (#   2270:10  Unique         2.14, 2.55 A)
 &rst
  ixpk= 2270, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2469,2470,
 &end
#
#  149 LYS  HB+         149 LYS  HN          2.80    (#   2271:10  Unique         2.14, 2.55 A)
 &rst
  ixpk= 2271, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2469,2470,
 &end
#
#    0 AMB  10-2:2272   149 LYS  HN          4.50    (#   2272:10  Single Ambig)
 &rst
  ixpk= 2272, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2472,2473,2475,2476,
 &end
#
#    0 AMB  10-2:2273   149 LYS  HN          5.50    (#   2273:10  Single Ambig)
 &rst
  ixpk= 2273, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=2526,2527,2528,2391,2392,2491,2492,
 &end
#
#  148 MET  HB-         149 LYS  HN          5.50    (#   2274:10  Unique         2.05, 2.87 A)
 &rst
  ixpk= 2274, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2452,2453,
 &end
#
#    0 AMB  10-2:2275   149 LYS  HN          5.50    (#   2275:10  Single Ambig)
 &rst
  ixpk= 2275, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2175,2176,2177,2179,2180,2181,2175,2176,2177,2179,
      2180,2181,
 &end
#
#  149 LYS  HN          150 GLU  HN          4.50    (#   2276:10  Unique         2.52, 2.67 A)
 &rst
  ixpk= 2276, nxpk= 10, iat=2465,2487, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  147 VAL  HN          150 GLU  HN          5.50    (#   2277:10  Unique         4.38, 4.82 A)
 &rst
  ixpk= 2277, nxpk= 10, iat=2432,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  130 TRP  HH2         150 GLU  HN          5.50    (#   2278:10  Unique         5.06, 5.37 A)
 &rst
  ixpk= 2278, nxpk= 10, iat=2125,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  151 PHE  HA          150 GLU  HN          5.50    (#   2280:10  Unique         4.88, 5.29 A)
 &rst
  ixpk= 2280, nxpk= 10, iat=2504,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HA          150 GLU  HN          5.50    (#   2281:10  Unique         3.30, 3.43 A)
 &rst
  ixpk= 2281, nxpk= 10, iat=2467,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HA          150 GLU  HN          3.50    (#   2282:10  Unique         2.74, 2.80 A)
 &rst
  ixpk= 2282, nxpk= 10, iat=2489,2487, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  146 ARG  HA          150 GLU  HN          5.50    (#   2283:10  Unique         3.64, 4.13 A)
 &rst
  ixpk= 2283, nxpk= 10, iat=2410,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2284   150 GLU  HN          5.50    (#   2284:10  Single Ambig)
 &rst
  ixpk= 2284, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2506,2507,2394,2395,2394,2395,1123,1124,1123,1124,
      2418,2419,
 &end
#
#  147 VAL  HA          150 GLU  HN          5.50    (#   2285:10  Unique         3.48, 3.79 A)
 &rst
  ixpk= 2285, nxpk= 10, iat=2434,2487, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HG+         150 GLU  HN          4.50    (#   2286:10  Unique         2.29, 3.20 A)
 &rst
  ixpk= 2286, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2494,2495,
 &end
#
#  150 GLU  HG-         150 GLU  HN          3.50    (#   2287:10  Unique         2.29, 3.20 A)
 &rst
  ixpk= 2287, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2494,2495,
 &end
#
#  150 GLU  HB+         150 GLU  HN          2.80    (#   2288:10  Unique         2.07, 2.89 A)
 &rst
  ixpk= 2288, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2491,2492,
 &end
#
#  150 GLU  HB-         150 GLU  HN          2.80    (#   2289:10  Unique         2.07, 2.89 A)
 &rst
  ixpk= 2289, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2491,2492,
 &end
#
#  147 VAL  MGX         150 GLU  HN          5.50    (#   2292:10  Unique         4.48, 6.27 A)
 &rst
  ixpk= 2292, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         150 GLU  HN          5.50    (#   2293:10  Unique         4.48, 6.27 A)
 &rst
  ixpk= 2293, nxpk= 10, iat=  -1,2487, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  153 SER  HN          151 PHE  HN          5.50    (#   2294:10  Unique         4.56, 5.05 A)
 &rst
  ixpk= 2294, nxpk= 10, iat=2532,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HN          151 PHE  HN          5.50    (#   2295:10  Unique         4.22, 4.88 A)
 &rst
  ixpk= 2295, nxpk= 10, iat=2465,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  HN          151 PHE  HN          3.50    (#   2296:10  Unique         2.18, 2.62 A)
 &rst
  ixpk= 2296, nxpk= 10, iat=2522,2502, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  151 PHE  HA          151 PHE  HN          4.50    (#   2298:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 2298, nxpk= 10, iat=2504,2502, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  150 GLU  HA          151 PHE  HN          4.50    (#   2299:10  Unique         3.47, 3.56 A)
 &rst
  ixpk= 2299, nxpk= 10, iat=2489,2502, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  148 MET  HA          151 PHE  HN          5.50    (#   2300:10  Unique         3.53, 3.92 A)
 &rst
  ixpk= 2300, nxpk= 10, iat=2450,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HA          151 PHE  HN          5.50    (#   2301:10  Unique         4.16, 4.69 A)
 &rst
  ixpk= 2301, nxpk= 10, iat=2467,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  HA          151 PHE  HN          5.50    (#   2302:10  Unique         4.16, 4.33 A)
 &rst
  ixpk= 2302, nxpk= 10, iat=2524,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  151 PHE  HB+         151 PHE  HN          4.50    (#   2303:10  Unique         2.60, 3.36 A)
 &rst
  ixpk= 2303, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2506,2507,
 &end
#
#  151 PHE  HB-         151 PHE  HN          4.50    (#   2304:10  Unique         2.60, 3.36 A)
 &rst
  ixpk= 2304, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2506,2507,
 &end
#
#  147 VAL  HA          151 PHE  HN          5.50    (#   2305:10  Unique         3.91, 4.76 A)
 &rst
  ixpk= 2305, nxpk= 10, iat=2434,2502, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  150 GLU  HG+         151 PHE  HN          5.50    (#   2306:10  Unique         4.28, 4.62 A)
 &rst
  ixpk= 2306, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2494,2495,
 &end
#
#  150 GLU  HB+         151 PHE  HN          4.50    (#   2307:10  Unique         2.17, 2.72 A)
 &rst
  ixpk= 2307, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2491,2492,
 &end
#
#    0 AMB  10-2:2308   151 PHE  HN          4.50    (#   2308:10  Single Ambig)
 &rst
  ixpk= 2308, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2494,2495,2469,2470,
 &end
#
#  150 GLU  HB-         151 PHE  HN          3.50    (#   2309:10  Unique         2.17, 2.72 A)
 &rst
  ixpk= 2309, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2491,2492,
 &end
#
#    0 AMB  10-2:2310   151 PHE  HN          4.50    (#   2310:10  Single Ambig)
 &rst
  ixpk= 2310, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=2549,2550,2551,2553,2554,2555,1667,2565,2566,2567,
      2569,2570,2571,1664,1665,
 &end
#
#    0 AMB  10-2:2311   151 PHE  HN          5.50    (#   2311:10  Single Ambig)
 &rst
  ixpk= 2311, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675, 204, 205, 206, 208,
       209, 210,
 &end
#
#  147 VAL  MGX         151 PHE  HN          5.50    (#   2312:10  Unique         4.04, 6.70 A)
 &rst
  ixpk= 2312, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  147 VAL  MGY         151 PHE  HN          5.50    (#   2313:10  Unique         4.04, 6.70 A)
 &rst
  ixpk= 2313, nxpk= 10, iat=  -1,2502, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#  153 SER  HN          152 ALA  HN          4.50    (#   2314:10  Unique         2.51, 2.74 A)
 &rst
  ixpk= 2314, nxpk= 10, iat=2532,2522, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  151 PHE  HN          152 ALA  HN          4.50    (#   2316:10  Unique         2.18, 2.62 A)
 &rst
  ixpk= 2316, nxpk= 10, iat=2502,2522, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  154 VAL  HN          152 ALA  HN          5.50    (#   2317:10  Unique         3.54, 3.88 A)
 &rst
  ixpk= 2317, nxpk= 10, iat=2543,2522, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HE          152 ALA  HN          5.50    (#   2320:10  Unique         3.45, 5.48 A)
 &rst
  ixpk= 2320, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2104,
 &end
#
#  151 PHE  HA          152 ALA  HN          5.50    (#   2321:10  Unique         2.71, 2.88 A)
 &rst
  ixpk= 2321, nxpk= 10, iat=2504,2522, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HA          152 ALA  HN          5.50    (#   2323:10  Unique         2.99, 3.41 A)
 &rst
  ixpk= 2323, nxpk= 10, iat=2467,2522, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2324   152 ALA  HN          5.50    (#   2324:10  Single Ambig)
 &rst
  ixpk= 2324, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2489,2534,
 &end
#
#    0 AMB  10-2:2325   152 ALA  HN          5.50    (#   2325:10  Single Ambig)
 &rst
  ixpk= 2325, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2536,2537,2536,2537,
 &end
#
#  152 ALA  HA          152 ALA  HN          4.50    (#   2326:10  Unique         2.74, 2.79 A)
 &rst
  ixpk= 2326, nxpk= 10, iat=2524,2522, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  151 PHE  HB+         152 ALA  HN          5.50    (#   2327:10  Unique         3.99, 4.36 A)
 &rst
  ixpk= 2327, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2506,2507,
 &end
#
#  151 PHE  HB-         152 ALA  HN          5.50    (#   2328:10  Unique         3.99, 4.36 A)
 &rst
  ixpk= 2328, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2506,2507,
 &end
#
#    0 AMB  10-2:2330   152 ALA  HN          5.50    (#   2330:10  Single Ambig)
 &rst
  ixpk= 2330, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2547,2586,2587,2588,
 &end
#
#  152 ALA  MB          152 ALA  HN          2.80    (#   2331:10  Unique         2.07, 2.88 A)
 &rst
  ixpk= 2331, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=2526,2527,2528,
 &end
#
#    0 AMB  10-2:2332   152 ALA  HN          5.50    (#   2332:10  Single Ambig)
 &rst
  ixpk= 2332, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2549,2550,2551,2553,2554,2555,2565,2566,2567,2569,
      2570,2571,
 &end
#
#  154 VAL  MGY         152 ALA  HN          5.50    (#   2333:10  Unique         4.09, 6.50 A)
 &rst
  ixpk= 2333, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#    0 AMB  10-2:2334   152 ALA  HN          5.50    (#   2334:10  Single Ambig)
 &rst
  ixpk= 2334, nxpk= 10, iat=  -1,2522, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1669,1670,1671,1673,1674,1675, 204, 205, 206, 208,
       209, 210,
 &end
#
#  156 MET  HN          153 SER  HN          5.50    (#   2335:10  Unique         4.58, 4.98 A)
 &rst
  ixpk= 2335, nxpk= 10, iat=2575,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  151 PHE  HN          153 SER  HN          5.50    (#   2336:10  Unique         4.56, 5.05 A)
 &rst
  ixpk= 2336, nxpk= 10, iat=2502,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  HN          153 SER  HN          3.50    (#   2337:10  Unique         2.51, 2.74 A)
 &rst
  ixpk= 2337, nxpk= 10, iat=2522,2532, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  154 VAL  HN          153 SER  HN          3.50    (#   2338:10  Unique         2.29, 2.39 A)
 &rst
  ixpk= 2338, nxpk= 10, iat=2543,2532, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2341   153 SER  HN          5.50    (#   2341:10  Single Ambig)
 &rst
  ixpk= 2341, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2099,2104,2097,2106,
 &end
#
#  151 PHE  HA          153 SER  HN          5.50    (#   2342:10  Unique         3.13, 3.58 A)
 &rst
  ixpk= 2342, nxpk= 10, iat=2504,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  149 LYS  HA          153 SER  HN          5.50    (#   2344:10  Unique         4.44, 5.18 A)
 &rst
  ixpk= 2344, nxpk= 10, iat=2467,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  153 SER  HA          153 SER  HN          2.80    (#   2345:10  Unique         2.84, 2.89 A)
 &rst
  ixpk= 2345, nxpk= 10, iat=2534,2532, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:2346   153 SER  HN          2.80    (#   2346:10  Single Ambig)
 &rst
  ixpk= 2346, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2536,2537,2536,2537,
 &end
#
#  154 VAL  HA          153 SER  HN          5.50    (#   2347:10  Unique         4.76, 4.95 A)
 &rst
  ixpk= 2347, nxpk= 10, iat=2545,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  HA          153 SER  HN          4.50    (#   2348:10  Unique         3.45, 3.53 A)
 &rst
  ixpk= 2348, nxpk= 10, iat=2524,2532, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  156 MET  HG-         153 SER  HN          5.50    (#   2349:10  Unique         4.40, 5.29 A)
 &rst
  ixpk= 2349, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#    0 AMB  10-2:2350   153 SER  HN          4.50    (#   2350:10  Single Ambig)
 &rst
  ixpk= 2350, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2579,2580,2579,2580,
 &end
#
#  154 VAL  HB          153 SER  HN          5.50    (#   2351:10  Unique         4.53, 4.58 A)
 &rst
  ixpk= 2351, nxpk= 10, iat=2547,2532, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  152 ALA  MB          153 SER  HN          2.80    (#   2352:10  Unique         2.39, 3.43 A)
 &rst
  ixpk= 2352, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=2526,2527,2528,
 &end
#
#    0 AMB  10-2:2353   153 SER  HN          4.50    (#   2353:10  Single Ambig)
 &rst
  ixpk= 2353, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2549,2550,2551,2553,2554,2555,2565,2566,2567,2569,
      2570,2571,
 &end
#
#  154 VAL  MGY         153 SER  HN          5.50    (#   2354:10  Unique         3.48, 5.83 A)
 &rst
  ixpk= 2354, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#  101 LEU  MDY         154 VAL  HN          5.50    (#   2355:10  Unique         4.06, 6.65 A)
 &rst
  ixpk= 2355, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  154 VAL  MGY         154 VAL  HN          3.50    (#   2356:10  Unique         2.08, 3.85 A)
 &rst
  ixpk= 2356, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#  154 VAL  MGX         154 VAL  HN          2.80    (#   2357:10  Unique         2.08, 3.85 A)
 &rst
  ixpk= 2357, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2549,2550,2551,2553,2554,2555,
 &end
#
#    0 AMB  10-2:2359   154 VAL  HN          4.50    (#   2359:10  Single Ambig)
 &rst
  ixpk= 2359, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2526,2527,2528,2563,
 &end
#
#  154 VAL  HB          154 VAL  HN          3.50    (#   2360:10  Unique         2.38, 2.47 A)
 &rst
  ixpk= 2360, nxpk= 10, iat=2547,2543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  155 VAL  HA          154 VAL  HN          5.50    (#   2361:10  Unique         4.89, 5.25 A)
 &rst
  ixpk= 2361, nxpk= 10, iat=2561,2543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  154 VAL  HA          154 VAL  HN          3.50    (#   2363:10  Unique         2.74, 2.83 A)
 &rst
  ixpk= 2363, nxpk= 10, iat=2545,2543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2364   154 VAL  HN          4.50    (#   2364:10  Single Ambig)
 &rst
  ixpk= 2364, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2536,2537,2536,2537,
 &end
#
#  153 SER  HA          154 VAL  HN          4.50    (#   2365:10  Unique         3.31, 3.41 A)
 &rst
  ixpk= 2365, nxpk= 10, iat=2534,2543, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  151 PHE  HA          154 VAL  HN          5.50    (#   2366:10  Unique         2.89, 3.11 A)
 &rst
  ixpk= 2366, nxpk= 10, iat=2504,2543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2367   154 VAL  HN          5.50    (#   2367:10  Single Ambig)
 &rst
  ixpk= 2367, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2099,2104,2097,2106,
 &end
#
#  156 MET  HN          154 VAL  HN          5.50    (#   2370:10  Unique         3.53, 4.08 A)
 &rst
  ixpk= 2370, nxpk= 10, iat=2575,2543, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  153 SER  HN          154 VAL  HN          3.50    (#   2371:10  Unique         2.29, 2.39 A)
 &rst
  ixpk= 2371, nxpk= 10, iat=2532,2543, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  153 SER  HN          155 VAL  HN          5.50    (#   2372:10  Unique         3.96, 4.37 A)
 &rst
  ixpk= 2372, nxpk= 10, iat=2532,2559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HN          155 VAL  HN          4.50    (#   2373:10  Unique         2.22, 2.48 A)
 &rst
  ixpk= 2373, nxpk= 10, iat=2575,2559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  139 PHE  HE          140 LYS  HN          4.50    (#   2374:10  Unique         3.84, 5.06 A)
 &rst
  ixpk= 2374, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2279,2283,
 &end
#
#  129 TYR  HE          155 VAL  HN          5.50    (#   2376:10  Unique         3.56, 5.60 A)
 &rst
  ixpk= 2376, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2104,
 &end
#
#    0 AMB  10-2:2377   155 VAL  HN          5.50    (#   2377:10  Single Ambig)
 &rst
  ixpk= 2377, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2577,2605,
 &end
#
#    0 AMB  10-2:2378   155 VAL  HN          5.50    (#   2378:10  Single Ambig)
 &rst
  ixpk= 2378, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 301, 302,2536,2537,2536,2537,
 &end
#
#  154 VAL  HA          155 VAL  HN          5.50    (#   2379:10  Unique         3.43, 3.51 A)
 &rst
  ixpk= 2379, nxpk= 10, iat=2545,2559, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  155 VAL  HA          155 VAL  HN          4.50    (#   2380:10  Unique         2.77, 2.88 A)
 &rst
  ixpk= 2380, nxpk= 10, iat=2561,2559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2381   155 VAL  HN          5.50    (#   2381:10  Single Ambig)
 &rst
  ixpk= 2381, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2582,2583, 237, 238,
 &end
#
#  156 MET  HG-         155 VAL  HN          5.50    (#   2382:10  Unique         3.86, 4.94 A)
 &rst
  ixpk= 2382, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#  154 VAL  HB          155 VAL  HN          4.50    (#   2383:10  Unique         2.04, 2.68 A)
 &rst
  ixpk= 2383, nxpk= 10, iat=2547,2559, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2384     0 AMB  10-1:2384   5.50    (#   2384:10  Double Ambig)
 &rst
  ixpk= 2384, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=2318,2319,2315,2316,1284,1285,2610,
 igr2=2289,2559,
 &end
#
#  155 VAL  HB          155 VAL  HN          3.50    (#   2385:10  Unique         2.47, 2.71 A)
 &rst
  ixpk= 2385, nxpk= 10, iat=2563,2559, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2386     0 AMB  10-1:2386   5.50    (#   2386:10  Double Ambig)
 &rst
  ixpk= 2386, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2299,2300,1082,1083,1084,
 igr2=2289,2559,
 &end
#
#    0 AMB  10-2:2387   155 VAL  HN          2.80    (#   2387:10  Single Ambig)
 &rst
  ixpk= 2387, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 &end
#
#    0 AMB  10-2:2388   155 VAL  HN          3.50    (#   2388:10  Single Ambig)
 &rst
  ixpk= 2388, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 &end
#
#  101 LEU  MDY         155 VAL  HN          4.50    (#   2389:10  Unique         2.66, 5.38 A)
 &rst
  ixpk= 2389, nxpk= 10, iat=  -1,2559, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  155 VAL  MGX         156 MET  HN          3.50    (#   2391:10  Unique         1.91, 3.95 A)
 &rst
  ixpk= 2391, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#  155 VAL  MGY         156 MET  HN          4.50    (#   2392:10  Unique         1.91, 3.95 A)
 &rst
  ixpk= 2392, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#  155 VAL  HB          156 MET  HN          3.50    (#   2393:10  Unique         2.07, 3.27 A)
 &rst
  ixpk= 2393, nxpk= 10, iat=2563,2575, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2394   156 MET  HN          5.50    (#   2394:10  Single Ambig)
 &rst
  ixpk= 2394, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2607,2608,2610,
 &end
#
#    0 AMB  10-2:2395   156 MET  HN          2.80    (#   2395:10  Single Ambig)
 &rst
  ixpk= 2395, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2579,2580,2579,2580,
 &end
#
#  156 MET  HG-         156 MET  HN          4.50    (#   2396:10  Unique         2.27, 3.05 A)
 &rst
  ixpk= 2396, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2582,2583,
 &end
#
#  156 MET  HG+         156 MET  HN          4.50    (#   2397:10  Unique         2.27, 3.05 A)
 &rst
  ixpk= 2397, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2582,2583,
 &end
#
#  155 VAL  HA          156 MET  HN          5.50    (#   2398:10  Unique         3.49, 3.54 A)
 &rst
  ixpk= 2398, nxpk= 10, iat=2561,2575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  154 VAL  HA          156 MET  HN          5.50    (#   2400:10  Unique         4.25, 4.78 A)
 &rst
  ixpk= 2400, nxpk= 10, iat=2545,2575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2401   156 MET  HN          5.50    (#   2401:10  Single Ambig)
 &rst
  ixpk= 2401, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 301, 302,2536,2537,2536,2537,
 &end
#
#  156 MET  HA          156 MET  HN          3.50    (#   2402:10  Unique         2.75, 2.82 A)
 &rst
  ixpk= 2402, nxpk= 10, iat=2577,2575, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  157 SER  HA          156 MET  HN          5.50    (#   2403:10  Unique         4.81, 5.15 A)
 &rst
  ixpk= 2403, nxpk= 10, iat=2594,2575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HE          156 MET  HN          5.50    (#   2404:10  Unique         2.90, 6.01 A)
 &rst
  ixpk= 2404, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2099,2104,
 &end
#
#    0 AMB  10-2:2405   156 MET  HN          3.50    (#   2405:10  Single Ambig)
 &rst
  ixpk= 2405, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2543,2603,
 &end
#
#  157 SER  HN          156 MET  HN          3.50    (#   2406:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 2406, nxpk= 10, iat=2592,2575, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  153 SER  HN          156 MET  HN          5.50    (#   2407:10  Unique         4.58, 4.98 A)
 &rst
  ixpk= 2407, nxpk= 10, iat=2532,2575, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HN          157 SER  HN          3.50    (#   2409:10  Unique         2.31, 2.61 A)
 &rst
  ixpk= 2409, nxpk= 10, iat=2575,2592, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  160 GLU  HN          157 SER  HN          5.50    (#   2410:10  Unique         4.65, 4.80 A)
 &rst
  ixpk= 2410, nxpk= 10, iat=2639,2592, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  158 LEU  HN          157 SER  HN          3.50    (#   2411:10  Unique         2.33, 2.60 A)
 &rst
  ixpk= 2411, nxpk= 10, iat=2603,2592, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  157 SER  HA          157 SER  HN          2.80    (#   2413:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 2413, nxpk= 10, iat=2594,2592, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  158 LEU  HA          157 SER  HN          5.50    (#   2414:10  Unique         4.95, 5.19 A)
 &rst
  ixpk= 2414, nxpk= 10, iat=2605,2592, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2415   157 SER  HN          2.80    (#   2415:10  Single Ambig)
 &rst
  ixpk= 2415, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2596,2597,2596,2597,
 &end
#
#  154 VAL  HA          157 SER  HN          4.50    (#   2416:10  Unique         3.57, 3.90 A)
 &rst
  ixpk= 2416, nxpk= 10, iat=2545,2592, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  155 VAL  HA          157 SER  HN          5.50    (#   2417:10  Unique         3.68, 3.93 A)
 &rst
  ixpk= 2417, nxpk= 10, iat=2561,2592, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  156 MET  HG+         157 SER  HN          5.50    (#   2418:10  Unique         2.20, 3.87 A)
 &rst
  ixpk= 2418, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#  156 MET  HG-         157 SER  HN          5.50    (#   2419:10  Unique         2.20, 3.87 A)
 &rst
  ixpk= 2419, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2582,2583,
 &end
#
#    0 AMB  10-2:2421   157 SER  HN          2.80    (#   2421:10  Single Ambig)
 &rst
  ixpk= 2421, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2579,2580,2579,2580,
 &end
#
#    0 AMB  10-2:2422   157 SER  HN          4.50    (#   2422:10  Single Ambig)
 &rst
  ixpk= 2422, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2610,2607,2608,
 &end
#
#    0 AMB  10-2:2423   157 SER  HN          4.50    (#   2423:10  Single Ambig)
 &rst
  ixpk= 2423, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2607,2608,2563,
 &end
#
#    0 AMB  10-2:2424   157 SER  HN          5.50    (#   2424:10  Single Ambig)
 &rst
  ixpk= 2424, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 &end
#
#    0 AMB  10-2:2425   157 SER  HN          4.50    (#   2425:10  Single Ambig)
 &rst
  ixpk= 2425, nxpk= 10, iat=  -1,2592, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2612,2613,2614,2616,2617,2618,2565,2566,2567,2569,
      2570,2571,
 &end
#
#    0 AMB  10-2:2426   158 LEU  HN          2.80    (#   2426:10  Single Ambig)
 &rst
  ixpk= 2426, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,
 &end
#
#    0 AMB  10-2:2427   158 LEU  HN          5.50    (#   2427:10  Single Ambig)
 &rst
  ixpk= 2427, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2565,2566,2567,2569,2570,2571,2549,2550,2551,2553,
      2554,2555,
 &end
#
#  158 LEU  HB-         158 LEU  HN          3.50    (#   2428:10  Unique         2.04, 2.89 A)
 &rst
  ixpk= 2428, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2607,2608,
 &end
#
#    0 AMB  10-2:2429   158 LEU  HN          2.80    (#   2429:10  Single Ambig)
 &rst
  ixpk= 2429, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=2607,2608,2610,
 &end
#
#    0 AMB  10-2:2430   158 LEU  HN          4.50    (#   2430:10  Single Ambig)
 &rst
  ixpk= 2430, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2643,2644,2626,2627,
 &end
#
#    0 AMB  10-2:2431   158 LEU  HN          4.50    (#   2431:10  Single Ambig)
 &rst
  ixpk= 2431, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2579,2580,2579,2580,2626,2627,1705,1706,
 &end
#
#    0 AMB  10-2:2432   158 LEU  HN          5.50    (#   2432:10  Single Ambig)
 &rst
  ixpk= 2432, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2629,2630,2629,2630,
 &end
#
#  155 VAL  HA          158 LEU  HN          4.50    (#   2433:10  Unique         3.25, 3.76 A)
 &rst
  ixpk= 2433, nxpk= 10, iat=2561,2603, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  154 VAL  HA          158 LEU  HN          5.50    (#   2434:10  Unique         4.79, 5.37 A)
 &rst
  ixpk= 2434, nxpk= 10, iat=2545,2603, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2435   158 LEU  HN          3.50    (#   2435:10  Single Ambig)
 &rst
  ixpk= 2435, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2596,2597,2596,2597,
 &end
#
#    0 AMB  10-2:2436   158 LEU  HN          2.80    (#   2436:10  Single Ambig)
 &rst
  ixpk= 2436, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2605,2577,
 &end
#
#  157 SER  HA          158 LEU  HN          3.50    (#   2437:10  Unique         3.35, 3.46 A)
 &rst
  ixpk= 2437, nxpk= 10, iat=2594,2603, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  156 MET  HN          158 LEU  HN          5.50    (#   2438:10  Unique         3.90, 4.30 A)
 &rst
  ixpk= 2438, nxpk= 10, iat=2575,2603, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  160 GLU  HN          158 LEU  HN          5.50    (#   2439:10  Unique         3.36, 3.63 A)
 &rst
  ixpk= 2439, nxpk= 10, iat=2639,2603, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2440   158 LEU  HN          2.80    (#   2440:10  Single Ambig)
 &rst
  ixpk= 2440, nxpk= 10, iat=  -1,2603, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2622,2592,
 &end
#
#    0 AMB  10-2:2441   159 GLN  HN          5.50    (#   2441:10  Single Ambig)
 &rst
  ixpk= 2441, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2654,2575,
 &end
#
#  160 GLU  HN          159 GLN  HN          2.80    (#   2442:10  Unique         2.22, 2.43 A)
 &rst
  ixpk= 2442, nxpk= 10, iat=2639,2622, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  158 LEU  HN          159 GLN  HN          3.50    (#   2443:10  Unique         2.15, 2.55 A)
 &rst
  ixpk= 2443, nxpk= 10, iat=2603,2622, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  159 GLN  HE2-        159 GLN  HN          5.50    (#   2444:10  Unique         1.84, 2.57 A)
 &rst
  ixpk= 2444, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2634,2635,
 &end
#
#    0 AMB  10-2:2445   159 GLN  HN          2.80    (#   2445:10  Single Ambig)
 &rst
  ixpk= 2445, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=2624,2577,2605,
 &end
#
#    0 AMB  10-2:2446   159 GLN  HN          5.50    (#   2446:10  Single Ambig)
 &rst
  ixpk= 2446, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2596,2597,2596,2597,
 &end
#
#  155 VAL  HA          159 GLN  HN          5.50    (#   2447:10  Unique         4.71, 5.28 A)
 &rst
  ixpk= 2447, nxpk= 10, iat=2561,2622, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2448   159 GLN  HN          3.50    (#   2448:10  Single Ambig)
 &rst
  ixpk= 2448, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2629,2630,2629,2630,
 &end
#
#  159 GLN  HB+         159 GLN  HN          2.80    (#   2449:10  Unique         2.77, 3.28 A)
 &rst
  ixpk= 2449, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2626,2627,
 &end
#
#    0 AMB  10-2:2450   159 GLN  HN          2.80    (#   2450:10  Single Ambig)
 &rst
  ixpk= 2450, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2626,2627,2643,2644,
 &end
#
#  158 LEU  HB+         159 GLN  HN          3.50    (#   2451:10  Unique         2.27, 3.06 A)
 &rst
  ixpk= 2451, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2607,2608,
 &end
#
#  158 LEU  HB-         159 GLN  HN          3.50    (#   2452:10  Unique         2.27, 3.06 A)
 &rst
  ixpk= 2452, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2607,2608,
 &end
#
#  155 VAL  MGY         159 GLN  HN          5.50    (#   2453:10  Unique         4.00, 6.58 A)
 &rst
  ixpk= 2453, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  10-2:2454   159 GLN  HN          4.50    (#   2454:10  Single Ambig)
 &rst
  ixpk= 2454, nxpk= 10, iat=  -1,2622, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,2565,2566,2567,2569,2570,2571,
 &end
#
#    0 AMB  10-2:2455   160 GLU  HN          5.50    (#   2455:10  Single Ambig)
 &rst
  ixpk= 2455, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,
 &end
#
#  158 LEU  HB-         160 GLU  HN          5.50    (#   2457:10  Unique         4.40, 4.86 A)
 &rst
  ixpk= 2457, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2607,2608,
 &end
#
#    0 AMB  10-2:2458   160 GLU  HN          5.50    (#   2458:10  Single Ambig)
 &rst
  ixpk= 2458, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2607,2608,2610,
 &end
#
#  160 GLU  HB-         160 GLU  HN          2.80    (#   2459:10  Unique         2.21, 2.79 A)
 &rst
  ixpk= 2459, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2643,2644,
 &end
#
#  160 GLU  HB+         160 GLU  HN          2.80    (#   2460:10  Unique         2.21, 2.79 A)
 &rst
  ixpk= 2460, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2643,2644,
 &end
#
#    0 AMB  10-2:2461   160 GLU  HN          4.50    (#   2461:10  Single Ambig)
 &rst
  ixpk= 2461, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2629,2630,2629,2630,2646,2647,
 &end
#
#  161 ASN  HB-         160 GLU  HN          5.50    (#   2462:10  Unique         3.71, 4.48 A)
 &rst
  ixpk= 2462, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2658,2659,
 &end
#
#  161 ASN  HB+         160 GLU  HN          5.50    (#   2463:10  Unique         3.71, 4.48 A)
 &rst
  ixpk= 2463, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2658,2659,
 &end
#
#    0 AMB  10-2:2464   160 GLU  HN          5.50    (#   2464:10  Single Ambig)
 &rst
  ixpk= 2464, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2596,2597,2596,2597,
 &end
#
#  159 GLN  HE2-        160 GLU  HN          5.50    (#   2466:10  Unique         4.01, 4.89 A)
 &rst
  ixpk= 2466, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2634,2635,
 &end
#
#    0 AMB  10-2:2467   160 GLU  HN          2.80    (#   2467:10  Single Ambig)
 &rst
  ixpk= 2467, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2641,2624,
 &end
#
#  159 GLN  HE2+        160 GLU  HN          5.50    (#   2468:10  Unique         4.01, 4.89 A)
 &rst
  ixpk= 2468, nxpk= 10, iat=  -1,2639, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2634,2635,
 &end
#
#  158 LEU  HN          160 GLU  HN          5.50    (#   2469:10  Unique         3.36, 3.63 A)
 &rst
  ixpk= 2469, nxpk= 10, iat=2603,2639, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  159 GLN  HN          160 GLU  HN          2.80    (#   2470:10  Unique         2.22, 2.43 A)
 &rst
  ixpk= 2470, nxpk= 10, iat=2622,2639, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  161 ASN  HN          160 GLU  HN          3.50    (#   2471:10  Unique         2.25, 2.45 A)
 &rst
  ixpk= 2471, nxpk= 10, iat=2654,2639, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  164 LYS  HN          161 ASN  HN          4.50    (#   2472:10  Unique         3.36, 3.54 A)
 &rst
  ixpk= 2472, nxpk= 10, iat=2696,2654, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:2473   161 ASN  HN          4.50    (#   2473:10  Single Ambig)
 &rst
  ixpk= 2473, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2663,2664,2622,
 &end
#
#  161 ASN  HD2-        161 ASN  HN          5.50    (#   2474:10  Unique         2.83, 4.27 A)
 &rst
  ixpk= 2474, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2663,2664,
 &end
#
#    0 AMB  10-2:2476   161 ASN  HN          3.50    (#   2476:10  Single Ambig)
 &rst
  ixpk= 2476, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2641,2624,
 &end
#
#  161 ASN  HB-         161 ASN  HN          2.80    (#   2477:10  Unique         2.66, 3.24 A)
 &rst
  ixpk= 2477, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2658,2659,
 &end
#
#  161 ASN  HB+         161 ASN  HN          2.80    (#   2478:10  Unique         2.66, 3.24 A)
 &rst
  ixpk= 2478, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=2658,2659,
 &end
#
#    0 AMB  10-2:2479   161 ASN  HN          4.50    (#   2479:10  Single Ambig)
 &rst
  ixpk= 2479, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2646,2647,2629,2630,2629,2630,
 &end
#
#  160 GLU  HB-         161 ASN  HN          4.50    (#   2480:10  Unique         3.86, 4.17 A)
 &rst
  ixpk= 2480, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2643,2644,
 &end
#
#    0 AMB  10-2:2481   161 ASN  HN          3.50    (#   2481:10  Single Ambig)
 &rst
  ixpk= 2481, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2686,2687,2643,2644,
 &end
#
#    0 AMB  10-2:2482   161 ASN  HN          5.50    (#   2482:10  Single Ambig)
 &rst
  ixpk= 2482, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2607,2608,2610,
 &end
#
#  158 LEU  HB-         161 ASN  HN          5.50    (#   2483:10  Unique         5.36, 5.89 A)
 &rst
  ixpk= 2483, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2607,2608,
 &end
#
#  162 THR  MG2         161 ASN  HN          5.50    (#   2484:10  Unique         5.26, 5.99 A)
 &rst
  ixpk= 2484, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2674,2675,2676,
 &end
#
#    0 AMB  10-2:2485   161 ASN  HN          5.50    (#   2485:10  Single Ambig)
 &rst
  ixpk= 2485, nxpk= 10, iat=  -1,2654, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,2612,2613,2614,2616,
      2617,2618,
 &end
#
#  162 THR  MG2         162 THR  HN          3.50    (#   2486:10  Unique         4.02, 4.42 A)
 &rst
  ixpk= 2486, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=2674,2675,2676,
 &end
#
#    0 AMB  10-2:2487   162 THR  HN          5.50    (#   2487:10  Single Ambig)
 &rst
  ixpk= 2487, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2643,2644,2579,2580,
 &end
#
#    0 AMB  10-2:2488   162 THR  HN          5.50    (#   2488:10  Single Ambig)
 &rst
  ixpk= 2488, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2643,2644,2626,2627,
 &end
#
#  163 PRO  HB+         162 THR  HN          5.50    (#   2489:10  Unique         5.17, 5.84 A)
 &rst
  ixpk= 2489, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2689,2690,
 &end
#
#  161 ASN  HB+         162 THR  HN          4.50    (#   2490:10  Unique         2.51, 3.29 A)
 &rst
  ixpk= 2490, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2658,2659,
 &end
#
#  161 ASN  HB-         162 THR  HN          4.50    (#   2491:10  Unique         2.51, 3.29 A)
 &rst
  ixpk= 2491, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2658,2659,
 &end
#
#  163 PRO  HD-         162 THR  HN          5.50    (#   2492:10  Unique         1.72, 2.57 A)
 &rst
  ixpk= 2492, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2683,2684,
 &end
#
#  163 PRO  HD+         162 THR  HN          5.50    (#   2493:10  Unique         1.72, 2.57 A)
 &rst
  ixpk= 2493, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2683,2684,
 &end
#
#  162 THR  HB          162 THR  HN          4.50    (#   2494:10  Unique         2.22, 2.44 A)
 &rst
  ixpk= 2494, nxpk= 10, iat=2672,2668, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  162 THR  HA          162 THR  HN          2.80    (#   2495:10  Unique         2.75, 2.80 A)
 &rst
  ixpk= 2495, nxpk= 10, iat=2670,2668, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  161 ASN  HN          162 THR  HN          3.50    (#   2499:10  Unique         1.88, 2.00 A)
 &rst
  ixpk= 2499, nxpk= 10, iat=2654,2668, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  163 PRO  HA          164 LYS  HN          3.50    (#   2500:10  Unique         3.35, 3.51 A)
 &rst
  ixpk= 2500, nxpk= 10, iat=2692,2696, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  164 LYS  HA          164 LYS  HN          4.50    (#   2501:10  Unique         2.28, 2.78 A)
 &rst
  ixpk= 2501, nxpk= 10, iat=2698,2696, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  163 PRO  HD-         164 LYS  HN          5.50    (#   2502:10  Unique         2.65, 3.25 A)
 &rst
  ixpk= 2502, nxpk= 10, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2683,2684,
 &end
#
#  163 PRO  HB+         164 LYS  HN          5.50    (#   2503:10  Unique         3.33, 3.79 A)
 &rst
  ixpk= 2503, nxpk= 10, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2689,2690,
 &end
#
#    0 AMB  10-2:2504   164 LYS  HN          5.50    (#   2504:10  Single Ambig)
 &rst
  ixpk= 2504, nxpk= 10, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2686,2687,2689,2690,
 &end
#
#  164 LYS  HB-         164 LYS  HN          3.50    (#   2506:10  Unique         2.06, 2.84 A)
 &rst
  ixpk= 2506, nxpk= 10, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2700,2701,
 &end
#
#    0 AMB  10-2:2507   164 LYS  HN          4.50    (#   2507:10  Single Ambig)
 &rst
  ixpk= 2507, nxpk= 10, iat=  -1,2696, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2703,2704,2703,2704,
 &end
#
#    0 AMB  10-2:2508   126 TRP  HE1         5.50    (#   2508:10  Single Ambig)
 &rst
  ixpk= 2508, nxpk= 10, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1768,2038,
 &end
#
#  126 TRP  HZ2         126 TRP  HE1         4.50    (#   2509:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2509, nxpk= 10, iat=2051,2048, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  126 TRP  HD1         126 TRP  HE1         2.80    (#   2510:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2510, nxpk= 10, iat=2046,2048, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  126 TRP  HH2         126 TRP  HE1         5.50    (#   2511:10  Unique         4.96, 4.97 A)
 &rst
  ixpk= 2511, nxpk= 10, iat=2053,2048, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  108 ASP  HA          126 TRP  HE1         5.50    (#   2514:10  Unique         3.89, 4.84 A)
 &rst
  ixpk= 2514, nxpk= 10, iat=1770,2048, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2515   126 TRP  HE1         4.50    (#   2515:10  Single Ambig)
 &rst
  ixpk= 2515, nxpk= 10, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1772,1773,1772,1773,
 &end
#
#  104 LEU  MDY         126 TRP  HE1         5.50    (#   2516:10  Unique         3.80, 5.99 A)
 &rst
  ixpk= 2516, nxpk= 10, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1724,1725,1726,1728,1729,1730,
 &end
#
#  111 ILE  QD1         126 TRP  HE1         5.50    (#   2517:10  Unique         4.34, 5.72 A)
 &rst
  ixpk= 2517, nxpk= 10, iat=  -1,2048, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1818,1819,1820,
 &end
#
#   74 TRP  HN           74 TRP  HE1         5.50    (#   2518:10  Unique         4.21, 4.64 A)
 &rst
  ixpk= 2518, nxpk= 10, iat=1151,1161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   74 TRP  HZ2          74 TRP  HE1         2.80    (#   2519:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2519, nxpk= 10, iat=1164,1161, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 TRP  HD1          74 TRP  HE1         2.80    (#   2520:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2520, nxpk= 10, iat=1159,1161, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 TRP  HH2          74 TRP  HE1         5.50    (#   2521:10  Unique         4.96, 4.97 A)
 &rst
  ixpk= 2521, nxpk= 10, iat=1166,1161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 ASN  HA           74 TRP  HE1         5.50    (#   2522:10  Unique         4.25, 5.14 A)
 &rst
  ixpk= 2522, nxpk= 10, iat=1139,1161, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   73 ASN  HB+          74 TRP  HE1         5.50    (#   2525:10  Unique         3.99, 6.23 A)
 &rst
  ixpk= 2525, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1141,1142,
 &end
#
#   74 TRP  HB+          74 TRP  HE1         5.50    (#   2526:10  Unique         4.77, 5.03 A)
 &rst
  ixpk= 2526, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#   98 LYS  HE+          74 TRP  HE1         5.50    (#   2527:10  Unique         2.69, 4.23 A)
 &rst
  ixpk= 2527, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1607,1608,
 &end
#
#   98 LYS  HE-          74 TRP  HE1         5.50    (#   2528:10  Unique         2.69, 4.23 A)
 &rst
  ixpk= 2528, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1607,1608,
 &end
#
#   46 ALA  MB           74 TRP  HE1         5.50    (#   2529:10  Unique         4.16, 5.25 A)
 &rst
  ixpk= 2529, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 700, 701, 702,
 &end
#
#   98 LYS  HD+          74 TRP  HE1         5.50    (#   2530:10  Unique         3.97, 5.56 A)
 &rst
  ixpk= 2530, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1604,1605,
 &end
#
#    0 AMB  10-2:2531    74 TRP  HE1         5.50    (#   2531:10  Single Ambig)
 &rst
  ixpk= 2531, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1562,1563, 626, 627,
 &end
#
#    0 AMB  10-2:2533    74 TRP  HE1         5.50    (#   2533:10  Single Ambig)
 &rst
  ixpk= 2533, nxpk= 10, iat=  -1,1161, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1565,1566,1601,1602,
 &end
#
#   26 ARG  HG-          33 TRP  HE1         5.50    (#   2534:10  Unique         3.65, 5.88 A)
 &rst
  ixpk= 2534, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#    0 AMB  10-2:2535    33 TRP  HE1         5.50    (#   2535:10  Single Ambig)
 &rst
  ixpk= 2535, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 394, 395, 394, 395,
 &end
#
#   26 ARG  HG+          33 TRP  HE1         5.50    (#   2536:10  Unique         3.65, 5.88 A)
 &rst
  ixpk= 2536, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#    0 AMB  10-2:2537    33 TRP  HE1         5.50    (#   2537:10  Single Ambig)
 &rst
  ixpk= 2537, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 514, 515,2021,2022,
 &end
#
#   33 TRP  HB+          33 TRP  HE1         5.50    (#   2538:10  Unique         4.76, 5.03 A)
 &rst
  ixpk= 2538, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#    0 AMB  10-2:2542    33 TRP  HE1         5.50    (#   2542:10  Single Ambig)
 &rst
  ixpk= 2542, nxpk= 10, iat=  -1, 520, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 400, 401, 400, 401,1994,1995,1955,1956,
 &end
#
#   33 TRP  HH2          33 TRP  HE1         5.50    (#   2548:10  Unique         4.96, 4.96 A)
 &rst
  ixpk= 2548, nxpk= 10, iat= 525, 520, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HD1          33 TRP  HE1         2.80    (#   2549:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2549, nxpk= 10, iat= 518, 520, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 TRP  HZ2          33 TRP  HE1         3.50    (#   2550:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2550, nxpk= 10, iat= 523, 520, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:2552   130 TRP  HE1         5.50    (#   2552:10  Single Ambig)
 &rst
  ixpk= 2552, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2089,2575,
 &end
#
#  130 TRP  HZ2         130 TRP  HE1         3.50    (#   2553:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2553, nxpk= 10, iat=2123,2120, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  130 TRP  HD1         130 TRP  HE1         2.80    (#   2554:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2554, nxpk= 10, iat=2118,2120, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  130 TRP  HH2         130 TRP  HE1         5.50    (#   2555:10  Unique         4.96, 4.97 A)
 &rst
  ixpk= 2555, nxpk= 10, iat=2125,2120, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  129 TYR  HD          130 TRP  HE1         4.50    (#   2556:10  Unique         3.38, 5.30 A)
 &rst
  ixpk= 2556, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2097,2106,
 &end
#
#    0 AMB  10-2:2558   130 TRP  HE1         5.50    (#   2558:10  Single Ambig)
 &rst
  ixpk= 2558, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2082,2083,2082,2083,
 &end
#
#  130 TRP  HB+         130 TRP  HE1         5.50    (#   2559:10  Unique         4.75, 4.98 A)
 &rst
  ixpk= 2559, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2114,2115,
 &end
#
#  129 TYR  HB+         130 TRP  HE1         5.50    (#   2560:10  Unique         2.72, 3.73 A)
 &rst
  ixpk= 2560, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2093,2094,
 &end
#
#    0 AMB  10-2:2561   130 TRP  HE1         5.50    (#   2561:10  Single Ambig)
 &rst
  ixpk= 2561, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2093,2094,2582,2583,
 &end
#
#  156 MET  ME          130 TRP  HE1         5.50    (#   2562:10  Unique         2.19, 5.17 A)
 &rst
  ixpk= 2562, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2586,2587,2588,
 &end
#
#  152 ALA  MB          130 TRP  HE1         5.50    (#   2563:10  Unique         4.23, 5.51 A)
 &rst
  ixpk= 2563, nxpk= 10, iat=  -1,2120, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=2526,2527,2528,
 &end
#
#    0 AMB  10-2:2568    24 TRP  HE1         5.50    (#   2568:10  Single Ambig)
 &rst
  ixpk= 2568, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2068,2069,2070,2072,2073,2074,2232,2233,2234,2236,
      2237,2238,
 &end
#
#   33 TRP  HB+          24 TRP  HE1         5.50    (#   2570:10  Unique         2.40, 2.99 A)
 &rst
  ixpk= 2570, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 514, 515,
 &end
#
#  135 GLN  HB+          24 TRP  HE1         5.50    (#   2571:10  Unique         2.43, 3.94 A)
 &rst
  ixpk= 2571, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2213,2214,
 &end
#
#   24 TRP  HD1          24 TRP  HE1         4.50    (#   2572:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2572, nxpk= 10, iat= 364, 366, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  131 TYR  HE           24 TRP  HE1         4.50    (#   2573:10  Unique         2.30, 5.75 A)
 &rst
  ixpk= 2573, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2144,2149,
 &end
#
#  135 GLN  HE2+         24 TRP  HE1         5.50    (#   2574:10  Unique         1.90, 5.32 A)
 &rst
  ixpk= 2574, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2221,2222,
 &end
#
#    0 AMB  10-2:2575    24 TRP  HE1         5.50    (#   2575:10  Single Ambig)
 &rst
  ixpk= 2575, nxpk= 10, iat=  -1, 366, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 371, 525,
 &end
#
#   24 TRP  HZ2          24 TRP  HE1         5.50    (#   2576:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2576, nxpk= 10, iat= 369, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   33 TRP  HN           24 TRP  HE1         5.50    (#   2577:10  Unique         4.59, 5.10 A)
 &rst
  ixpk= 2577, nxpk= 10, iat= 510, 366, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  147 VAL  MGY          99 TRP  HE1         5.50    (#   2578:10  Unique         3.30, 5.73 A)
 &rst
  ixpk= 2578, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2438,2439,2440,2442,2443,2444,
 &end
#
#    0 AMB  10-2:2579    99 TRP  HE1         4.50    (#   2579:10  Single Ambig)
 &rst
  ixpk= 2579, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  10-2:2580    99 TRP  HE1         4.50    (#   2580:10  Single Ambig)
 &rst
  ixpk= 2580, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#   97 GLN  HB-          99 TRP  HE1         4.50    (#   2581:10  Unique         2.36, 4.73 A)
 &rst
  ixpk= 2581, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#   75 LEU  HB+          99 TRP  HE1         5.50    (#   2582:10  Unique         1.98, 3.55 A)
 &rst
  ixpk= 2582, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1179,1180,
 &end
#
#   97 GLN  HB+          99 TRP  HE1         4.50    (#   2583:10  Unique         2.36, 4.73 A)
 &rst
  ixpk= 2583, nxpk= 10, iat=  -1,1626, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1581,1582,
 &end
#
#   99 TRP  HD1          99 TRP  HE1         4.50    (#   2585:10  Unique         2.57, 2.57 A)
 &rst
  ixpk= 2585, nxpk= 10, iat=1624,1626, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   99 TRP  HZ2          99 TRP  HE1         5.50    (#   2588:10  Unique         2.82, 2.82 A)
 &rst
  ixpk= 2588, nxpk= 10, iat=1629,1626, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2592    86 TRP  HE1         5.50    (#   2592:10  Single Ambig)
 &rst
  ixpk= 2592, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1375,1501,
 &end
#
#   86 TRP  HN           86 TRP  HE1         5.50    (#   2593:10  Unique         4.26, 4.85 A)
 &rst
  ixpk= 2593, nxpk= 10, iat=1399,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   85 ARG  HA           86 TRP  HE1         5.50    (#   2595:10  Unique         4.78, 5.33 A)
 &rst
  ixpk= 2595, nxpk= 10, iat=1377,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2596    86 TRP  HE1         4.50    (#   2596:10  Single Ambig)
 &rst
  ixpk= 2596, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1318,1401,
 &end
#
#   81 LYS  HA           86 TRP  HE1         5.50    (#   2597:10  Unique         2.13, 3.08 A)
 &rst
  ixpk= 2597, nxpk= 10, iat=1296,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2598    86 TRP  HE1         4.50    (#   2598:10  Single Ambig)
 &rst
  ixpk= 2598, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1403,1404,1361,
 &end
#
#    0 AMB  10-2:2599    86 TRP  HE1         4.50    (#   2599:10  Single Ambig)
 &rst
  ixpk= 2599, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1307,1308,1307,1308,
 &end
#
#   81 LYS  HB-          86 TRP  HE1         5.50    (#   2600:10  Unique         1.96, 3.87 A)
 &rst
  ixpk= 2600, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1298,1299,
 &end
#
#    0 AMB  10-2:2601    86 TRP  HE1         4.50    (#   2601:10  Single Ambig)
 &rst
  ixpk= 2601, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1304,1305,1304,1305,
 &end
#
#    0 AMB  10-2:2602    86 TRP  HE1         2.80    (#   2602:10  Single Ambig)
 &rst
  ixpk= 2602, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1363,1301,1302,
 &end
#
#   84 VAL  MGY          86 TRP  HE1         4.50    (#   2603:10  Unique         2.72, 4.09 A)
 &rst
  ixpk= 2603, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   91 VAL  MGX          86 TRP  HE1         5.50    (#   2605:10  Unique         4.11, 6.54 A)
 &rst
  ixpk= 2605, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1491,1492,1493,1495,1496,1497,
 &end
#
#   84 VAL  MGX          86 TRP  HE1         3.50    (#   2606:10  Unique         2.72, 4.09 A)
 &rst
  ixpk= 2606, nxpk= 10, iat=  -1,1409, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1365,1366,1367,1369,1370,1371,
 &end
#
#   76 ARG  HD-          76 ARG  HE          5.50    (#   2627:10  Unique         2.30, 2.75 A)
 &rst
  ixpk= 2627, nxpk= 10, iat=  -1,1207, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1204,1205,
 &end
#
#  158 LEU  MDY         161 ASN  HD2+        5.50    (#   2632:10  Unique         3.59, 7.21 A)
 &rst
  ixpk= 2632, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,
 igr2=2663,2664,
 &end
#
#  158 LEU  MDY         161 ASN  HD2-        5.50    (#   2633:10  Unique         3.59, 7.21 A)
 &rst
  ixpk= 2633, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2612,2613,2614,2616,2617,2618,
 igr2=2663,2664,
 &end
#
#    0 AMB  10-2:2635   161 ASN  HD2-        5.50    (#   2635:10  Single Ambig)
 &rst
  ixpk= 2635, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2686,2687,2579,2580,2579,2580,2626,2627,
 igr2=2663,2664,
 &end
#
#  161 ASN  HB+         161 ASN  HD2+        2.80    (#   2636:10  Unique         2.18, 3.34 A)
 &rst
  ixpk= 2636, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2658,2659,
 igr2=2663,2664,
 &end
#
#  161 ASN  HB-         161 ASN  HD2+        2.80    (#   2637:10  Unique         2.18, 3.34 A)
 &rst
  ixpk= 2637, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2658,2659,
 igr2=2663,2664,
 &end
#
#  161 ASN  HB+         161 ASN  HD2-        4.50    (#   2638:10  Unique         2.18, 3.34 A)
 &rst
  ixpk= 2638, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2658,2659,
 igr2=2663,2664,
 &end
#
#  161 ASN  HB-         161 ASN  HD2-        3.50    (#   2639:10  Unique         2.18, 3.34 A)
 &rst
  ixpk= 2639, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2658,2659,
 igr2=2663,2664,
 &end
#
#    0 AMB  10-2:2640     0 AMB  10-1:2640   5.50    (#   2640:10  Double Ambig)
 &rst
  ixpk= 2640, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2596,2597,2596,2597,
 igr2=2663,2664,2663,2664,
 &end
#
#    0 AMB  10-2:2641   161 ASN  HD2-        5.50    (#   2641:10  Single Ambig)
 &rst
  ixpk= 2641, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2596,2597,2596,2597,
 igr2=2663,2664,
 &end
#
#  158 LEU  HA          161 ASN  HD2+        5.50    (#   2642:10  Unique         2.93, 4.44 A)
 &rst
  ixpk= 2642, nxpk= 10, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2663,2664,
 &end
#
#  158 LEU  HA          161 ASN  HD2-        5.50    (#   2644:10  Unique         2.93, 4.44 A)
 &rst
  ixpk= 2644, nxpk= 10, iat=2605,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2663,2664,
 &end
#
#  161 ASN  HN          161 ASN  HD2+        5.50    (#   2648:10  Unique         2.83, 4.27 A)
 &rst
  ixpk= 2648, nxpk= 10, iat=2654,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2663,2664,
 &end
#
#  161 ASN  HN          161 ASN  HD2-        5.50    (#   2649:10  Unique         2.83, 4.27 A)
 &rst
  ixpk= 2649, nxpk= 10, iat=2654,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2663,2664,
 &end
#
#   18 ARG  HA          103 GLN  HE2+        5.50    (#   2652:10  Unique         3.33, 5.19 A)
 &rst
  ixpk= 2652, nxpk= 10, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1710,1711,
 &end
#
#   18 ARG  HA          103 GLN  HE2-        5.50    (#   2653:10  Unique         3.33, 5.19 A)
 &rst
  ixpk= 2653, nxpk= 10, iat= 260,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1710,1711,
 &end
#
#    0 AMB  10-2:2654     0 AMB  10-1:2654   5.50    (#   2654:10  Double Ambig)
 &rst
  ixpk= 2654, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 268, 269, 268, 269,
 igr2=1710,1711,1710,1711,
 &end
#
#    0 AMB  10-2:2656     0 AMB  10-1:2656   4.50    (#   2656:10  Double Ambig)
 &rst
  ixpk= 2656, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1705,1706,1705,1706,
 igr2=1710,1711,1710,1711,
 &end
#
#    0 AMB  10-2:2657   103 GLN  HE2-        4.50    (#   2657:10  Single Ambig)
 &rst
  ixpk= 2657, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1705,1706,1705,1706,
 igr2=1710,1711,
 &end
#
#    0 AMB  10-2:2658   103 GLN  HE2-        4.50    (#   2658:10  Single Ambig)
 &rst
  ixpk= 2658, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1702,1703,2607,2608, 262, 263,
 igr2=1710,1711,
 &end
#
#    0 AMB  10-2:2659     0 AMB  10-1:2659   4.50    (#   2659:10  Double Ambig)
 &rst
  ixpk= 2659, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 265, 266, 262, 263,1020,1021,
 igr2=1710,1711,1710,1711,1710,1711,
 &end
#
#    0 AMB  10-2:2660     0 AMB  10-1:2660   5.50    (#   2660:10  Double Ambig)
 &rst
  ixpk= 2660, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 265, 266,1023,1024,
 igr2=1710,1711,1710,1711,
 &end
#
#    0 AMB  10-2:2661   103 GLN  HE2-        5.50    (#   2661:10  Single Ambig)
 &rst
  ixpk= 2661, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 265, 266,1023,1024,
 igr2=1710,1711,
 &end
#
#    0 AMB  10-2:2662     0 AMB  10-1:2662   3.50    (#   2662:10  Double Ambig)
 &rst
  ixpk= 2662, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,2549,2550,2551,2553,2554,2555,
 igr2=1710,1711,1710,1711,1710,1711,
 &end
#
#    0 AMB  10-2:2663   103 GLN  HE2-        3.50    (#   2663:10  Single Ambig)
 &rst
  ixpk= 2663, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,2549,2550,2551,2553,2554,2555,
 igr2=1710,1711,
 &end
#
#   79 LEU  MDX          95 GLN  HE2+        5.50    (#   2664:10  Unique         1.94, 4.51 A)
 &rst
  ixpk= 2664, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1550,1551,
 &end
#
#   79 LEU  MDX          95 GLN  HE2-        5.50    (#   2665:10  Unique         1.94, 4.51 A)
 &rst
  ixpk= 2665, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1270,1271,1272,1274,1275,1276,
 igr2=1550,1551,
 &end
#
#    0 AMB  10-2:2666     0 AMB  10-1:2666   5.50    (#   2666:10  Double Ambig)
 &rst
  ixpk= 2666, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.00, r4=12.50,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,1349,1350,1351,1353,1354,1355,
 igr2=1550,1551,1550,1551,1550,1551,
 &end
#
#    0 AMB  10-2:2667    95 GLN  HE2-        5.50    (#   2667:10  Single Ambig)
 &rst
  ixpk= 2667, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1270,1271,1272,1274,1275,1276,1349,1350,1351,1353,
      1354,1355,1349,1350,1351,1353,1354,1355,
 igr2=1550,1551,
 &end
#
#    0 AMB  10-2:2668     0 AMB  10-1:2668   5.50    (#   2668:10  Double Ambig)
 &rst
  ixpk= 2668, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1542,1543,1344,1345,
 igr2=1550,1551,1550,1551,
 &end
#
#    0 AMB  10-2:2669    95 GLN  HE2-        5.50    (#   2669:10  Single Ambig)
 &rst
  ixpk= 2669, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1542,1543,1344,1345,
 igr2=1550,1551,
 &end
#
#    0 AMB  10-2:2670     0 AMB  10-1:2670   4.50    (#   2670:10  Double Ambig)
 &rst
  ixpk= 2670, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 108, 109, 108, 109,1542,1543,
 igr2=1550,1551,1550,1551,1550,1551,
 &end
#
#    0 AMB  10-2:2671    95 GLN  HE2-        5.50    (#   2671:10  Single Ambig)
 &rst
  ixpk= 2671, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 108, 109, 108, 109,1542,1543,
 igr2=1550,1551,
 &end
#
#   95 GLN  HG-          95 GLN  HE2-        4.50    (#   2672:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2672, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1545,1546,
 igr2=1550,1551,
 &end
#
#   95 GLN  HG+          95 GLN  HE2-        4.50    (#   2673:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2673, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1545,1546,
 igr2=1550,1551,
 &end
#
#   95 GLN  HG+          95 GLN  HE2+        4.50    (#   2674:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2674, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1545,1546,
 igr2=1550,1551,
 &end
#
#   95 GLN  HG-          95 GLN  HE2+        4.50    (#   2675:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2675, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1545,1546,
 igr2=1550,1551,
 &end
#
#   95 GLN  HA           95 GLN  HE2+        5.50    (#   2676:10  Unique         2.06, 4.21 A)
 &rst
  ixpk= 2676, nxpk= 10, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1550,1551,
 &end
#
#   95 GLN  HA           95 GLN  HE2-        5.50    (#   2677:10  Unique         2.06, 4.21 A)
 &rst
  ixpk= 2677, nxpk= 10, iat=1540,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1550,1551,
 &end
#
#    0 AMB  10-2:2678     0 AMB  10-1:2678   4.50    (#   2678:10  Double Ambig)
 &rst
  ixpk= 2678, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1559,1560,1198,1199,  31,  32,
 igr2= 151, 152, 151, 152, 151, 152,
 &end
#
#   95 GLN  HB-          10 ASN  HD2-        5.50    (#   2679:10  Unique         1.92, 3.94 A)
 &rst
  ixpk= 2679, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,
 igr2= 151, 152,
 &end
#
#    8 ARG  HG-          10 ASN  HD2-        5.50    (#   2680:10  Unique         1.92, 4.04 A)
 &rst
  ixpk= 2680, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 111, 112,
 igr2= 151, 152,
 &end
#
#    8 ARG  HG-          10 ASN  HD2+        3.50    (#   2681:10  Unique         1.92, 4.04 A)
 &rst
  ixpk= 2681, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 111, 112,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2682     0 AMB  10-1:2682   4.50    (#   2682:10  Double Ambig)
 &rst
  ixpk= 2682, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.00, r4= 9.50,
 igr1= 108, 109, 108, 109, 111, 112,1542,1543,
 igr2= 151, 152, 151, 152, 151, 152, 151, 152,
 &end
#
#    0 AMB  10-2:2683    10 ASN  HD2-        4.50    (#   2683:10  Single Ambig)
 &rst
  ixpk= 2683, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 108, 109, 108, 109, 111, 112,1542,1543,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2684     0 AMB  10-1:2684   5.50    (#   2684:10  Double Ambig)
 &rst
  ixpk= 2684, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1581,1582,1545,1546,
 igr2= 151, 152, 151, 152,
 &end
#
#    0 AMB  10-2:2685    10 ASN  HD2-        5.50    (#   2685:10  Single Ambig)
 &rst
  ixpk= 2685, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1581,1582,1545,1546,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB-          10 ASN  HD2+        5.50    (#   2686:10  Unique         2.11, 3.20 A)
 &rst
  ixpk= 2686, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB+          10 ASN  HD2+        5.50    (#   2687:10  Unique         2.11, 3.20 A)
 &rst
  ixpk= 2687, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB-          10 ASN  HD2-        5.50    (#   2688:10  Unique         2.11, 3.20 A)
 &rst
  ixpk= 2688, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#   10 ASN  HB+          10 ASN  HD2-        5.50    (#   2689:10  Unique         2.11, 3.20 A)
 &rst
  ixpk= 2689, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 146, 147,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2690     0 AMB  10-1:2690   5.50    (#   2690:10  Double Ambig)
 &rst
  ixpk= 2690, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=  44,  45,1620,1621,
 igr2= 151, 152, 151, 152,
 &end
#
#   39 GLY  HA-          10 ASN  HD2+        5.50    (#   2692:10  Unique         3.79, 5.85 A)
 &rst
  ixpk= 2692, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA-          10 ASN  HD2-        5.50    (#   2693:10  Unique         3.79, 5.85 A)
 &rst
  ixpk= 2693, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA+          10 ASN  HD2+        5.50    (#   2694:10  Unique         3.79, 5.85 A)
 &rst
  ixpk= 2694, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#   39 GLY  HA+          10 ASN  HD2-        5.50    (#   2695:10  Unique         3.79, 5.85 A)
 &rst
  ixpk= 2695, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 611, 612,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2697    10 ASN  HD2-        4.50    (#   2697:10  Single Ambig)
 &rst
  ixpk= 2697, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 138, 144,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2698     0 AMB  10-1:2698   4.50    (#   2698:10  Double Ambig)
 &rst
  ixpk= 2698, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 138, 144,
 igr2= 151, 152, 151, 152,
 &end
#
#   96 LYS  HN           10 ASN  HD2+        5.50    (#   2699:10  Unique         2.51, 3.78 A)
 &rst
  ixpk= 2699, nxpk= 10, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   96 LYS  HN           10 ASN  HD2-        5.50    (#   2700:10  Unique         2.51, 3.78 A)
 &rst
  ixpk= 2700, nxpk= 10, iat=1555,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   11 VAL  HN           10 ASN  HD2+        5.50    (#   2701:10  Unique         4.01, 5.16 A)
 &rst
  ixpk= 2701, nxpk= 10, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   10 ASN  HN           10 ASN  HD2+        5.50    (#   2702:10  Unique         1.89, 3.96 A)
 &rst
  ixpk= 2702, nxpk= 10, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   11 VAL  HN           10 ASN  HD2-        5.50    (#   2703:10  Unique         4.01, 5.16 A)
 &rst
  ixpk= 2703, nxpk= 10, iat= 156,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   10 ASN  HN           10 ASN  HD2-        5.50    (#   2704:10  Unique         1.89, 3.96 A)
 &rst
  ixpk= 2704, nxpk= 10, iat= 142,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 151, 152,
 &end
#
#   18 ARG  HG-          19 GLN  HE2+        5.50    (#   2707:10  Unique         4.28, 6.19 A)
 &rst
  ixpk= 2707, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 265, 266,
 igr2= 294, 295,
 &end
#
#   18 ARG  HG-          19 GLN  HE2-        5.50    (#   2708:10  Unique         4.28, 6.19 A)
 &rst
  ixpk= 2708, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 265, 266,
 igr2= 294, 295,
 &end
#
#   19 GLN  HB-          19 GLN  HE2-        4.50    (#   2709:10  Unique         1.92, 3.98 A)
 &rst
  ixpk= 2709, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 286, 287,
 igr2= 294, 295,
 &end
#
#   19 GLN  HB-          19 GLN  HE2+        4.50    (#   2710:10  Unique         1.92, 3.98 A)
 &rst
  ixpk= 2710, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 286, 287,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB+          19 GLN  HE2+        5.50    (#   2711:10  Unique         4.36, 6.66 A)
 &rst
  ixpk= 2711, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   18 ARG  HB+          19 GLN  HE2-        5.50    (#   2712:10  Unique         4.36, 6.66 A)
 &rst
  ixpk= 2712, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 262, 263,
 igr2= 294, 295,
 &end
#
#   19 GLN  HG+          19 GLN  HE2-        4.50    (#   2713:10  Unique         2.12, 3.29 A)
 &rst
  ixpk= 2713, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#   19 GLN  HG+          19 GLN  HE2+        3.50    (#   2714:10  Unique         2.12, 3.29 A)
 &rst
  ixpk= 2714, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 289, 290,
 igr2= 294, 295,
 &end
#
#    0 AMB  10-2:2715     0 AMB  10-1:2715   3.50    (#   2715:10  Double Ambig)
 &rst
  ixpk= 2715, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 286, 287, 289, 290,
 igr2= 294, 295, 294, 295,
 &end
#
#    0 AMB  10-2:2716    19 GLN  HE2-        4.50    (#   2716:10  Single Ambig)
 &rst
  ixpk= 2716, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 286, 287, 289, 290,
 igr2= 294, 295,
 &end
#
#   17 ASN  HB+          19 GLN  HE2+        5.50    (#   2717:10  Unique         1.91, 3.06 A)
 &rst
  ixpk= 2717, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 248, 249,
 igr2= 294, 295,
 &end
#
#   17 ASN  HB+          19 GLN  HE2-        5.50    (#   2718:10  Unique         1.91, 3.06 A)
 &rst
  ixpk= 2718, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 248, 249,
 igr2= 294, 295,
 &end
#
#   19 GLN  HA           19 GLN  HE2+        5.50    (#   2719:10  Unique         4.49, 5.33 A)
 &rst
  ixpk= 2719, nxpk= 10, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 294, 295,
 &end
#
#   19 GLN  HA           19 GLN  HE2-        5.50    (#   2720:10  Unique         4.49, 5.33 A)
 &rst
  ixpk= 2720, nxpk= 10, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 294, 295,
 &end
#
#   18 ARG  HN           19 GLN  HE2+        5.50    (#   2721:10  Unique         3.10, 5.38 A)
 &rst
  ixpk= 2721, nxpk= 10, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 294, 295,
 &end
#
#    0 AMB  10-2:2723     0 AMB  10-1:2723   4.50    (#   2723:10  Double Ambig)
 &rst
  ixpk= 2723, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 418, 419,1926,1927,
 igr2= 477, 478,1867,1868,
 &end
#
#  119 PRO  HG-         114 GLN  HE2-        5.50    (#   2724:10  Unique         2.38, 6.23 A)
 &rst
  ixpk= 2724, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1926,1927,
 igr2=1867,1868,
 &end
#
#  119 PRO  HG+         114 GLN  HE2-        5.50    (#   2725:10  Unique         2.38, 6.23 A)
 &rst
  ixpk= 2725, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1926,1927,
 igr2=1867,1868,
 &end
#
#    0 AMB  10-2:2726     0 AMB  10-1:2726   5.50    (#   2726:10  Double Ambig)
 &rst
  ixpk= 2726, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1842,1843,1842,1843,
 igr2=1867,1868,1867,1868,
 &end
#
#  114 GLN  HB-         114 GLN  HE2+        4.50    (#   2727:10  Unique         1.92, 3.74 A)
 &rst
  ixpk= 2727, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1859,1860,
 igr2=1867,1868,
 &end
#
#  114 GLN  HB-         114 GLN  HE2-        5.50    (#   2728:10  Unique         1.92, 3.74 A)
 &rst
  ixpk= 2728, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1859,1860,
 igr2=1867,1868,
 &end
#
#    0 AMB  10-2:2729   114 GLN  HE2-        3.50    (#   2729:10  Single Ambig)
 &rst
  ixpk= 2729, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1859,1860,1975,1976,1862,1863,1862,1863,
 igr2=1867,1868,
 &end
#
#    0 AMB  10-2:2730     0 AMB  10-1:2730   2.80    (#   2730:10  Double Ambig)
 &rst
  ixpk= 2730, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 472, 473, 472, 473, 677, 678,
 igr2= 477, 478, 477, 478, 733, 734,
 &end
#
#    0 AMB  10-2:2731     0 AMB  10-1:2731   5.50    (#   2731:10  Double Ambig)
 &rst
  ixpk= 2731, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1899, 416,
 igr2=1867,1868,1867,1868,
 &end
#
#    0 AMB  10-2:2732   114 GLN  HE2-        5.50    (#   2732:10  Single Ambig)
 &rst
  ixpk= 2732, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1899, 416,
 igr2=1867,1868,
 &end
#
#  114 GLN  HA          114 GLN  HE2+        5.50    (#   2733:10  Unique         2.22, 4.26 A)
 &rst
  ixpk= 2733, nxpk= 10, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1867,1868,
 &end
#
#  114 GLN  HA          114 GLN  HE2-        5.50    (#   2734:10  Unique         2.22, 4.26 A)
 &rst
  ixpk= 2734, nxpk= 10, iat=1857,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1867,1868,
 &end
#
#  122 ASP  HA          114 GLN  HE2-        5.50    (#   2735:10  Unique         2.09, 4.57 A)
 &rst
  ixpk= 2735, nxpk= 10, iat=1973,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1867,1868,
 &end
#
#  114 GLN  HN          114 GLN  HE2+        5.50    (#   2737:10  Unique         1.88, 3.77 A)
 &rst
  ixpk= 2737, nxpk= 10, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1867,1868,
 &end
#
#  114 GLN  HN          114 GLN  HE2-        5.50    (#   2738:10  Unique         1.88, 3.77 A)
 &rst
  ixpk= 2738, nxpk= 10, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1867,1868,
 &end
#
#    0 AMB  10-2:2739     0 AMB  10-1:2739   5.50    (#   2739:10  Double Ambig)
 &rst
  ixpk= 2739, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1146,1147,1146,1147,
 &end
#
#    0 AMB  10-2:2740    73 ASN  HD2-        5.50    (#   2740:10  Single Ambig)
 &rst
  ixpk= 2740, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 igr2=1146,1147,
 &end
#
#    0 AMB  10-2:2741     0 AMB  10-1:2741   5.50    (#   2741:10  Double Ambig)
 &rst
  ixpk= 2741, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1120,1121,1120,1121,
 igr2=1146,1147,1146,1147,
 &end
#
#    0 AMB  10-2:2742     0 AMB  10-1:2742   4.50    (#   2742:10  Double Ambig)
 &rst
  ixpk= 2742, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1117,1118,1117,1118,
 igr2=1146,1147,1146,1147,
 &end
#
#   72 ARG  HG+          73 ASN  HD2-        5.50    (#   2743:10  Unique         2.23, 5.67 A)
 &rst
  ixpk= 2743, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1120,1121,
 igr2=1146,1147,
 &end
#
#    0 AMB  10-2:2744    73 ASN  HD2-        4.50    (#   2744:10  Single Ambig)
 &rst
  ixpk= 2744, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1117,1118,1117,1118,
 igr2=1146,1147,
 &end
#
#   73 ASN  HB-          73 ASN  HD2+        3.50    (#   2745:10  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2745, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1141,1142,
 igr2=1146,1147,
 &end
#
#   73 ASN  HB+          73 ASN  HD2+        3.50    (#   2746:10  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2746, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1141,1142,
 igr2=1146,1147,
 &end
#
#   73 ASN  HB-          73 ASN  HD2-        3.50    (#   2747:10  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2747, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1141,1142,
 igr2=1146,1147,
 &end
#
#   73 ASN  HB+          73 ASN  HD2-        4.50    (#   2748:10  Unique         2.13, 3.34 A)
 &rst
  ixpk= 2748, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1141,1142,
 igr2=1146,1147,
 &end
#
#    0 AMB  10-2:2749     0 AMB  10-1:2749   5.50    (#   2749:10  Double Ambig)
 &rst
  ixpk= 2749, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1123,1124,1123,1124,
 igr2=1146,1147,1146,1147,
 &end
#
#    0 AMB  10-2:2750    73 ASN  HD2-        5.50    (#   2750:10  Single Ambig)
 &rst
  ixpk= 2750, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1123,1124,1123,1124,
 igr2=1146,1147,
 &end
#
#   72 ARG  HA           73 ASN  HD2+        5.50    (#   2751:10  Unique         4.15, 5.39 A)
 &rst
  ixpk= 2751, nxpk= 10, iat=1115,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1146,1147,
 &end
#
#   73 ASN  HA           73 ASN  HD2+        4.50    (#   2754:10  Unique         3.80, 4.46 A)
 &rst
  ixpk= 2754, nxpk= 10, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1146,1147,
 &end
#
#   73 ASN  HA           73 ASN  HD2-        5.50    (#   2755:10  Unique         3.80, 4.46 A)
 &rst
  ixpk= 2755, nxpk= 10, iat=1139,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1146,1147,
 &end
#
#    0 AMB  10-2:2756     0 AMB  10-1:2756   4.50    (#   2756:10  Double Ambig)
 &rst
  ixpk= 2756, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1137,1151,
 igr2=1146,1147,1146,1147,
 &end
#
#    0 AMB  10-2:2757    73 ASN  HD2-        4.50    (#   2757:10  Single Ambig)
 &rst
  ixpk= 2757, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1137,1151,
 igr2=1146,1147,
 &end
#
#   72 ARG  HN           73 ASN  HD2+        5.50    (#   2758:10  Unique         4.01, 5.18 A)
 &rst
  ixpk= 2758, nxpk= 10, iat=1113,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1146,1147,
 &end
#
#   20 GLY  HN          159 GLN  HE2+        5.50    (#   2759:10  Unique         2.71, 4.52 A)
 &rst
  ixpk= 2759, nxpk= 10, iat= 299,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2634,2635,
 &end
#
#    0 AMB  10-2:2760     0 AMB  10-1:2760   5.50    (#   2760:10  Double Ambig)
 &rst
  ixpk= 2760, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 258,2639,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  10-2:2761     0 AMB  10-1:2761   5.50    (#   2761:10  Double Ambig)
 &rst
  ixpk= 2761, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=1855, 299,
 igr2=1833,1834,2634,2635,
 &end
#
#  159 GLN  HA          159 GLN  HE2+        4.50    (#   2762:10  Unique         2.06, 3.78 A)
 &rst
  ixpk= 2762, nxpk= 10, iat=2624,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2634,2635,
 &end
#
#    0 AMB  10-2:2763     0 AMB  10-1:2763   5.50    (#   2763:10  Double Ambig)
 &rst
  ixpk= 2763, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=2596,2597,2596,2597,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  10-2:2764   159 GLN  HE2-        5.50    (#   2764:10  Single Ambig)
 &rst
  ixpk= 2764, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2596,2597,2596,2597,
 igr2=2634,2635,
 &end
#
#  159 GLN  HA          159 GLN  HE2-        4.50    (#   2765:10  Unique         2.06, 3.78 A)
 &rst
  ixpk= 2765, nxpk= 10, iat=2624,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2634,2635,
 &end
#
#   19 GLN  HA          159 GLN  HE2+        5.50    (#   2766:10  Unique         2.46, 4.22 A)
 &rst
  ixpk= 2766, nxpk= 10, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2634,2635,
 &end
#
#   19 GLN  HA          159 GLN  HE2-        5.50    (#   2767:10  Unique         2.46, 4.22 A)
 &rst
  ixpk= 2767, nxpk= 10, iat= 284,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2634,2635,
 &end
#
#   20 GLY  HA-         159 GLN  HE2+        5.50    (#   2768:10  Unique         3.14, 5.81 A)
 &rst
  ixpk= 2768, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 301, 302,
 igr2=2634,2635,
 &end
#
#   20 GLY  HA-         159 GLN  HE2-        5.50    (#   2769:10  Unique         3.14, 5.81 A)
 &rst
  ixpk= 2769, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 301, 302,
 igr2=2634,2635,
 &end
#
#    0 AMB  10-2:2770     0 AMB  10-1:2770   2.80    (#   2770:10  Double Ambig)
 &rst
  ixpk= 2770, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=2629,2630,2629,2630,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  10-2:2771   159 GLN  HE2-        3.50    (#   2771:10  Single Ambig)
 &rst
  ixpk= 2771, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=2629,2630,2629,2630,
 igr2=2634,2635,
 &end
#
#    0 AMB  10-2:2772     0 AMB  10-1:2772   4.50    (#   2772:10  Double Ambig)
 &rst
  ixpk= 2772, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 262, 263,2686,2687,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  10-2:2773   159 GLN  HE2-        4.50    (#   2773:10  Single Ambig)
 &rst
  ixpk= 2773, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 262, 263,2686,2687,
 igr2=2634,2635,
 &end
#
#  159 GLN  HB+         159 GLN  HE2-        4.50    (#   2774:10  Unique         1.95, 3.44 A)
 &rst
  ixpk= 2774, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2626,2627,
 igr2=2634,2635,
 &end
#
#  159 GLN  HB+         159 GLN  HE2+        4.50    (#   2775:10  Unique         1.95, 3.44 A)
 &rst
  ixpk= 2775, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2626,2627,
 igr2=2634,2635,
 &end
#
#    0 AMB  10-2:2776     0 AMB  10-1:2776   3.50    (#   2776:10  Double Ambig)
 &rst
  ixpk= 2776, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,
 igr2=2634,2635,2634,2635,
 &end
#
#    0 AMB  10-2:2777   159 GLN  HE2-        4.50    (#   2777:10  Single Ambig)
 &rst
  ixpk= 2777, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=2565,2566,2567,2569,2570,2571,2612,2613,2614,2616,
      2617,2618,
 igr2=2634,2635,
 &end
#
#   18 ARG  HG-         159 GLN  HE2+        4.50    (#   2778:10  Unique         4.15, 5.66 A)
 &rst
  ixpk= 2778, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 265, 266,
 igr2=2634,2635,
 &end
#
#   18 ARG  HB-         159 GLN  HE2+        3.50    (#   2779:10  Unique         2.72, 4.38 A)
 &rst
  ixpk= 2779, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 262, 263,
 igr2=2634,2635,
 &end
#
#   95 GLN  HB+          97 GLN  HE2+        5.50    (#   2780:10  Unique         2.00, 4.30 A)
 &rst
  ixpk= 2780, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,
 igr2=1589,1590,
 &end
#
#    0 AMB  10-2:2781     0 AMB  10-1:2781   4.50    (#   2781:10  Double Ambig)
 &rst
  ixpk= 2781, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1581,1582,1204,1205,
 igr2=1589,1590,1589,1590,
 &end
#
#   95 GLN  HB+          97 GLN  HE2-        4.50    (#   2782:10  Unique         2.00, 4.30 A)
 &rst
  ixpk= 2782, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1542,1543,
 igr2=1589,1590,
 &end
#
#    0 AMB  10-2:2783    97 GLN  HE2-        4.50    (#   2783:10  Single Ambig)
 &rst
  ixpk= 2783, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1581,1582,1204,1205,
 igr2=1589,1590,
 &end
#
#    0 AMB  10-2:2784     0 AMB  10-1:2784   4.50    (#   2784:10  Double Ambig)
 &rst
  ixpk= 2784, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 418, 419,1926,1927, 793, 794,
 igr2= 477, 478,1867,1868, 644, 645,
 &end
#
#   30 GLN  HB-          30 GLN  HE2+        4.50    (#   2785:10  Unique         1.95, 3.60 A)
 &rst
  ixpk= 2785, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 469, 470,
 igr2= 477, 478,
 &end
#
#   27 ARG  HB-          30 GLN  HE2-        5.50    (#   2786:10  Unique         1.94, 3.56 A)
 &rst
  ixpk= 2786, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 418, 419,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2787    30 GLN  HE2-        5.50    (#   2787:10  Single Ambig)
 &rst
  ixpk= 2787, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 418, 419, 469, 470,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2788    30 GLN  HE2-        3.50    (#   2788:10  Single Ambig)
 &rst
  ixpk= 2788, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 472, 473, 472, 473,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2789     0 AMB  10-1:2789   2.80    (#   2789:10  Double Ambig)
 &rst
  ixpk= 2789, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 472, 473, 472, 473,
 igr2= 477, 478, 477, 478,
 &end
#
#   27 ARG  HD-          30 GLN  HE2-        5.50    (#   2790:10  Unique         2.03, 5.18 A)
 &rst
  ixpk= 2790, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2= 477, 478,
 &end
#
#   27 ARG  HD+          30 GLN  HE2-        5.50    (#   2791:10  Unique         2.03, 5.18 A)
 &rst
  ixpk= 2791, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 424, 425,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2793     0 AMB  10-1:2793   5.50    (#   2793:10  Double Ambig)
 &rst
  ixpk= 2793, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 503, 504, 503, 504, 650, 651,
 igr2= 477, 478, 477, 478, 644, 645,
 &end
#
#    0 AMB  10-2:2794    30 GLN  HE2-        5.50    (#   2794:10  Single Ambig)
 &rst
  ixpk= 2794, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 503, 504, 503, 504,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2795     0 AMB  10-1:2795   5.50    (#   2795:10  Double Ambig)
 &rst
  ixpk= 2795, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 467,1932,
 igr2= 477, 478,1867,1868,
 &end
#
#   30 GLN  HA           30 GLN  HE2-        5.50    (#   2796:10  Unique         4.27, 5.44 A)
 &rst
  ixpk= 2796, nxpk= 10, iat= 467,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2797     0 AMB  10-1:2797   5.50    (#   2797:10  Double Ambig)
 &rst
  ixpk= 2797, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 465, 786, 765,
 igr2= 477, 478, 644, 645, 733, 734,
 &end
#
#    0 AMB  10-2:2798     0 AMB  10-1:2798   5.50    (#   2798:10  Double Ambig)
 &rst
  ixpk= 2798, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 510, 482,
 igr2= 477, 478, 477, 478,
 &end
#
#    0 AMB  10-2:2799    30 GLN  HE2-        5.50    (#   2799:10  Single Ambig)
 &rst
  ixpk= 2799, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 510, 482,
 igr2= 477, 478,
 &end
#
#   30 GLN  HN           30 GLN  HE2-        5.50    (#   2800:10  Unique         4.49, 5.63 A)
 &rst
  ixpk= 2800, nxpk= 10, iat= 465,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 477, 478,
 &end
#
#    0 AMB  10-2:2801     0 AMB  10-1:2801   4.50    (#   2801:10  Double Ambig)
 &rst
  ixpk= 2801, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=2216,2217,2162,2163,
 igr2=2221,2222,2221,2222,
 &end
#
#    0 AMB  10-2:2802   135 GLN  HE2-        4.50    (#   2802:10  Single Ambig)
 &rst
  ixpk= 2802, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=2216,2217,2162,2163,
 igr2=2221,2222,
 &end
#
#    0 AMB  10-2:2803     0 AMB  10-1:2803   4.50    (#   2803:10  Double Ambig)
 &rst
  ixpk= 2803, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=2066,2159,2160,2189,2190,
 igr2=2221,2222,2221,2222,2221,2222,
 &end
#
#  135 GLN  HG+         135 GLN  HE2-        3.50    (#   2804:10  Unique         2.13, 3.37 A)
 &rst
  ixpk= 2804, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2216,2217,
 igr2=2221,2222,
 &end
#
#  134 ARG  HB+         135 GLN  HE2+        5.50    (#   2805:10  Unique         5.55, 6.95 A)
 &rst
  ixpk= 2805, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2189,2190,
 igr2=2221,2222,
 &end
#
#    0 AMB  10-2:2806   135 GLN  HE2-        5.50    (#   2806:10  Single Ambig)
 &rst
  ixpk= 2806, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1=2066,2159,2160,2189,2190,
 igr2=2221,2222,
 &end
#
#  135 GLN  HG+         135 GLN  HE2+        3.50    (#   2807:10  Unique         2.13, 3.37 A)
 &rst
  ixpk= 2807, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2216,2217,
 igr2=2221,2222,
 &end
#
#    0 AMB  10-2:2808   135 GLN  HE2-        5.50    (#   2808:10  Single Ambig)
 &rst
  ixpk= 2808, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=2189,2190,2315,2316,
 igr2=2221,2222,
 &end
#
#  135 GLN  HB+         135 GLN  HE2-        5.50    (#   2809:10  Unique         1.95, 3.91 A)
 &rst
  ixpk= 2809, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2213,2214,
 igr2=2221,2222,
 &end
#
#  135 GLN  HB+         135 GLN  HE2+        5.50    (#   2810:10  Unique         1.95, 3.91 A)
 &rst
  ixpk= 2810, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2213,2214,
 igr2=2221,2222,
 &end
#
#  135 GLN  HA          135 GLN  HE2+        5.50    (#   2813:10  Unique         2.27, 3.53 A)
 &rst
  ixpk= 2813, nxpk= 10, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=2221,2222,
 &end
#
#  135 GLN  HA          135 GLN  HE2-        4.50    (#   2814:10  Unique         2.27, 3.53 A)
 &rst
  ixpk= 2814, nxpk= 10, iat=2211,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=2221,2222,
 &end
#
#    0 AMB  10-2:2815     0 AMB  10-1:2815   5.50    (#   2815:10  Double Ambig)
 &rst
  ixpk= 2815, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 369,2209,
 igr2=2221,2222,2221,2222,
 &end
#
#  128 SER  HA           21 GLN  HE2-        5.50    (#   2819:10  Unique         1.91, 4.23 A)
 &rst
  ixpk= 2819, nxpk= 10, iat=2080,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 318, 319,
 &end
#
#    0 AMB  10-2:2820    21 GLN  HE2-        5.50    (#   2820:10  Single Ambig)
 &rst
  ixpk= 2820, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 248, 249,2042,2043,2042,2043,
 igr2= 318, 319,
 &end
#
#    0 AMB  10-2:2821     0 AMB  10-1:2821   5.50    (#   2821:10  Double Ambig)
 &rst
  ixpk= 2821, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 843, 844,2114,2115, 360, 361,
 igr2= 889, 318, 319, 318, 319,
 &end
#
#   19 GLN  HG+          21 GLN  HE2-        5.50    (#   2822:10  Unique         1.95, 5.67 A)
 &rst
  ixpk= 2822, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 289, 290,
 igr2= 318, 319,
 &end
#
#   21 GLN  HB-          21 GLN  HE2-        5.50    (#   2823:10  Unique         2.93, 4.54 A)
 &rst
  ixpk= 2823, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 310, 311,
 igr2= 318, 319,
 &end
#
#   21 GLN  HB-          21 GLN  HE2+        5.50    (#   2824:10  Unique         2.93, 4.54 A)
 &rst
  ixpk= 2824, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 310, 311,
 igr2= 318, 319,
 &end
#
#  159 GLN  HB-          21 GLN  HE2+        4.50    (#   2825:10  Unique         3.33, 6.92 A)
 &rst
  ixpk= 2825, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2626,2627,
 igr2= 318, 319,
 &end
#
#  159 GLN  HB-          21 GLN  HE2-        4.50    (#   2826:10  Unique         3.33, 6.92 A)
 &rst
  ixpk= 2826, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2626,2627,
 igr2= 318, 319,
 &end
#
#  115 THR  MG2         112 ASN  HD2+        5.50    (#   2842:10  Unique         2.07, 5.29 A)
 &rst
  ixpk= 2842, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1878,1879,1880,
 igr2=1833,1834,
 &end
#
#  115 THR  MG2         112 ASN  HD2-        4.50    (#   2843:10  Unique         2.07, 5.29 A)
 &rst
  ixpk= 2843, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1878,1879,1880,
 igr2=1833,1834,
 &end
#
#  112 ASN  HB-         112 ASN  HD2+        3.50    (#   2844:10  Unique         2.11, 3.16 A)
 &rst
  ixpk= 2844, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1828,1829,
 igr2=1833,1834,
 &end
#
#  112 ASN  HB-         112 ASN  HD2-        3.50    (#   2845:10  Unique         2.11, 3.16 A)
 &rst
  ixpk= 2845, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1828,1829,
 igr2=1833,1834,
 &end
#
#  115 THR  HB          112 ASN  HD2+        5.50    (#   2846:10  Unique         2.52, 4.50 A)
 &rst
  ixpk= 2846, nxpk= 10, iat=1876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1833,1834,
 &end
#
#  115 THR  HB          112 ASN  HD2-        5.50    (#   2847:10  Unique         2.52, 4.50 A)
 &rst
  ixpk= 2847, nxpk= 10, iat=1876,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1833,1834,
 &end
#
#  114 GLN  HN          112 ASN  HD2+        5.50    (#   2848:10  Unique         1.93, 5.15 A)
 &rst
  ixpk= 2848, nxpk= 10, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1833,1834,
 &end
#
#  114 GLN  HN          112 ASN  HD2-        5.50    (#   2849:10  Unique         1.93, 5.15 A)
 &rst
  ixpk= 2849, nxpk= 10, iat=1855,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1833,1834,
 &end
#
#    0 AMB  10-2:2852    82 ARG  HE          5.50    (#   2852:10  Single Ambig)
 &rst
  ixpk= 2852, nxpk= 10, iat=  -1,1329, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1349,1350,1351,1353,1354,1355,1349,1350,1351,1353,
      1354,1355,
 &end
#
#   62 ARG  HG-          62 ARG  HE          4.50    (#   2853:10  Unique         2.43, 3.40 A)
 &rst
  ixpk= 2853, nxpk= 10, iat=  -1, 955, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 949, 950,
 &end
#
#   62 ARG  HG+          62 ARG  HE          4.50    (#   2854:10  Unique         2.43, 3.40 A)
 &rst
  ixpk= 2854, nxpk= 10, iat=  -1, 955, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 949, 950,
 &end
#
#   62 ARG  HB+          62 ARG  HE          5.50    (#   2855:10  Unique         3.22, 4.08 A)
 &rst
  ixpk= 2855, nxpk= 10, iat=  -1, 955, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 946, 947,
 &end
#
#   82 ARG  HG+          82 ARG  HE          4.50    (#   2856:10  Unique         2.09, 3.13 A)
 &rst
  ixpk= 2856, nxpk= 10, iat=  -1,1329, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1323,1324,
 &end
#
#    0 AMB  10-2:2857    82 ARG  HE          5.50    (#   2857:10  Single Ambig)
 &rst
  ixpk= 2857, nxpk= 10, iat=  -1,1329, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1320,1321,1284,1285,
 &end
#
#   82 ARG  HB+          82 ARG  HE          5.50    (#   2858:10  Unique         1.88, 2.80 A)
 &rst
  ixpk= 2858, nxpk= 10, iat=  -1,1329, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1320,1321,
 &end
#
#    0 AMB  10-2:2859    62 ARG  HE          2.80    (#   2859:10  Single Ambig)
 &rst
  ixpk= 2859, nxpk= 10, iat=  -1, 955, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 952, 953, 952, 953,
 &end
#
#    0 AMB  10-2:2860    82 ARG  HE          3.50    (#   2860:10  Single Ambig)
 &rst
  ixpk= 2860, nxpk= 10, iat=  -1,1329, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1326,1327,1326,1327,
 &end
#
#   62 ARG  HA           62 ARG  HE          5.50    (#   2861:10  Unique         5.24, 5.43 A)
 &rst
  ixpk= 2861, nxpk= 10, iat= 944, 955, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 ARG  HN           62 ARG  HE          5.50    (#   2864:10  Unique         2.94, 3.69 A)
 &rst
  ixpk= 2864, nxpk= 10, iat= 942, 955, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  103 GLN  HA          103 GLN  HE2+        5.50    (#   2867:10  Unique         1.99, 3.13 A)
 &rst
  ixpk= 2867, nxpk= 10, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1710,1711,
 &end
#
#  103 GLN  HA          103 GLN  HE2-        5.50    (#   2868:10  Unique         1.99, 3.13 A)
 &rst
  ixpk= 2868, nxpk= 10, iat=1700,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1710,1711,
 &end
#
#   41 ASN  HN           41 ASN  HD2+        5.50    (#   2869:10  Unique         2.67, 4.53 A)
 &rst
  ixpk= 2869, nxpk= 10, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   41 ASN  HN           41 ASN  HD2-        5.50    (#   2870:10  Unique         2.67, 4.53 A)
 &rst
  ixpk= 2870, nxpk= 10, iat= 635,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   52 ARG  HE           41 ASN  HD2+        5.50    (#   2871:10  Unique         4.33, 5.33 A)
 &rst
  ixpk= 2871, nxpk= 10, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   52 ARG  HE           41 ASN  HD2-        5.50    (#   2872:10  Unique         4.33, 5.33 A)
 &rst
  ixpk= 2872, nxpk= 10, iat= 799,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   41 ASN  HA           41 ASN  HD2+        5.50    (#   2873:10  Unique         1.95, 3.67 A)
 &rst
  ixpk= 2873, nxpk= 10, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   41 ASN  HA           41 ASN  HD2-        5.50    (#   2874:10  Unique         1.95, 3.67 A)
 &rst
  ixpk= 2874, nxpk= 10, iat= 637,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 644, 645,
 &end
#
#   42 PRO  HD+          41 ASN  HD2-        5.50    (#   2875:10  Unique         1.94, 4.27 A)
 &rst
  ixpk= 2875, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 644, 645,
 &end
#
#    0 AMB  10-2:2876     0 AMB  10-1:2876   5.50    (#   2876:10  Double Ambig)
 &rst
  ixpk= 2876, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 503, 504, 650, 651,
 igr2= 477, 478, 644, 645,
 &end
#
#   42 PRO  HD-          41 ASN  HD2-        5.50    (#   2877:10  Unique         1.94, 4.27 A)
 &rst
  ixpk= 2877, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 644, 645,
 &end
#
#   42 PRO  HD-          41 ASN  HD2+        5.50    (#   2878:10  Unique         1.94, 4.27 A)
 &rst
  ixpk= 2878, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 650, 651,
 igr2= 644, 645,
 &end
#
#   52 ARG  HD+          41 ASN  HD2-        5.50    (#   2879:10  Unique         2.45, 4.56 A)
 &rst
  ixpk= 2879, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 796, 797,
 igr2= 644, 645,
 &end
#
#   41 ASN  HB+          41 ASN  HD2-        4.50    (#   2880:10  Unique         2.12, 3.27 A)
 &rst
  ixpk= 2880, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#   41 ASN  HB-          41 ASN  HD2-        4.50    (#   2881:10  Unique         2.12, 3.27 A)
 &rst
  ixpk= 2881, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#    0 AMB  10-2:2882     0 AMB  10-1:2882   3.50    (#   2882:10  Double Ambig)
 &rst
  ixpk= 2882, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 639, 640, 728, 729, 728, 729,
 igr2= 644, 645, 733, 734, 733, 734,
 &end
#
#   41 ASN  HB+          41 ASN  HD2+        4.50    (#   2883:10  Unique         2.12, 3.27 A)
 &rst
  ixpk= 2883, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 639, 640,
 igr2= 644, 645,
 &end
#
#    0 AMB  10-2:2884    41 ASN  HD2-        5.50    (#   2884:10  Single Ambig)
 &rst
  ixpk= 2884, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 674, 675, 674, 675, 653, 654,
 igr2= 644, 645,
 &end
#
#   52 ARG  HG-          41 ASN  HD2-        5.50    (#   2885:10  Unique         2.48, 4.75 A)
 &rst
  ixpk= 2885, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 793, 794,
 igr2= 644, 645,
 &end
#
#   82 ARG  HN           82 ARG  HE          5.50    (#   2887:10  Unique         2.28, 3.97 A)
 &rst
  ixpk= 2887, nxpk= 10, iat=1316,1329, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   80 PRO  HA           82 ARG  HE          5.50    (#   2888:10  Unique         4.46, 5.06 A)
 &rst
  ixpk= 2888, nxpk= 10, iat=1290,1329, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ARG  HN           72 ARG  HE          5.50    (#   2889:10  Unique         3.70, 4.08 A)
 &rst
  ixpk= 2889, nxpk= 10, iat=1113,1126, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ARG  HA           72 ARG  HE          5.50    (#   2891:10  Unique         4.89, 5.34 A)
 &rst
  ixpk= 2891, nxpk= 10, iat=1115,1126, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2892    72 ARG  HE          2.80    (#   2892:10  Single Ambig)
 &rst
  ixpk= 2892, nxpk= 10, iat=  -1,1126, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1123,1124,1123,1124,
 &end
#
#    0 AMB  10-2:2893    72 ARG  HE          5.50    (#   2893:10  Single Ambig)
 &rst
  ixpk= 2893, nxpk= 10, iat=  -1,1126, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1117,1118,1117,1118,
 &end
#
#  149 LYS  HD-          72 ARG  HE          5.50    (#   2894:10  Unique         5.16, 6.13 A)
 &rst
  ixpk= 2894, nxpk= 10, iat=  -1,1126, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2475,2476,
 &end
#
#   72 ARG  HG+          72 ARG  HE          5.50    (#   2895:10  Unique         2.15, 3.38 A)
 &rst
  ixpk= 2895, nxpk= 10, iat=  -1,1126, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1120,1121,
 &end
#
#  134 ARG  HA          134 ARG  HE          5.50    (#   2898:10  Unique         1.94, 2.40 A)
 &rst
  ixpk= 2898, nxpk= 10, iat=2187,2198, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  141 ARG  HD+         134 ARG  HE          3.50    (#   2900:10  Unique         1.91, 3.13 A)
 &rst
  ixpk= 2900, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2321,2322,
 &end
#
#    0 AMB  10-2:2901   134 ARG  HE          4.50    (#   2901:10  Single Ambig)
 &rst
  ixpk= 2901, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2321,2322,2195,2196,2195,2196,
 &end
#
#    0 AMB  10-2:2902   134 ARG  HE          3.50    (#   2902:10  Single Ambig)
 &rst
  ixpk= 2902, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=2318,2319,2315,2316,
 &end
#
#    0 AMB  10-2:2903   134 ARG  HE          3.50    (#   2903:10  Single Ambig)
 &rst
  ixpk= 2903, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2318,2319,2315,2316,2189,2190,
 &end
#
#    0 AMB  10-2:2904   134 ARG  HE          4.50    (#   2904:10  Single Ambig)
 &rst
  ixpk= 2904, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2318,2319,2192,2193,
 &end
#
#  141 ARG  HG-         134 ARG  HE          5.50    (#   2905:10  Unique         1.87, 3.27 A)
 &rst
  ixpk= 2905, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2318,2319,
 &end
#
#  136 VAL  MGX         134 ARG  HE          5.50    (#   2906:10  Unique         5.02, 7.71 A)
 &rst
  ixpk= 2906, nxpk= 10, iat=  -1,2198, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#   68 LEU  HA           66 ARG  HE          5.50    (#   2910:10  Unique         2.76, 3.31 A)
 &rst
  ixpk= 2910, nxpk= 10, iat=1061,1029, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2911    66 ARG  HE          2.80    (#   2911:10  Single Ambig)
 &rst
  ixpk= 2911, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1026,1027,1026,1027,
 &end
#
#   67 ILE  HB           66 ARG  HE          5.50    (#   2912:10  Unique         2.88, 3.49 A)
 &rst
  ixpk= 2912, nxpk= 10, iat=1044,1029, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ARG  HB+          66 ARG  HE          4.50    (#   2914:10  Unique         3.98, 4.35 A)
 &rst
  ixpk= 2914, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1020,1021,
 &end
#
#   66 ARG  HG-          66 ARG  HE          4.50    (#   2915:10  Unique         2.09, 2.75 A)
 &rst
  ixpk= 2915, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#   66 ARG  HG+          66 ARG  HE          3.50    (#   2916:10  Unique         2.09, 2.75 A)
 &rst
  ixpk= 2916, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1023,1024,
 &end
#
#    0 AMB  10-2:2917    66 ARG  HE          4.50    (#   2917:10  Single Ambig)
 &rst
  ixpk= 2917, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1053,1054,1055,1688,1689,1690,1692,1693,1694,
 &end
#
#   68 LEU  MDY          66 ARG  HE          3.50    (#   2918:10  Unique         2.14, 5.11 A)
 &rst
  ixpk= 2918, nxpk= 10, iat=  -1,1029, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1068,1069,1070,1072,1073,1074,
 &end
#
#   47 GLU  HB+          48 GLN  HE2-        5.50    (#   2919:10  Unique         2.18, 4.89 A)
 &rst
  ixpk= 2919, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 710, 711,
 igr2= 733, 734,
 &end
#
#    0 AMB  10-2:2920     0 AMB  10-1:2920   2.80    (#   2920:10  Double Ambig)
 &rst
  ixpk= 2920, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1975,1976,1862,1863,1862,1863,
 igr2=1867,1868,1867,1868,1867,1868,
 &end
#
#    0 AMB  10-2:2921     0 AMB  10-1:2921   2.80    (#   2921:10  Double Ambig)
 &rst
  ixpk= 2921, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 728, 729, 728, 729,
 igr2= 733, 734, 733, 734,
 &end
#
#    0 AMB  10-2:2922    48 GLN  HE2-        2.80    (#   2922:10  Single Ambig)
 &rst
  ixpk= 2922, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 728, 729, 728, 729,
 igr2= 733, 734,
 &end
#
#   45 SER  HB-          48 GLN  HE2+        5.50    (#   2923:10  Unique         1.92, 2.44 A)
 &rst
  ixpk= 2923, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 689, 690,
 igr2= 733, 734,
 &end
#
#   45 SER  HB-          48 GLN  HE2-        5.50    (#   2924:10  Unique         1.92, 2.44 A)
 &rst
  ixpk= 2924, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 689, 690,
 igr2= 733, 734,
 &end
#
#    0 AMB  10-2:2925     0 AMB  10-1:2925   5.50    (#   2925:10  Double Ambig)
 &rst
  ixpk= 2925, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 467,1932,
 igr2= 477, 478,1867,1868,
 &end
#
#    0 AMB  10-2:2926     0 AMB  10-1:2926   5.50    (#   2926:10  Double Ambig)
 &rst
  ixpk= 2926, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 672, 536,
 igr2= 733, 734, 477, 478,
 &end
#
#   45 SER  HA           48 GLN  HE2-        5.50    (#   2927:10  Unique         3.96, 4.34 A)
 &rst
  ixpk= 2927, nxpk= 10, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 733, 734,
 &end
#
#   48 GLN  HN           48 GLN  HE2-        5.50    (#   2928:10  Unique         2.28, 3.13 A)
 &rst
  ixpk= 2928, nxpk= 10, iat= 721,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 733, 734,
 &end
#
#   45 SER  HN           48 GLN  HE2+        5.50    (#   2929:10  Unique         1.87, 3.13 A)
 &rst
  ixpk= 2929, nxpk= 10, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 733, 734,
 &end
#
#   45 SER  HN           48 GLN  HE2-        5.50    (#   2930:10  Unique         1.87, 3.13 A)
 &rst
  ixpk= 2930, nxpk= 10, iat= 685,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 733, 734,
 &end
#
#   11 VAL  MGY          10 ASN  HD2+        5.50    (#   2931:10  Unique         6.20, 8.18 A)
 &rst
  ixpk= 2931, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 162, 163, 164, 166, 167, 168,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2932     0 AMB  10-1:2932   5.50    (#   2932:10  Double Ambig)
 &rst
  ixpk= 2932, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.77, r4=12.27,
 igr1=1565,1566, 162, 163, 164, 166, 167, 168,1601,1602,
      2296,2297,
 igr2= 151, 152, 151, 152, 151, 152, 151, 152,
 &end
#
#    0 AMB  10-2:2933    10 ASN  HD2-        5.50    (#   2933:10  Single Ambig)
 &rst
  ixpk= 2933, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 629, 630, 631, 162, 163, 164, 166, 167, 168,
 igr2= 151, 152,
 &end
#
#    0 AMB  10-2:2934    10 ASN  HD2-        5.50    (#   2934:10  Single Ambig)
 &rst
  ixpk= 2934, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1565,1566, 162, 163, 164, 166, 167, 168,1601,1602,
      2296,2297,
 igr2= 151, 152,
 &end
#
#   88 THR  MG2          85 ARG  HE          4.50    (#   2935:10  Unique         1.94, 4.54 A)
 &rst
  ixpk= 2935, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1441,1442,1443,
 &end
#
#   85 ARG  HG-          85 ARG  HE          4.50    (#   2936:10  Unique         2.12, 3.31 A)
 &rst
  ixpk= 2936, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1382,1383,
 &end
#
#   85 ARG  HG+          85 ARG  HE          3.50    (#   2937:10  Unique         2.12, 3.31 A)
 &rst
  ixpk= 2937, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1382,1383,
 &end
#
#   85 ARG  HB-          85 ARG  HE          3.50    (#   2938:10  Unique         2.24, 3.74 A)
 &rst
  ixpk= 2938, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1379,1380,
 &end
#
#   85 ARG  HB+          85 ARG  HE          4.50    (#   2939:10  Unique         2.24, 3.74 A)
 &rst
  ixpk= 2939, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1379,1380,
 &end
#
#    0 AMB  10-2:2941    85 ARG  HE          2.80    (#   2941:10  Single Ambig)
 &rst
  ixpk= 2941, nxpk= 10, iat=  -1,1388, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1385,1386,1385,1386,
 &end
#
#   85 ARG  HA           85 ARG  HE          4.50    (#   2942:10  Unique         4.21, 4.84 A)
 &rst
  ixpk= 2942, nxpk= 10, iat=1377,1388, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 ARG  HN           85 ARG  HE          5.50    (#   2945:10  Unique         1.89, 3.01 A)
 &rst
  ixpk= 2945, nxpk= 10, iat=1375,1388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   87 ASP  HN           85 ARG  HE          5.50    (#   2946:10  Unique         3.96, 5.27 A)
 &rst
  ixpk= 2946, nxpk= 10, iat=1423,1388, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:2958   146 ARG  HE          4.50    (#   2958:10  Single Ambig)
 &rst
  ixpk= 2958, nxpk= 10, iat=  -1,2421, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1184,1185,1186,1188,1189,1190,1184,1185,1186,1188,
      1189,1190,
 &end
#
#    0 AMB  10-2:2959   146 ARG  HE          5.50    (#   2959:10  Single Ambig)
 &rst
  ixpk= 2959, nxpk= 10, iat=  -1,2421, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 &end
#
#  146 ARG  HG-         146 ARG  HE          4.50    (#   2960:10  Unique         2.17, 3.01 A)
 &rst
  ixpk= 2960, nxpk= 10, iat=  -1,2421, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2415,2416,
 &end
#
#    0 AMB  10-2:2961   146 ARG  HE          3.50    (#   2961:10  Single Ambig)
 &rst
  ixpk= 2961, nxpk= 10, iat=  -1,2421, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2412,2413,2412,2413,2415,2416,
 &end
#
#    0 AMB  10-2:2962   146 ARG  HE          2.80    (#   2962:10  Single Ambig)
 &rst
  ixpk= 2962, nxpk= 10, iat=  -1,2421, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=2418,2419,2418,2419,
 &end
#
#  143 VAL  HA          146 ARG  HE          5.50    (#   2963:10  Unique         1.91, 3.00 A)
 &rst
  ixpk= 2963, nxpk= 10, iat=2349,2421, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  146 ARG  HA          146 ARG  HE          5.50    (#   2964:10  Unique         3.83, 4.67 A)
 &rst
  ixpk= 2964, nxpk= 10, iat=2410,2421, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  142 ASP  HA          146 ARG  HE          5.50    (#   2965:10  Unique         3.42, 4.46 A)
 &rst
  ixpk= 2965, nxpk= 10, iat=2337,2421, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  127 VAL  MGY         125 ARG  HE          5.50    (#   2967:10  Unique         2.74, 5.52 A)
 &rst
  ixpk= 2967, nxpk= 10, iat=  -1,2027, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2068,2069,2070,2072,2073,2074,
 &end
#
#  125 ARG  HG-         125 ARG  HE          5.50    (#   2968:10  Unique         2.10, 2.92 A)
 &rst
  ixpk= 2968, nxpk= 10, iat=  -1,2027, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2021,2022,
 &end
#
#  127 VAL  HB          125 ARG  HE          5.50    (#   2970:10  Unique         4.22, 5.39 A)
 &rst
  ixpk= 2970, nxpk= 10, iat=2066,2027, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  133 VAL  MGX         145 ARG  HE          5.50    (#   2975:10  Unique         1.97, 5.72 A)
 &rst
  ixpk= 2975, nxpk= 10, iat=  -1,2397, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2175,2176,2177,2179,2180,2181,
 &end
#
#  145 ARG  HG-         145 ARG  HE          5.50    (#   2976:10  Unique         2.09, 3.15 A)
 &rst
  ixpk= 2976, nxpk= 10, iat=  -1,2397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2391,2392,
 &end
#
#  145 ARG  HG+         145 ARG  HE          5.50    (#   2977:10  Unique         2.09, 3.15 A)
 &rst
  ixpk= 2977, nxpk= 10, iat=  -1,2397, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2391,2392,
 &end
#
#    0 AMB  10-2:2978   145 ARG  HE          5.50    (#   2978:10  Single Ambig)
 &rst
  ixpk= 2978, nxpk= 10, iat=  -1,2397, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2388,2389,2388,2389,
 &end
#
#    0 AMB  10-2:2979   145 ARG  HE          4.50    (#   2979:10  Single Ambig)
 &rst
  ixpk= 2979, nxpk= 10, iat=  -1,2397, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=2394,2395,2394,2395,
 &end
#
#  142 ASP  HA          145 ARG  HE          5.50    (#   2980:10  Unique         3.73, 4.99 A)
 &rst
  ixpk= 2980, nxpk= 10, iat=2337,2397, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   26 ARG  HG-          26 ARG  HE          5.50    (#   2983:10  Unique         2.15, 3.09 A)
 &rst
  ixpk= 2983, nxpk= 10, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#   26 ARG  HG+          26 ARG  HE          5.50    (#   2984:10  Unique         2.15, 3.09 A)
 &rst
  ixpk= 2984, nxpk= 10, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 397, 398,
 &end
#
#    0 AMB  10-2:2985    26 ARG  HE          5.50    (#   2985:10  Single Ambig)
 &rst
  ixpk= 2985, nxpk= 10, iat=  -1, 403, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 394, 395, 394, 395,
 &end
#
#    0 AMB  10-2:2993    97 GLN  HE2-        5.50    (#   2993:10  Single Ambig)
 &rst
  ixpk= 2993, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=2353,2354,2355,2357,2358,2359,2353,2354,2355,2357,
      2358,2359,
 igr2=1589,1590,
 &end
#
#   95 GLN  HB-          97 GLN  HE2-        5.50    (#   2994:10  Unique         2.00, 4.30 A)
 &rst
  ixpk= 2994, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1542,1543,
 igr2=1589,1590,
 &end
#
#    0 AMB  10-2:2997    97 GLN  HE2-        5.50    (#   2997:10  Single Ambig)
 &rst
  ixpk= 2997, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1196,1540,
 igr2=1589,1590,
 &end
#
#   77 TYR  HE           97 GLN  HE2-        5.50    (#   2998:10  Unique         1.91, 4.87 A)
 &rst
  ixpk= 2998, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1228,1233,
 igr2=1589,1590,
 &end
#
#   77 TYR  HD           97 GLN  HE2-        5.50    (#   2999:10  Unique         3.19, 5.82 A)
 &rst
  ixpk= 2999, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1226,1235,
 igr2=1589,1590,
 &end
#
#   99 TRP  HZ2          97 GLN  HE2-        5.50    (#   3000:10  Unique         1.90, 4.73 A)
 &rst
  ixpk= 3000, nxpk= 10, iat=1629,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1589,1590,
 &end
#
#   92 CYS  HB+          95 GLN  HE2-        5.50    (#   3002:10  Unique         3.48, 5.44 A)
 &rst
  ixpk= 3002, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1505,1506,
 igr2=1550,1551,
 &end
#
#    8 ARG  HD-          95 GLN  HE2-        5.50    (#   3003:10  Unique         2.00, 4.21 A)
 &rst
  ixpk= 3003, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 114, 115,
 igr2=1550,1551,
 &end
#
#   85 ARG  HE           95 GLN  HE2-        5.50    (#   3005:10  Unique         5.22, 6.25 A)
 &rst
  ixpk= 3005, nxpk= 10, iat=1388,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1550,1551,
 &end
#
#   18 ARG  HN           17 ASN  HD2+        5.50    (#   3007:10  Unique         4.08, 5.28 A)
 &rst
  ixpk= 3007, nxpk= 10, iat= 258,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 253, 254,
 &end
#
#   17 ASN  HA           17 ASN  HD2+        5.50    (#   3008:10  Unique         2.29, 3.87 A)
 &rst
  ixpk= 3008, nxpk= 10, iat= 246,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 253, 254,
 &end
#
#    0 AMB  10-2:3010     0 AMB  10-1:3010   5.50    (#   3010:10  Double Ambig)
 &rst
  ixpk= 3010, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 248, 249,2042,2043,2042,2043,
 igr2= 253, 254, 253, 254, 253, 254,
 &end
#
#   21 GLN  HB+          17 ASN  HD2+        5.50    (#   3011:10  Unique         1.91, 5.51 A)
 &rst
  ixpk= 3011, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 310, 311,
 igr2= 253, 254,
 &end
#
#    0 AMB  10-2:3012     0 AMB  10-1:3012   5.50    (#   3012:10  Double Ambig)
 &rst
  ixpk= 3012, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 343, 344, 343, 344,1719,1720,
 igr2= 253, 254, 253, 254, 253, 254,
 &end
#
#    0 AMB  10-2:3014     0 AMB  10-1:3014   5.50    (#   3014:10  Double Ambig)
 &rst
  ixpk= 3014, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=1722, 286, 287,
 igr2= 253, 254, 253, 254,
 &end
#
#    9 PRO  HG+           3 ASP  HN          5.50    (#   3015:10  Unique         4.26, 5.82 A)
 &rst
  ixpk= 3015, nxpk= 10, iat=  -1,  40, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 132, 133,
 &end
#
#    0 AMB  10-2:3016     7 TYR  HN          5.50    (#   3016:10  Single Ambig)
 &rst
  ixpk= 3016, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.61, r4= 8.11,
 igr1=1525,1526,1527,1522,1523,1565,1566,
 &end
#
#    2 ILE  QG2           7 TYR  HN          4.50    (#   3017:10  Unique         2.24, 3.29 A)
 &rst
  ixpk= 3017, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  27,  28,  29,
 &end
#
#    7 TYR  HB+           7 TYR  HN          4.50    (#   3018:10  Unique         2.24, 3.06 A)
 &rst
  ixpk= 3018, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  87,  88,
 &end
#
#    6 GLY  HA-           7 TYR  HN          5.50    (#   3019:10  Unique         2.63, 3.19 A)
 &rst
  ixpk= 3019, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#    6 GLY  HA+           7 TYR  HN          5.50    (#   3020:10  Unique         2.63, 3.19 A)
 &rst
  ixpk= 3020, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  78,  79,
 &end
#
#    7 TYR  HA            7 TYR  HN          4.50    (#   3021:10  Unique         2.90, 2.94 A)
 &rst
  ixpk= 3021, nxpk= 10, iat=  85,  83, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 TYR  HE            7 TYR  HN          5.50    (#   3023:10  Unique         5.21, 5.82 A)
 &rst
  ixpk= 3023, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  93,  98,
 &end
#
#  112 ASN  HD2-        114 GLN  HN          3.50    (#   3024:10  Unique         1.93, 5.15 A)
 &rst
  ixpk= 3024, nxpk= 10, iat=  -1,1855, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1833,1834,
 &end
#
#   93 ILE  HN            7 TYR  HN          5.50    (#   3025:10  Unique         4.42, 4.90 A)
 &rst
  ixpk= 3025, nxpk= 10, iat=1512,  83, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 SER  HB-          46 ALA  HN          4.50    (#   3026:10  Unique         2.12, 3.22 A)
 &rst
  ixpk= 3026, nxpk= 10, iat=  -1, 696, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 689, 690,
 &end
#
#    0 AMB  10-2:3027    51 TYR  HN          5.50    (#   3027:10  Single Ambig)
 &rst
  ixpk= 3027, nxpk= 10, iat=  -1, 765, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 949, 950,1053,1054,1055,1006,1007,1008,1010,1011,
      1012,
 &end
#
#   58 VAL  HA           57 GLU  HN          5.50    (#   3028:10  Unique         4.73, 4.83 A)
 &rst
  ixpk= 3028, nxpk= 10, iat= 891, 874, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:3029    65 VAL  HN          2.80    (#   3029:10  Single Ambig)
 &rst
  ixpk= 3029, nxpk= 10, iat=  -1,1000, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1006,1007,1008,1010,1011,1012,1740,1741,1742,1744,
      1745,1746,
 &end
#
#   66 ARG  HG+          67 ILE  HN          4.50    (#   3030:10  Unique         2.92, 3.99 A)
 &rst
  ixpk= 3030, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1023,1024,
 &end
#
#    0 AMB  10-2:3031    67 ILE  HN          2.80    (#   3031:10  Single Ambig)
 &rst
  ixpk= 3031, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1053,1054,1055,1688,1689,1690,1692,1693,1694,
 &end
#
#    0 AMB  10-2:3033    70 SER  HN          5.50    (#   3033:10  Single Ambig)
 &rst
  ixpk= 3033, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2491,2492,1120,1121,
 &end
#
#   96 LYS  HA           76 ARG  HN          5.50    (#   3037:10  Unique         4.88, 5.06 A)
 &rst
  ixpk= 3037, nxpk= 10, iat=1557,1194, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:3038    82 ARG  HN          4.50    (#   3038:10  Single Ambig)
 &rst
  ixpk= 3038, nxpk= 10, iat=  -1,1316, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1290,1342,
 &end
#
#   83 LEU  HG           84 VAL  HN          5.50    (#   3039:10  Unique         2.36, 4.09 A)
 &rst
  ixpk= 3039, nxpk= 10, iat=1347,1359, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   89 LYS  HG-          89 LYS  HN          4.50    (#   3040:10  Unique         2.65, 3.32 A)
 &rst
  ixpk= 3040, nxpk= 10, iat=  -1,1449, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1456,1457,
 &end
#
#   96 LYS  HN           97 GLN  HN          5.50    (#   3041:10  Unique         3.93, 4.25 A)
 &rst
  ixpk= 3041, nxpk= 10, iat=1555,1577, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:3042    97 GLN  HN          5.50    (#   3042:10  Single Ambig)
 &rst
  ixpk= 3042, nxpk= 10, iat=  -1,1577, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1538,1151,1137,
 &end
#
#  101 LEU  MDY         102 LEU  HN          4.50    (#   3043:10  Unique         1.94, 4.57 A)
 &rst
  ixpk= 3043, nxpk= 10, iat=  -1,1679, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1669,1670,1671,1673,1674,1675,
 &end
#
#  117 SER  HA          116 SER  HN          5.50    (#   3045:10  Unique         4.37, 4.64 A)
 &rst
  ixpk= 3045, nxpk= 10, iat=1899,1886, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:3046   118 THR  HN          4.50    (#   3046:10  Single Ambig)
 &rst
  ixpk= 3046, nxpk= 10, iat=  -1,1908, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1888,1857,
 &end
#
#  122 ASP  HB+         122 ASP  HN          5.50    (#   3047:10  Unique         2.25, 2.98 A)
 &rst
  ixpk= 3047, nxpk= 10, iat=  -1,1971, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1975,1976,
 &end
#
#   21 GLN  HB-         127 VAL  HN          5.50    (#   3048:10  Unique         1.95, 3.58 A)
 &rst
  ixpk= 3048, nxpk= 10, iat=  -1,2062, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 310, 311,
 &end
#
#    0 AMB  10-2:3049   133 VAL  HN          5.50    (#   3049:10  Single Ambig)
 &rst
  ixpk= 3049, nxpk= 10, iat=  -1,2169, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2315,2316,2391,2392,2318,2319,
 &end
#
#  135 GLN  HE2-        135 GLN  HN          5.50    (#   3050:10  Unique         3.90, 5.59 A)
 &rst
  ixpk= 3050, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2221,2222,
 &end
#
#  131 TYR  HE          135 GLN  HN          5.50    (#   3051:10  Unique         5.59, 6.88 A)
 &rst
  ixpk= 3051, nxpk= 10, iat=  -1,2209, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2144,2149,
 &end
#
#  136 VAL  MGX         136 VAL  HN          2.80    (#   3052:10  Unique         1.77, 3.39 A)
 &rst
  ixpk= 3052, nxpk= 10, iat=  -1,2226, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=2232,2233,2234,2236,2237,2238,
 &end
#
#  140 LYS  HG-         140 LYS  HN          4.50    (#   3053:10  Unique         3.41, 4.45 A)
 &rst
  ixpk= 3053, nxpk= 10, iat=  -1,2289, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=2296,2297,
 &end
#
#  137 VAL  HN          138 SER  HN          5.50    (#   3054:10  Unique         4.30, 4.51 A)
 &rst
  ixpk= 3054, nxpk= 10, iat=2242,2258, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  139 PHE  HD          138 SER  HN          5.50    (#   3055:10  Unique         3.59, 5.90 A)
 &rst
  ixpk= 3055, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2277,2285,
 &end
#
#  138 SER  HB-         138 SER  HN          3.50    (#   3057:10  Unique         2.09, 3.02 A)
 &rst
  ixpk= 3057, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=2262,2263,
 &end
#
#  137 VAL  HA          138 SER  HN          2.80    (#   3058:10  Unique         2.17, 2.42 A)
 &rst
  ixpk= 3058, nxpk= 10, iat=2244,2258, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  138 SER  HA          138 SER  HN          4.50    (#   3059:10  Unique         2.74, 2.85 A)
 &rst
  ixpk= 3059, nxpk= 10, iat=2260,2258, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  139 PHE  HB+         138 SER  HN          5.50    (#   3060:10  Unique         4.06, 5.35 A)
 &rst
  ixpk= 3060, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2273,2274,
 &end
#
#    0 AMB  10-2:3061   138 SER  HN          5.50    (#   3061:10  Single Ambig)
 &rst
  ixpk= 3061, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2321,2322,2273,2274,
 &end
#
#  137 VAL  HB          138 SER  HN          4.50    (#   3062:10  Unique         2.40, 3.22 A)
 &rst
  ixpk= 3062, nxpk= 10, iat=2246,2258, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  137 VAL  MGY         138 SER  HN          3.50    (#   3063:10  Unique         1.93, 3.77 A)
 &rst
  ixpk= 3063, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  10-2:3064   142 ASP  HN          5.50    (#   3064:10  Single Ambig)
 &rst
  ixpk= 3064, nxpk= 10, iat=  -1,2335, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1=2232,2233,2234,2236,2237,2238,2296,2297,2248,2249,
      2250,2252,2253,2254,
 &end
#
#  137 VAL  MGX         138 SER  HN          4.50    (#   3066:10  Unique         1.93, 3.77 A)
 &rst
  ixpk= 3066, nxpk= 10, iat=  -1,2258, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2248,2249,2250,2252,2253,2254,
 &end
#
#    0 AMB  10-2:3067   147 VAL  HN          4.50    (#   3067:10  Single Ambig)
 &rst
  ixpk= 3067, nxpk= 10, iat=  -1,2432, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=2388,2389,2388,2389,1179,1180,
 &end
#
#    0 AMB  10-2:3068   149 LYS  HN          5.50    (#   3068:10  Single Ambig)
 &rst
  ixpk= 3068, nxpk= 10, iat=  -1,2465, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2522,2123,
 &end
#
#   61 SER  HN           62 ARG  HN          5.50    (#   3069:10  Unique         4.28, 4.43 A)
 &rst
  ixpk= 3069, nxpk= 10, iat= 931, 942, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  110 GLU  HN          109 ALA  HN          4.50    (#   3070:10  Unique         2.28, 2.63 A)
 &rst
  ixpk= 3070, nxpk= 10, iat=1790,1780, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 LYS  HN           62 ARG  HN          4.50    (#   3071:10  Unique         2.58, 2.67 A)
 &rst
  ixpk= 3071, nxpk= 10, iat= 966, 942, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 TYR  HD           62 ARG  HN          5.50    (#   3072:10  Unique         2.41, 4.07 A)
 &rst
  ixpk= 3072, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 773, 782,
 &end
#
#   51 TYR  HE           62 ARG  HN          5.50    (#   3075:10  Unique         3.84, 5.33 A)
 &rst
  ixpk= 3075, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 775, 780,
 &end
#
#   61 SER  HA           62 ARG  HN          3.50    (#   3076:10  Unique         2.45, 2.69 A)
 &rst
  ixpk= 3076, nxpk= 10, iat= 933, 942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 SER  HB+          62 ARG  HN          2.80    (#   3079:10  Unique         2.00, 2.99 A)
 &rst
  ixpk= 3079, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 935, 936,
 &end
#
#   62 ARG  HA           62 ARG  HN          3.50    (#   3080:10  Unique         2.78, 2.82 A)
 &rst
  ixpk= 3080, nxpk= 10, iat= 944, 942, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:3081    62 ARG  HN          3.50    (#   3081:10  Single Ambig)
 &rst
  ixpk= 3081, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 952, 953, 952, 953, 769, 770,
 &end
#
#    0 AMB  10-2:3082     0 AMB  10-1:3082   4.50    (#   3082:10  Double Ambig)
 &rst
  ixpk= 3082, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 970, 971,1722,
 igr2= 942,1780,
 &end
#
#   62 ARG  HB+          62 ARG  HN          2.80    (#   3083:10  Unique         2.46, 3.15 A)
 &rst
  ixpk= 3083, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 946, 947,
 &end
#
#   62 ARG  HG+          62 ARG  HN          3.50    (#   3084:10  Unique         1.90, 2.70 A)
 &rst
  ixpk= 3084, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 949, 950,
 &end
#
#   62 ARG  HG-          62 ARG  HN          3.50    (#   3085:10  Unique         1.90, 2.70 A)
 &rst
  ixpk= 3085, nxpk= 10, iat=  -1, 942, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 949, 950,
 &end
#
#    0 AMB  10-2:3086     0 AMB  10-1:3086   5.50    (#   3086:10  Double Ambig)
 &rst
  ixpk= 3086, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 921, 922, 923, 925, 926, 927, 921, 922, 923, 925,
       926, 927, 192, 193, 194,
 igr2= 942,1780,
 &end
#
#    0 AMB  10-2:3087   153 SER  HN          5.50    (#   3087:10  Single Ambig)
 &rst
  ixpk= 3087, nxpk= 10, iat=  -1,2532, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=2472,2473,2475,2476,
 &end
#
#    0 AMB  10-2:3088   154 VAL  HN          5.50    (#   3088:10  Single Ambig)
 &rst
  ixpk= 3088, nxpk= 10, iat=  -1,2543, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1082,1083,1084,1063,1064,
 &end
#
#  156 MET  ME          156 MET  HN          4.50    (#   3089:10  Unique         2.67, 5.47 A)
 &rst
  ixpk= 3089, nxpk= 10, iat=  -1,2575, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=2586,2587,2588,
 &end
#
#    0 AMB  10-2:3093   162 THR  HN          5.50    (#   3093:10  Single Ambig)
 &rst
  ixpk= 3093, nxpk= 10, iat=  -1,2668, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=2646,2647,2629,2630,2629,2630,
 &end
#
#   83 LEU  HN           86 TRP  HE1         5.50    (#   3094:10  Unique         5.44, 5.58 A)
 &rst
  ixpk= 3094, nxpk= 10, iat=1340,1409, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:3095   159 GLN  HE2-        5.50    (#   3095:10  Single Ambig)
 &rst
  ixpk= 3095, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 258,2639,
 igr2=2634,2635,
 &end
#
#   52 ARG  HD+          52 ARG  HE          5.50    (#   3098:10  Unique         2.30, 2.78 A)
 &rst
  ixpk= 3098, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
#   52 ARG  HD-          52 ARG  HE          5.50    (#   3099:10  Unique         2.30, 2.78 A)
 &rst
  ixpk= 3099, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 796, 797,
 &end
#
#   52 ARG  HB+          52 ARG  HE          5.50    (#   3100:10  Unique         1.88, 2.73 A)
 &rst
  ixpk= 3100, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 790, 791,
 &end
#
#    0 AMB  10-2:3101    52 ARG  HE          4.50    (#   3101:10  Single Ambig)
 &rst
  ixpk= 3101, nxpk= 10, iat=  -1, 799, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 793, 794, 793, 794,
 &end



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  -0.833   1.224  -0.732
    2    H2   MET   1           H2       MET   1  -1.626   1.716  -2.099
    3    H3   MET   1           H3       MET   1  -1.708   0.131  -1.640
    4    HA   MET   1           HA       MET   1   0.664  -0.085  -2.069
    5    HB2  MET   1           HB2      MET   1  -0.785  -0.912  -3.600
    6    HB3  MET   1           HB3      MET   1  -1.528   0.628  -4.014
    7    HG2  MET   1           HG2      MET   1  -0.171   1.021  -5.710
    8    HG3  MET   1           HG3      MET   1   1.299   0.536  -4.828
    9    HE1  MET   1           HE1      MET   1   1.476  -0.227  -7.538
   10    HE2  MET   1           HE2      MET   1   2.523  -1.010  -6.315
   11    HE3  MET   1           HE3      MET   1   1.707  -2.002  -7.563
   12    H    ILE   2           H        ILE   2   2.453   1.055  -1.804
   13    HA   ILE   2           HA       ILE   2   2.749   3.668  -3.114
   14    HB   ILE   2           HB       ILE   2   3.741   2.835  -0.342
   15   HG12  ILE   2          HG12      ILE   2   1.414   3.467  -0.073
   16   HG13  ILE   2          HG13      ILE   2   2.462   4.696   0.600
   17   HG21  ILE   2          HG21      ILE   2   5.351   4.216  -1.243
   18   HG22  ILE   2          HG22      ILE   2   4.214   5.394  -1.904
   19   HG23  ILE   2          HG23      ILE   2   4.510   5.213  -0.143
   20   HD11  ILE   2          HD11      ILE   2   2.110   6.145  -1.394
   21   HD12  ILE   2          HD12      ILE   2   1.031   4.926  -2.077
   22   HD13  ILE   2          HD13      ILE   2   0.600   5.733  -0.563
   23    H    ASP   3           H        ASP   3   4.763   3.721  -4.074
   24    HA   ASP   3           HA       ASP   3   6.243   1.247  -4.682
   25    HB2  ASP   3           HB2      ASP   3   5.816   3.153  -6.349
   26    HB3  ASP   3           HB3      ASP   3   6.796   4.186  -5.312
   27    H    ASP   4           H        ASP   4   8.665   1.401  -3.999
   28    HA   ASP   4           HA       ASP   4   8.726   1.008  -1.287
   29    HB2  ASP   4           HB2      ASP   4  10.332   0.273  -2.934
   30    HB3  ASP   4           HB3      ASP   4  10.884   1.921  -3.220
   31    H    ASP   5           H        ASP   5   9.872   4.055  -2.814
   32    HA   ASP   5           HA       ASP   5  10.840   4.812  -0.205
   33    HB2  ASP   5           HB2      ASP   5  12.096   5.056  -2.282
   34    HB3  ASP   5           HB3      ASP   5  10.912   6.221  -2.887
   35    H    GLY   6           H        GLY   6   7.810   5.178  -1.418
   36    HA2  GLY   6           HA2      GLY   6   6.256   6.428   0.071
   37    HA3  GLY   6           HA3      GLY   6   7.381   7.769   0.078
   38    H    TYR   7           H        TYR   7   6.874   6.048  -2.942
   39    HA   TYR   7           HA       TYR   7   5.549   8.521  -3.971
   40    HB2  TYR   7           HB2      TYR   7   7.386   6.517  -5.257
   41    HB3  TYR   7           HB3      TYR   7   6.289   7.500  -6.233
   42    HD1  TYR   7           HD1      TYR   7   6.461  10.129  -5.903
   43    HD2  TYR   7           HD2      TYR   7   9.430   7.280  -4.618
   44    HE1  TYR   7           HE1      TYR   7   8.137  11.999  -5.605
   45    HE2  TYR   7           HE2      TYR   7  11.026   9.065  -4.286
   46    HH   TYR   7           HH       TYR   7  11.389  10.916  -4.342
   47    H    ARG   8           H        ARG   8   3.585   8.389  -4.891
   48    HA   ARG   8           HA       ARG   8   2.202   5.796  -4.735
   49    HB2  ARG   8           HB2      ARG   8   1.108   7.786  -3.972
   50    HB3  ARG   8           HB3      ARG   8   1.503   8.623  -5.469
   51    HG2  ARG   8           HG2      ARG   8  -0.692   8.166  -5.847
   52    HG3  ARG   8           HG3      ARG   8   0.030   6.727  -6.580
   53    HD2  ARG   8           HD2      ARG   8  -0.290   5.450  -4.530
   54    HD3  ARG   8           HD3      ARG   8  -0.974   6.865  -3.688
   55    HE   ARG   8           HE       ARG   8  -2.003   5.392  -6.026
   56   HH11  ARG   8          HH11      ARG   8  -2.932   8.160  -3.893
   57   HH12  ARG   8          HH12      ARG   8  -4.598   7.688  -3.911
   58   HH21  ARG   8          HH21      ARG   8  -3.934   4.805  -5.963
   59   HH22  ARG   8          HH22      ARG   8  -5.256   5.671  -5.274
   60    HA   PRO   9           HA       PRO   9   3.308   5.367  -9.151
   61    HB2  PRO   9           HB2      PRO   9   2.089   2.863  -9.519
   62    HB3  PRO   9           HB3      PRO   9   3.781   3.162  -9.054
   63    HG2  PRO   9           HG2      PRO   9   1.521   2.182  -7.423
   64    HG3  PRO   9           HG3      PRO   9   3.279   2.095  -7.094
   65    HD2  PRO   9           HD2      PRO   9   1.362   3.901  -5.952
   66    HD3  PRO   9           HD3      PRO   9   3.133   3.895  -5.722
   67    H    ASN  10           H        ASN  10   2.187   6.205 -10.846
   68    HA   ASN  10           HA       ASN  10  -0.754   5.913 -11.044
   69    HB2  ASN  10           HB2      ASN  10   0.782   8.525 -11.480
   70    HB3  ASN  10           HB3      ASN  10  -0.930   8.300 -11.739
   71   HD21  ASN  10          HD22      ASN  10   1.422   8.127  -8.996
   72   HD22  ASN  10          HD21      ASN  10   0.377   9.117  -7.978
   73    H    VAL  11           H        VAL  11  -1.512   6.714 -13.126
   74    HA   VAL  11           HA       VAL  11   0.502   6.978 -15.291
   75    HB   VAL  11           HB       VAL  11  -1.352   5.906 -16.717
   76   HG11  VAL  11          HG11      VAL  11   0.745   4.733 -16.170
   77   HG12  VAL  11          HG12      VAL  11   0.043   4.181 -14.633
   78   HG13  VAL  11          HG13      VAL  11  -0.634   3.614 -16.167
   79   HG21  VAL  11          HG21      VAL  11  -2.321   4.898 -13.967
   80   HG22  VAL  11          HG22      VAL  11  -3.199   5.991 -15.052
   81   HG23  VAL  11          HG23      VAL  11  -2.860   4.325 -15.508
   82    H    GLY  12           H        GLY  12   0.224   8.890 -16.403
   83    HA2  GLY  12           HA2      GLY  12  -2.285  10.463 -15.912
   84    HA3  GLY  12           HA3      GLY  12  -0.723  11.137 -16.380
   85    H    ILE  13           H        ILE  13  -3.680  10.670 -17.656
   86    HA   ILE  13           HA       ILE  13  -2.832   9.528 -20.264
   87    HB   ILE  13           HB       ILE  13  -5.509  10.699 -19.391
   88   HG12  ILE  13          HG12      ILE  13  -6.079   8.881 -18.302
   89   HG13  ILE  13          HG13      ILE  13  -6.225   8.128 -19.867
   90   HG21  ILE  13          HG21      ILE  13  -5.185  10.793 -21.792
   91   HG22  ILE  13          HG22      ILE  13  -4.744   9.082 -21.849
   92   HG23  ILE  13          HG23      ILE  13  -6.398   9.584 -21.424
   93   HD11  ILE  13          HD11      ILE  13  -4.045   7.138 -19.672
   94   HD12  ILE  13          HD12      ILE  13  -3.913   7.743 -17.979
   95   HD13  ILE  13          HD13      ILE  13  -5.226   6.665 -18.442
   96    H    VAL  14           H        VAL  14  -1.838  10.986 -21.682
   97    HA   VAL  14           HA       VAL  14  -2.706  13.844 -21.621
   98    HB   VAL  14           HB       VAL  14  -0.470  12.524 -23.221
   99   HG11  VAL  14          HG11      VAL  14  -1.366  14.587 -24.255
  100   HG12  VAL  14          HG12      VAL  14  -1.149  15.462 -22.725
  101   HG13  VAL  14          HG13      VAL  14   0.264  14.848 -23.623
  102   HG21  VAL  14          HG21      VAL  14  -0.238  14.190 -20.700
  103   HG22  VAL  14          HG22      VAL  14   0.149  12.452 -20.909
  104   HG23  VAL  14          HG23      VAL  14   1.101  13.662 -21.749
  105    H    ILE  15           H        ILE  15  -4.912  13.250 -22.385
  106    HA   ILE  15           HA       ILE  15  -5.197  12.043 -25.019
  107    HB   ILE  15           HB       ILE  15  -7.024  14.058 -23.644
  108   HG12  ILE  15          HG12      ILE  15  -6.931  11.936 -22.409
  109   HG13  ILE  15          HG13      ILE  15  -8.500  12.242 -23.106
  110   HG21  ILE  15          HG21      ILE  15  -7.373  14.187 -26.033
  111   HG22  ILE  15          HG22      ILE  15  -7.505  12.428 -26.160
  112   HG23  ILE  15          HG23      ILE  15  -8.732  13.373 -25.271
  113   HD11  ILE  15          HD11      ILE  15  -8.057  10.629 -24.941
  114   HD12  ILE  15          HD12      ILE  15  -6.435  10.334 -24.286
  115   HD13  ILE  15          HD13      ILE  15  -7.867   9.869 -23.359
  116    H    CYS  16           H        CYS  16  -4.701  12.897 -26.905
  117    HA   CYS  16           HA       CYS  16  -4.414  15.837 -27.148
  118    HB2  CYS  16           HB2      CYS  16  -2.872  13.596 -28.487
  119    HB3  CYS  16           HB3      CYS  16  -3.013  15.234 -29.200
  120    HG   CYS  16           HG       CYS  16  -0.779  14.964 -27.768
  121    H    ASN  17           H        ASN  17  -5.834  16.659 -28.265
  122    HA   ASN  17           HA       ASN  17  -7.823  15.019 -29.706
  123    HB2  ASN  17           HB2      ASN  17  -8.397  16.910 -28.051
  124    HB3  ASN  17           HB3      ASN  17  -7.657  18.030 -29.215
  125   HD21  ASN  17          HD22      ASN  17 -10.356  16.063 -28.493
  126   HD22  ASN  17          HD21      ASN  17 -11.235  16.235 -30.009
  127    H    ARG  18           H        ARG  18  -7.075  14.626 -31.779
  128    HA   ARG  18           HA       ARG  18  -4.951  15.350 -33.157
  129    HB2  ARG  18           HB2      ARG  18  -7.471  15.302 -34.786
  130    HB3  ARG  18           HB3      ARG  18  -5.886  14.568 -35.117
  131    HG2  ARG  18           HG2      ARG  18  -6.356  12.956 -33.217
  132    HG3  ARG  18           HG3      ARG  18  -7.976  13.740 -33.106
  133    HD2  ARG  18           HD2      ARG  18  -7.999  13.414 -35.734
  134    HD3  ARG  18           HD3      ARG  18  -6.789  12.138 -35.359
  135    HE   ARG  18           HE       ARG  18  -8.888  12.110 -33.459
  136   HH11  ARG  18          HH11      ARG  18  -8.293  11.292 -36.813
  137   HH12  ARG  18          HH12      ARG  18  -9.491  10.047 -36.881
  138   HH21  ARG  18          HH21      ARG  18 -10.324  10.625 -33.391
  139   HH22  ARG  18          HH22      ARG  18 -10.860   9.685 -34.722
  140    H    GLN  19           H        GLN  19  -7.084  17.900 -32.526
  141    HA   GLN  19           HA       GLN  19  -6.485  19.417 -34.990
  142    HB2  GLN  19           HB2      GLN  19  -7.619  20.265 -32.287
  143    HB3  GLN  19           HB3      GLN  19  -7.533  21.278 -33.738
  144    HG2  GLN  19           HG2      GLN  19  -9.182  20.048 -34.891
  145    HG3  GLN  19           HG3      GLN  19  -9.053  18.653 -33.826
  146   HE21  GLN  19          HE22      GLN  19 -10.134  18.539 -31.957
  147   HE22  GLN  19          HE21      GLN  19 -11.376  19.716 -31.511
  148    H    GLY  20           H        GLY  20  -4.716  18.398 -32.250
  149    HA2  GLY  20           HA2      GLY  20  -2.392  18.983 -32.090
  150    HA3  GLY  20           HA3      GLY  20  -2.757  20.612 -32.688
  151    H    GLN  21           H        GLN  21  -4.739  19.088 -30.188
  152    HA   GLN  21           HA       GLN  21  -3.769  21.174 -28.266
  153    HB2  GLN  21           HB2      GLN  21  -6.551  20.465 -29.317
  154    HB3  GLN  21           HB3      GLN  21  -6.250  21.310 -27.853
  155    HG2  GLN  21           HG2      GLN  21  -7.031  22.664 -29.578
  156    HG3  GLN  21           HG3      GLN  21  -5.632  23.272 -28.707
  157   HE21  GLN  21          HE22      GLN  21  -3.804  22.164 -31.502
  158   HE22  GLN  21          HE21      GLN  21  -4.362  23.537 -32.403
  159    H    VAL  22           H        VAL  22  -4.628  20.655 -26.042
  160    HA   VAL  22           HA       VAL  22  -4.334  17.706 -25.670
  161    HB   VAL  22           HB       VAL  22  -3.057  18.325 -23.584
  162   HG11  VAL  22          HG11      VAL  22  -1.926  17.605 -25.610
  163   HG12  VAL  22          HG12      VAL  22  -2.000  19.262 -26.232
  164   HG13  VAL  22          HG13      VAL  22  -0.992  18.882 -24.811
  165   HG21  VAL  22          HG21      VAL  22  -2.969  21.112 -24.867
  166   HG22  VAL  22          HG22      VAL  22  -3.772  20.705 -23.340
  167   HG23  VAL  22          HG23      VAL  22  -2.011  20.556 -23.493
  168    H    MET  23           H        MET  23  -4.915  16.871 -23.691
  169    HA   MET  23           HA       MET  23  -7.505  17.179 -22.848
  170    HB2  MET  23           HB2      MET  23  -5.820  15.290 -22.442
  171    HB3  MET  23           HB3      MET  23  -5.086  16.261 -21.191
  172    HG2  MET  23           HG2      MET  23  -6.650  14.520 -20.343
  173    HG3  MET  23           HG3      MET  23  -7.091  16.160 -19.836
  174    HE1  MET  23           HE1      MET  23  -9.270  13.667 -19.692
  175    HE2  MET  23           HE2      MET  23  -9.600  15.343 -19.172
  176    HE3  MET  23           HE3      MET  23 -10.670  14.554 -20.343
  177    H    TRP  24           H        TRP  24  -8.532  18.657 -21.594
  178    HA   TRP  24           HA       TRP  24  -7.363  19.430 -19.129
  179    HB2  TRP  24           HB2      TRP  24  -6.636  21.240 -20.922
  180    HB3  TRP  24           HB3      TRP  24  -8.291  21.794 -20.780
  181    HD1  TRP  24           HD1      TRP  24  -8.179  23.893 -19.395
  182    HE1  TRP  24           HE1      TRP  24  -7.076  24.690 -17.230
  183    HE3  TRP  24           HE3      TRP  24  -5.343  19.752 -18.351
  184    HZ2  TRP  24           HZ2      TRP  24  -5.156  23.657 -15.280
  185    HZ3  TRP  24           HZ3      TRP  24  -3.949  19.680 -16.328
  186    HH2  TRP  24           HH2      TRP  24  -3.835  21.621 -14.777
  187    H    ALA  25           H        ALA  25  -9.057  19.581 -17.635
  188    HA   ALA  25           HA       ALA  25 -11.758  19.840 -18.558
  189    HB1  ALA  25           HB1      ALA  25 -11.352  17.465 -18.986
  190    HB2  ALA  25           HB2      ALA  25 -10.799  17.279 -17.308
  191    HB3  ALA  25           HB3      ALA  25 -12.501  17.690 -17.656
  192    H    ARG  26           H        ARG  26 -13.200  20.393 -17.022
  193    HA   ARG  26           HA       ARG  26 -12.067  21.761 -14.749
  194    HB2  ARG  26           HB2      ARG  26 -13.982  22.620 -16.195
  195    HB3  ARG  26           HB3      ARG  26 -14.986  21.325 -15.522
  196    HG2  ARG  26           HG2      ARG  26 -14.715  22.226 -13.256
  197    HG3  ARG  26           HG3      ARG  26 -13.500  23.397 -13.813
  198    HD2  ARG  26           HD2      ARG  26 -15.797  24.354 -13.408
  199    HD3  ARG  26           HD3      ARG  26 -15.145  24.648 -15.038
  200    HE   ARG  26           HE       ARG  26 -16.599  22.204 -15.052
  201   HH11  ARG  26          HH11      ARG  26 -17.305  25.648 -14.741
  202   HH12  ARG  26          HH12      ARG  26 -18.867  25.536 -15.497
  203   HH21  ARG  26          HH21      ARG  26 -18.542  21.956 -15.802
  204   HH22  ARG  26          HH22      ARG  26 -19.589  23.241 -16.252
  205    H    ARG  27           H        ARG  27 -12.217  21.088 -12.650
  206    HA   ARG  27           HA       ARG  27 -12.549  18.242 -12.352
  207    HB2  ARG  27           HB2      ARG  27 -10.650  19.785 -11.531
  208    HB3  ARG  27           HB3      ARG  27 -11.717  20.213 -10.222
  209    HG2  ARG  27           HG2      ARG  27 -10.629  17.455 -10.880
  210    HG3  ARG  27           HG3      ARG  27 -10.121  18.580  -9.600
  211    HD2  ARG  27           HD2      ARG  27 -12.237  18.339  -8.453
  212    HD3  ARG  27           HD3      ARG  27 -12.787  17.165  -9.654
  213    HE   ARG  27           HE       ARG  27 -10.289  16.233  -8.766
  214   HH11  ARG  27          HH11      ARG  27 -13.543  16.819  -7.442
  215   HH12  ARG  27          HH12      ARG  27 -13.368  15.604  -6.198
  216   HH21  ARG  27          HH21      ARG  27 -10.088  14.717  -7.271
  217   HH22  ARG  27          HH22      ARG  27 -11.328  14.295  -6.110
  218    H    PHE  28           H        PHE  28 -14.233  17.347 -11.542
  219    HA   PHE  28           HA       PHE  28 -16.741  18.441 -10.904
  220    HB2  PHE  28           HB2      PHE  28 -16.552  16.243 -11.674
  221    HB3  PHE  28           HB3      PHE  28 -15.187  15.877 -10.637
  222    HD1  PHE  28           HD2      PHE  28 -18.866  16.115 -10.714
  223    HD2  PHE  28           HD1      PHE  28 -15.338  15.015  -8.499
  224    HE1  PHE  28           HE2      PHE  28 -20.228  14.624  -9.259
  225    HE2  PHE  28           HE1      PHE  28 -16.691  13.528  -7.059
  226    HZ   PHE  28           HZ       PHE  28 -19.150  13.334  -7.429
  227    H    GLY  29           H        GLY  29 -17.600  19.227  -9.069
  228    HA2  GLY  29           HA2      GLY  29 -17.995  19.732  -6.897
  229    HA3  GLY  29           HA3      GLY  29 -16.734  18.581  -6.405
  230    H    GLN  30           H        GLN  30 -14.903  20.271  -8.346
  231    HA   GLN  30           HA       GLN  30 -14.031  22.111  -6.188
  232    HB2  GLN  30           HB2      GLN  30 -12.579  20.267  -7.242
  233    HB3  GLN  30           HB3      GLN  30 -12.675  21.225  -8.737
  234    HG2  GLN  30           HG2      GLN  30 -11.708  23.149  -7.584
  235    HG3  GLN  30           HG3      GLN  30 -11.619  22.263  -6.085
  236   HE21  GLN  30          HE22      GLN  30 -10.185  22.691  -9.297
  237   HE22  GLN  30          HE21      GLN  30  -8.876  21.528  -9.086
  238    H    HIS  31           H        HIS  31 -14.874  21.982  -9.650
  239    HA   HIS  31           HA       HIS  31 -15.446  23.551 -11.116
  240    HB2  HIS  31           HB2      HIS  31 -15.809  25.438  -8.752
  241    HB3  HIS  31           HB3      HIS  31 -16.559  25.546 -10.340
  242    HD1  HIS  31           HD1      HIS  31 -18.671  24.071 -10.752
  243    HD2  HIS  31           HD2      HIS  31 -16.629  23.163  -7.203
  244    HE1  HIS  31           HE1      HIS  31 -20.058  22.304  -9.542
  245    H    SER  32           H        SER  32 -12.664  23.204 -10.314
  246    HA   SER  32           HA       SER  32 -11.702  25.405 -11.973
  247    HB2  SER  32           HB2      SER  32  -9.479  25.126 -10.471
  248    HB3  SER  32           HB3      SER  32 -10.711  26.377 -10.176
  249    HG   SER  32           HG       SER  32 -10.198  25.324  -8.270
  250    H    TRP  33           H        TRP  33  -9.299  24.622 -12.644
  251    HA   TRP  33           HA       TRP  33  -9.983  22.096 -13.985
  252    HB2  TRP  33           HB2      TRP  33  -7.645  23.996 -14.331
  253    HB3  TRP  33           HB3      TRP  33  -8.088  22.671 -15.412
  254    HD1  TRP  33           HD1      TRP  33  -8.869  26.205 -14.474
  255    HE1  TRP  33           HE1      TRP  33 -10.621  27.266 -16.000
  256    HE3  TRP  33           HE3      TRP  33 -10.155  22.099 -17.235
  257    HZ2  TRP  33           HZ2      TRP  33 -12.420  26.429 -18.096
  258    HZ3  TRP  33           HZ3      TRP  33 -11.917  22.254 -18.989
  259    HH2  TRP  33           HH2      TRP  33 -13.049  24.414 -19.429
  260    H    GLN  34           H        GLN  34  -8.365  20.426 -14.265
  261    HA   GLN  34           HA       GLN  34  -6.273  20.334 -12.221
  262    HB2  GLN  34           HB2      GLN  34  -8.448  19.433 -11.226
  263    HB3  GLN  34           HB3      GLN  34  -8.361  18.128 -12.416
  264    HG2  GLN  34           HG2      GLN  34  -6.052  17.607 -11.573
  265    HG3  GLN  34           HG3      GLN  34  -6.247  18.856 -10.359
  266   HE21  GLN  34          HE22      GLN  34  -6.752  15.559 -11.227
  267   HE22  GLN  34          HE21      GLN  34  -7.668  15.087  -9.809
  268    H    PHE  35           H        PHE  35  -4.746  18.735 -12.652
  269    HA   PHE  35           HA       PHE  35  -4.422  17.942 -15.408
  270    HB2  PHE  35           HB2      PHE  35  -2.340  16.798 -14.469
  271    HB3  PHE  35           HB3      PHE  35  -2.462  18.546 -14.290
  272    HD1  PHE  35           HD1      PHE  35  -3.842  15.689 -12.152
  273    HD2  PHE  35           HD2      PHE  35  -1.282  19.071 -12.387
  274    HE1  PHE  35           HE1      PHE  35  -4.124  16.005  -9.754
  275    HE2  PHE  35           HE2      PHE  35  -1.546  19.426  -9.908
  276    HZ   PHE  35           HZ       PHE  35  -2.931  17.827  -8.582
  277    HA   PRO  36           HA       PRO  36  -5.999  13.722 -14.773
  278    HB2  PRO  36           HB2      PRO  36  -3.986  12.764 -16.710
  279    HB3  PRO  36           HB3      PRO  36  -5.761  12.833 -16.896
  280    HG2  PRO  36           HG2      PRO  36  -3.966  14.478 -18.265
  281    HG3  PRO  36           HG3      PRO  36  -5.685  14.877 -17.916
  282    HD2  PRO  36           HD2      PRO  36  -3.208  15.867 -16.551
  283    HD3  PRO  36           HD3      PRO  36  -4.783  16.660 -16.895
  284    H    GLN  37           H        GLN  37  -5.295  11.805 -13.862
  285    HA   GLN  37           HA       GLN  37  -2.837  10.568 -13.828
  286    HB2  GLN  37           HB2      GLN  37  -2.390  10.918 -11.241
  287    HB3  GLN  37           HB3      GLN  37  -1.595  11.990 -12.407
  288    HG2  GLN  37           HG2      GLN  37  -3.357  13.685 -12.012
  289    HG3  GLN  37           HG3      GLN  37  -4.263  12.542 -11.079
  290   HE21  GLN  37          HE22      GLN  37  -4.420  13.561  -9.501
  291   HE22  GLN  37          HE21      GLN  37  -3.213  14.075  -8.322
  292    H    GLY  38           H        GLY  38  -3.246   8.554 -12.934
  293    HA2  GLY  38           HA2      GLY  38  -5.570   8.243 -11.101
  294    HA3  GLY  38           HA3      GLY  38  -5.505   7.329 -12.621
  295    H    GLY  39           H        GLY  39  -5.202   6.461  -9.694
  296    HA2  GLY  39           HA2      GLY  39  -2.384   5.827  -9.316
  297    HA3  GLY  39           HA3      GLY  39  -3.742   5.194  -8.366
  298    H    ILE  40           H        ILE  40  -1.475   3.675  -9.314
  299    HA   ILE  40           HA       ILE  40  -2.619   1.889 -11.376
  300    HB   ILE  40           HB       ILE  40   0.016   2.006  -9.863
  301   HG12  ILE  40          HG12      ILE  40  -0.807   2.341 -12.791
  302   HG13  ILE  40          HG13      ILE  40  -0.331   3.631 -11.703
  303   HG21  ILE  40          HG21      ILE  40  -0.536  -0.384 -10.139
  304   HG22  ILE  40          HG22      ILE  40  -0.849  -0.126 -11.862
  305   HG23  ILE  40          HG23      ILE  40   0.785   0.056 -11.199
  306   HD11  ILE  40          HD11      ILE  40   1.973   2.716 -11.625
  307   HD12  ILE  40          HD12      ILE  40   1.490   1.440 -12.770
  308   HD13  ILE  40          HD13      ILE  40   1.439   3.139 -13.246
  309    H    ASN  41           H        ASN  41  -3.473  -0.018 -10.900
  310    HA   ASN  41           HA       ASN  41  -4.400  -0.557  -8.194
  311    HB2  ASN  41           HB2      ASN  41  -5.686  -0.552 -10.348
  312    HB3  ASN  41           HB3      ASN  41  -4.649  -1.877 -10.887
  313   HD21  ASN  41          HD22      ASN  41  -6.625  -2.733 -11.357
  314   HD22  ASN  41          HD21      ASN  41  -7.545  -3.653 -10.121
  315    HA   PRO  42           HA       PRO  42  -0.941  -3.126  -7.339
  316    HB2  PRO  42           HB2      PRO  42  -2.620  -5.086  -5.837
  317    HB3  PRO  42           HB3      PRO  42  -1.198  -4.147  -5.297
  318    HG2  PRO  42           HG2      PRO  42  -3.826  -3.522  -4.634
  319    HG3  PRO  42           HG3      PRO  42  -2.505  -2.315  -4.714
  320    HD2  PRO  42           HD2      PRO  42  -4.726  -2.816  -6.577
  321    HD3  PRO  42           HD3      PRO  42  -3.789  -1.314  -6.313
  322    H    GLY  43           H        GLY  43   0.042  -4.209  -8.815
  323    HA2  GLY  43           HA2      GLY  43   0.764  -6.134  -9.883
  324    HA3  GLY  43           HA3      GLY  43  -0.747  -6.959  -9.459
  325    H    GLU  44           H        GLU  44  -1.657  -3.970 -10.751
  326    HA   GLU  44           HA       GLU  44  -2.139  -5.140 -13.409
  327    HB2  GLU  44           HB2      GLU  44  -3.918  -3.970 -12.095
  328    HB3  GLU  44           HB3      GLU  44  -2.973  -2.465 -12.212
  329    HG2  GLU  44           HG2      GLU  44  -3.251  -2.355 -14.568
  330    HG3  GLU  44           HG3      GLU  44  -3.826  -4.019 -14.656
  331    H    SER  45           H        SER  45  -0.738  -4.723 -15.054
  332    HA   SER  45           HA       SER  45   1.564  -3.091 -14.582
  333    HB2  SER  45           HB2      SER  45   1.425  -3.729 -17.348
  334    HB3  SER  45           HB3      SER  45   2.395  -4.488 -16.083
  335    HG   SER  45           HG       SER  45   1.149  -6.052 -17.092
  336    H    ALA  46           H        ALA  46   2.327  -1.486 -16.213
  337    HA   ALA  46           HA       ALA  46   0.929   0.826 -15.748
  338    HB1  ALA  46           HB1      ALA  46   3.322   0.715 -16.342
  339    HB2  ALA  46           HB2      ALA  46   2.902   0.248 -18.011
  340    HB3  ALA  46           HB3      ALA  46   2.469   1.860 -17.402
  341    H    GLU  47           H        GLU  47   0.865  -1.072 -18.856
  342    HA   GLU  47           HA       GLU  47  -0.749   0.945 -20.120
  343    HB2  GLU  47           HB2      GLU  47  -0.205  -1.958 -20.814
  344    HB3  GLU  47           HB3      GLU  47  -1.116  -0.843 -21.848
  345    HG2  GLU  47           HG2      GLU  47   0.710   0.450 -22.389
  346    HG3  GLU  47           HG3      GLU  47   1.523   0.201 -20.855
  347    H    GLN  48           H        GLN  48  -1.492  -2.011 -18.289
  348    HA   GLN  48           HA       GLN  48  -4.282  -2.083 -18.955
  349    HB2  GLN  48           HB2      GLN  48  -2.604  -3.299 -16.714
  350    HB3  GLN  48           HB3      GLN  48  -4.338  -3.551 -16.894
  351    HG2  GLN  48           HG2      GLN  48  -3.148  -5.434 -17.812
  352    HG3  GLN  48           HG3      GLN  48  -4.094  -4.578 -19.016
  353   HE21  GLN  48          HE22      GLN  48  -0.542  -3.919 -18.071
  354   HE22  GLN  48          HE21      GLN  48  -0.085  -4.140 -19.766
  355    H    ALA  49           H        ALA  49  -2.407  -0.714 -16.225
  356    HA   ALA  49           HA       ALA  49  -4.619   0.403 -14.816
  357    HB1  ALA  49           HB1      ALA  49  -2.422   0.038 -13.783
  358    HB2  ALA  49           HB2      ALA  49  -1.684   1.228 -14.890
  359    HB3  ALA  49           HB3      ALA  49  -2.892   1.752 -13.694
  360    H    MET  50           H        MET  50  -2.600   1.639 -17.501
  361    HA   MET  50           HA       MET  50  -3.539   4.334 -17.439
  362    HB2  MET  50           HB2      MET  50  -1.529   3.582 -18.589
  363    HB3  MET  50           HB3      MET  50  -2.487   2.667 -19.755
  364    HG2  MET  50           HG2      MET  50  -2.764   5.621 -19.285
  365    HG3  MET  50           HG3      MET  50  -1.610   4.968 -20.417
  366    HE1  MET  50           HE1      MET  50  -1.989   4.163 -22.751
  367    HE2  MET  50           HE2      MET  50  -2.702   2.720 -22.000
  368    HE3  MET  50           HE3      MET  50  -3.546   3.526 -23.340
  369    H    TYR  51           H        TYR  51  -4.859   1.435 -19.166
  370    HA   TYR  51           HA       TYR  51  -7.103   2.936 -20.144
  371    HB2  TYR  51           HB2      TYR  51  -6.901  -0.036 -19.630
  372    HB3  TYR  51           HB3      TYR  51  -8.187   0.772 -20.528
  373    HD1  TYR  51           HD2      TYR  51  -7.598   2.004 -22.718
  374    HD2  TYR  51           HD1      TYR  51  -4.893  -0.613 -20.667
  375    HE1  TYR  51           HE2      TYR  51  -6.265   1.734 -24.813
  376    HE2  TYR  51           HE1      TYR  51  -3.393  -0.644 -22.617
  377    HH   TYR  51           HH       TYR  51  -3.245  -0.197 -24.869
  378    H    ARG  52           H        ARG  52  -6.489   1.423 -16.998
  379    HA   ARG  52           HA       ARG  52  -9.179   1.534 -16.001
  380    HB2  ARG  52           HB2      ARG  52  -6.866   0.499 -15.071
  381    HB3  ARG  52           HB3      ARG  52  -6.729   2.083 -14.309
  382    HG2  ARG  52           HG2      ARG  52  -7.542   0.532 -12.747
  383    HG3  ARG  52           HG3      ARG  52  -8.776   1.757 -13.071
  384    HD2  ARG  52           HD2      ARG  52  -9.962  -0.226 -12.969
  385    HD3  ARG  52           HD3      ARG  52  -9.784  -0.013 -14.718
  386    HE   ARG  52           HE       ARG  52  -7.556  -1.543 -13.843
  387   HH11  ARG  52          HH11      ARG  52 -11.049  -1.806 -13.846
  388   HH12  ARG  52          HH12      ARG  52 -11.107  -3.540 -13.874
  389   HH21  ARG  52          HH21      ARG  52  -7.477  -3.681 -13.832
  390   HH22  ARG  52          HH22      ARG  52  -8.895  -4.718 -13.817
  391    H    ALA  53           H        ALA  53  -6.430   3.869 -15.822
  392    HA   ALA  53           HA       ALA  53  -7.946   5.909 -14.529
  393    HB1  ALA  53           HB1      ALA  53  -5.499   5.823 -14.498
  394    HB2  ALA  53           HB2      ALA  53  -5.431   6.070 -16.253
  395    HB3  ALA  53           HB3      ALA  53  -6.045   7.365 -15.195
  396    H    LEU  54           H        LEU  54  -7.335   5.187 -17.989
  397    HA   LEU  54           HA       LEU  54  -8.488   7.428 -19.201
  398    HB2  LEU  54           HB2      LEU  54  -7.266   5.597 -20.307
  399    HB3  LEU  54           HB3      LEU  54  -8.554   4.480 -19.847
  400    HG   LEU  54           HG       LEU  54 -10.123   5.695 -21.330
  401   HD11  LEU  54          HD11      LEU  54  -8.950   7.853 -21.507
  402   HD12  LEU  54          HD12      LEU  54  -7.576   7.054 -22.317
  403   HD13  LEU  54          HD13      LEU  54  -9.179   7.119 -23.101
  404   HD21  LEU  54          HD21      LEU  54  -7.611   4.458 -22.509
  405   HD22  LEU  54          HD22      LEU  54  -9.052   3.603 -21.911
  406   HD23  LEU  54          HD23      LEU  54  -9.183   4.622 -23.346
  407    H    PHE  55           H        PHE  55 -10.064   4.463 -17.961
  408    HA   PHE  55           HA       PHE  55 -12.755   5.304 -18.543
  409    HB2  PHE  55           HB2      PHE  55 -12.619   3.037 -18.439
  410    HB3  PHE  55           HB3      PHE  55 -11.359   3.029 -17.229
  411    HD1  PHE  55           HD1      PHE  55 -15.058   3.402 -17.652
  412    HD2  PHE  55           HD2      PHE  55 -11.781   2.775 -14.927
  413    HE1  PHE  55           HE1      PHE  55 -16.663   2.874 -15.815
  414    HE2  PHE  55           HE2      PHE  55 -13.380   2.277 -13.104
  415    HZ   PHE  55           HZ       PHE  55 -15.828   2.328 -13.544
  416    H    GLU  56           H        GLU  56 -10.759   5.365 -15.489
  417    HA   GLU  56           HA       GLU  56 -12.931   6.302 -13.918
  418    HB2  GLU  56           HB2      GLU  56  -9.917   6.479 -13.536
  419    HB3  GLU  56           HB3      GLU  56 -11.074   7.056 -12.329
  420    HG2  GLU  56           HG2      GLU  56 -12.105   4.787 -12.237
  421    HG3  GLU  56           HG3      GLU  56 -10.857   4.193 -13.330
  422    H    GLU  57           H        GLU  57 -10.511   8.075 -15.820
  423    HA   GLU  57           HA       GLU  57 -11.316  10.616 -14.600
  424    HB2  GLU  57           HB2      GLU  57  -9.251  10.091 -16.787
  425    HB3  GLU  57           HB3      GLU  57  -9.467  11.519 -15.787
  426    HG2  GLU  57           HG2      GLU  57  -9.127   9.644 -13.821
  427    HG3  GLU  57           HG3      GLU  57  -8.143   8.933 -15.096
  428    H    VAL  58           H        VAL  58 -11.307   9.063 -17.832
  429    HA   VAL  58           HA       VAL  58 -12.678  11.468 -18.904
  430    HB   VAL  58           HB       VAL  58 -11.591   9.540 -20.863
  431   HG11  VAL  58          HG11      VAL  58 -12.448  11.799 -21.423
  432   HG12  VAL  58          HG12      VAL  58 -11.228  12.503 -20.350
  433   HG13  VAL  58          HG13      VAL  58 -10.721  11.664 -21.828
  434   HG21  VAL  58          HG21      VAL  58  -9.585  11.108 -19.170
  435   HG22  VAL  58          HG22      VAL  58  -9.689   9.347 -19.282
  436   HG23  VAL  58          HG23      VAL  58  -9.251  10.273 -20.709
  437    H    GLY  59           H        GLY  59 -13.233   8.176 -18.087
  438    HA2  GLY  59           HA2      GLY  59 -14.978   6.792 -18.441
  439    HA3  GLY  59           HA3      GLY  59 -15.929   8.173 -19.055
  440    H    LEU  60           H        LEU  60 -12.813   6.825 -20.260
  441    HA   LEU  60           HA       LEU  60 -14.207   5.934 -22.758
  442    HB2  LEU  60           HB2      LEU  60 -11.452   7.144 -22.310
  443    HB3  LEU  60           HB3      LEU  60 -11.902   6.311 -23.788
  444    HG   LEU  60           HG       LEU  60 -13.067   8.888 -22.688
  445   HD11  LEU  60          HD11      LEU  60 -10.846   9.094 -23.718
  446   HD12  LEU  60          HD12      LEU  60 -11.431   8.248 -25.182
  447   HD13  LEU  60          HD13      LEU  60 -12.063   9.842 -24.756
  448   HD21  LEU  60          HD21      LEU  60 -13.903   7.401 -25.221
  449   HD22  LEU  60          HD22      LEU  60 -14.909   7.682 -23.791
  450   HD23  LEU  60          HD23      LEU  60 -14.397   9.030 -24.782
  451    H    SER  61           H        SER  61 -13.214   3.998 -23.754
  452    HA   SER  61           HA       SER  61 -12.136   2.205 -21.600
  453    HB2  SER  61           HB2      SER  61 -13.938   1.552 -23.955
  454    HB3  SER  61           HB3      SER  61 -13.406   0.435 -22.674
  455    HG   SER  61           HG       SER  61 -15.530   1.342 -22.334
  456    H    ARG  62           H        ARG  62 -11.320   0.070 -22.898
  457    HA   ARG  62           HA       ARG  62  -8.835   0.875 -24.017
  458    HB2  ARG  62           HB2      ARG  62  -9.441  -2.035 -24.316
  459    HB3  ARG  62           HB3      ARG  62  -8.053  -1.184 -23.641
  460    HG2  ARG  62           HG2      ARG  62  -9.536  -0.713 -21.645
  461    HG3  ARG  62           HG3      ARG  62 -10.741  -1.807 -22.370
  462    HD2  ARG  62           HD2      ARG  62  -9.481  -3.694 -22.019
  463    HD3  ARG  62           HD3      ARG  62  -7.919  -2.834 -22.094
  464    HE   ARG  62           HE       ARG  62  -9.103  -1.629 -20.015
  465   HH11  ARG  62          HH11      ARG  62  -8.546  -5.035 -20.675
  466   HH12  ARG  62          HH12      ARG  62  -8.388  -5.501 -19.016
  467   HH21  ARG  62          HH21      ARG  62  -9.015  -2.079 -17.916
  468   HH22  ARG  62          HH22      ARG  62  -8.722  -3.661 -17.311
  469    H    LYS  63           H        LYS  63 -10.546   1.932 -25.776
  470    HA   LYS  63           HA       LYS  63  -9.907   0.626 -28.303
  471    HB2  LYS  63           HB2      LYS  63 -12.210   0.215 -28.935
  472    HB3  LYS  63           HB3      LYS  63 -11.839  -0.692 -27.461
  473    HG2  LYS  63           HG2      LYS  63 -12.999   0.961 -26.069
  474    HG3  LYS  63           HG3      LYS  63 -13.316   1.992 -27.480
  475    HD2  LYS  63           HD2      LYS  63 -14.981   0.788 -28.208
  476    HD3  LYS  63           HD3      LYS  63 -14.120  -0.758 -28.059
  477    HE2  LYS  63           HE2      LYS  63 -14.664  -1.036 -25.800
  478    HE3  LYS  63           HE3      LYS  63 -15.186   0.670 -25.621
  479    HZ1  LYS  63           HZ1      LYS  63 -16.887   0.281 -27.198
  480    HZ2  LYS  63           HZ2      LYS  63 -16.430  -1.277 -27.443
  481    HZ3  LYS  63           HZ3      LYS  63 -17.095  -0.825 -25.983
  482    H    ASP  64           H        ASP  64 -11.058   3.307 -26.356
  483    HA   ASP  64           HA       ASP  64 -12.188   4.726 -28.608
  484    HB2  ASP  64           HB2      ASP  64 -11.817   5.265 -25.644
  485    HB3  ASP  64           HB3      ASP  64 -12.508   6.483 -26.711
  486    H    VAL  65           H        VAL  65  -9.080   4.216 -27.811
  487    HA   VAL  65           HA       VAL  65  -8.109   6.835 -28.674
  488    HB   VAL  65           HB       VAL  65  -6.764   7.083 -26.782
  489   HG11  VAL  65          HG11      VAL  65  -8.730   8.366 -26.727
  490   HG12  VAL  65          HG12      VAL  65  -9.615   7.069 -25.883
  491   HG13  VAL  65          HG13      VAL  65  -8.267   7.896 -25.086
  492   HG21  VAL  65          HG21      VAL  65  -8.410   4.780 -25.485
  493   HG22  VAL  65          HG22      VAL  65  -6.686   4.690 -25.883
  494   HG23  VAL  65          HG23      VAL  65  -7.254   5.773 -24.605
  495    H    ARG  66           H        ARG  66  -5.632   6.732 -28.709
  496    HA   ARG  66           HA       ARG  66  -4.647   4.070 -29.646
  497    HB2  ARG  66           HB2      ARG  66  -5.573   5.099 -31.601
  498    HB3  ARG  66           HB3      ARG  66  -5.052   6.702 -31.108
  499    HG2  ARG  66           HG2      ARG  66  -3.740   6.106 -32.953
  500    HG3  ARG  66           HG3      ARG  66  -2.675   6.053 -31.565
  501    HD2  ARG  66           HD2      ARG  66  -4.015   3.477 -32.300
  502    HD3  ARG  66           HD3      ARG  66  -2.839   4.117 -33.466
  503    HE   ARG  66           HE       ARG  66  -1.488   4.295 -31.086
  504   HH11  ARG  66          HH11      ARG  66  -2.935   1.656 -32.944
  505   HH12  ARG  66          HH12      ARG  66  -1.836   0.461 -32.348
  506   HH21  ARG  66          HH21      ARG  66  -0.076   2.830 -30.325
  507   HH22  ARG  66          HH22      ARG  66  -0.144   1.146 -30.760
  508    H    ILE  67           H        ILE  67  -2.670   3.811 -28.540
  509    HA   ILE  67           HA       ILE  67  -1.422   6.109 -27.275
  510    HB   ILE  67           HB       ILE  67  -0.443   3.246 -27.633
  511   HG12  ILE  67          HG12      ILE  67  -1.623   4.470 -25.105
  512   HG13  ILE  67          HG13      ILE  67  -2.649   3.654 -26.275
  513   HG21  ILE  67          HG21      ILE  67   1.430   4.788 -27.134
  514   HG22  ILE  67          HG22      ILE  67   0.534   5.474 -25.768
  515   HG23  ILE  67          HG23      ILE  67   1.100   3.786 -25.737
  516   HD11  ILE  67          HD11      ILE  67  -1.352   1.580 -26.067
  517   HD12  ILE  67          HD12      ILE  67  -0.318   2.340 -24.832
  518   HD13  ILE  67          HD13      ILE  67  -2.038   2.101 -24.522
  519    H    LEU  68           H        LEU  68   0.096   7.407 -28.180
  520    HA   LEU  68           HA       LEU  68   1.384   6.575 -30.761
  521    HB2  LEU  68           HB2      LEU  68   0.184   9.113 -29.817
  522    HB3  LEU  68           HB3      LEU  68   1.835   9.320 -30.364
  523    HG   LEU  68           HG       LEU  68   0.168   9.753 -32.114
  524   HD11  LEU  68          HD11      LEU  68   2.447   9.162 -32.756
  525   HD12  LEU  68          HD12      LEU  68   2.046   7.435 -32.730
  526   HD13  LEU  68          HD13      LEU  68   1.281   8.508 -33.915
  527   HD21  LEU  68          HD21      LEU  68  -0.385   6.758 -32.020
  528   HD22  LEU  68          HD22      LEU  68  -1.504   8.038 -31.529
  529   HD23  LEU  68          HD23      LEU  68  -0.998   7.898 -33.226
  530    H    ALA  69           H        ALA  69   2.005   7.786 -27.459
  531    HA   ALA  69           HA       ALA  69   4.771   6.902 -27.645
  532    HB1  ALA  69           HB1      ALA  69   4.933   9.162 -28.645
  533    HB2  ALA  69           HB2      ALA  69   4.036   9.840 -27.284
  534    HB3  ALA  69           HB3      ALA  69   5.665   9.168 -27.033
  535    H    SER  70           H        SER  70   5.810   7.270 -25.386
  536    HA   SER  70           HA       SER  70   4.045   8.128 -23.262
  537    HB2  SER  70           HB2      SER  70   4.851   6.087 -21.845
  538    HB3  SER  70           HB3      SER  70   3.438   5.950 -22.901
  539    HG   SER  70           HG       SER  70   4.726   4.171 -23.205
  540    H    THR  71           H        THR  71   5.366   8.433 -21.186
  541    HA   THR  71           HA       THR  71   7.794   9.796 -21.882
  542    HB   THR  71           HB       THR  71   8.091   9.789 -19.295
  543    HG1  THR  71           HG1      THR  71   6.289   9.348 -18.160
  544   HG21  THR  71          HG21      THR  71   7.218  11.730 -20.546
  545   HG22  THR  71          HG22      THR  71   5.602  11.011 -20.559
  546   HG23  THR  71          HG23      THR  71   6.336  11.525 -19.021
  547    H    ARG  72           H        ARG  72   9.882   9.243 -21.666
  548    HA   ARG  72           HA       ARG  72  10.428   6.561 -22.323
  549    HB2  ARG  72           HB2      ARG  72  12.276   8.848 -21.510
  550    HB3  ARG  72           HB3      ARG  72  12.841   7.283 -22.131
  551    HG2  ARG  72           HG2      ARG  72  11.492   7.569 -24.182
  552    HG3  ARG  72           HG3      ARG  72  10.922   9.148 -23.624
  553    HD2  ARG  72           HD2      ARG  72  13.886   8.665 -23.628
  554    HD3  ARG  72           HD3      ARG  72  13.081   8.807 -25.208
  555    HE   ARG  72           HE       ARG  72  12.126  10.950 -23.710
  556   HH11  ARG  72          HH11      ARG  72  15.227   9.712 -24.893
  557   HH12  ARG  72          HH12      ARG  72  15.969  11.257 -25.120
  558   HH21  ARG  72          HH21      ARG  72  13.055  12.965 -23.939
  559   HH22  ARG  72          HH22      ARG  72  14.687  13.205 -24.533
  560    H    ASN  73           H        ASN  73  10.487   8.105 -19.185
  561    HA   ASN  73           HA       ASN  73  10.517   5.493 -17.999
  562    HB2  ASN  73           HB2      ASN  73  12.259   5.790 -16.401
  563    HB3  ASN  73           HB3      ASN  73  12.964   6.062 -17.986
  564   HD21  ASN  73          HD22      ASN  73  13.056   8.475 -18.666
  565   HD22  ASN  73          HD21      ASN  73  13.568   9.566 -17.400
  566    H    TRP  74           H        TRP  74  10.195   5.983 -15.463
  567    HA   TRP  74           HA       TRP  74   7.691   7.416 -15.323
  568    HB2  TRP  74           HB2      TRP  74   9.415   6.235 -13.108
  569    HB3  TRP  74           HB3      TRP  74   7.767   6.827 -12.947
  570    HD1  TRP  74           HD1      TRP  74   9.762   3.926 -14.447
  571    HE1  TRP  74           HE1      TRP  74   8.223   1.982 -15.033
  572    HE3  TRP  74           HE3      TRP  74   5.291   6.031 -13.156
  573    HZ2  TRP  74           HZ2      TRP  74   5.329   1.508 -15.239
  574    HZ3  TRP  74           HZ3      TRP  74   3.177   4.786 -13.577
  575    HH2  TRP  74           HH2      TRP  74   3.176   2.609 -14.659
  576    H    LEU  75           H        LEU  75   7.494   9.506 -15.096
  577    HA   LEU  75           HA       LEU  75   9.632  11.312 -14.179
  578    HB2  LEU  75           HB2      LEU  75   6.695  11.550 -14.976
  579    HB3  LEU  75           HB3      LEU  75   7.499  12.825 -14.133
  580    HG   LEU  75           HG       LEU  75   7.449  12.277 -16.956
  581   HD11  LEU  75          HD11      LEU  75   7.121  14.424 -15.817
  582   HD12  LEU  75          HD12      LEU  75   8.800  14.385 -15.225
  583   HD13  LEU  75          HD13      LEU  75   8.467  14.538 -16.965
  584   HD21  LEU  75          HD21      LEU  75  10.336  12.609 -15.999
  585   HD22  LEU  75          HD22      LEU  75   9.702  11.175 -16.849
  586   HD23  LEU  75          HD23      LEU  75   9.729  12.739 -17.659
  587    H    ARG  76           H        ARG  76   9.408  12.435 -12.127
  588    HA   ARG  76           HA       ARG  76   7.153  11.822 -10.412
  589    HB2  ARG  76           HB2      ARG  76   8.676  11.170  -8.471
  590    HB3  ARG  76           HB3      ARG  76   8.341   9.920  -9.684
  591    HG2  ARG  76           HG2      ARG  76  10.577  10.972 -10.823
  592    HG3  ARG  76           HG3      ARG  76  10.762  11.625  -9.191
  593    HD2  ARG  76           HD2      ARG  76  10.360   9.151  -8.442
  594    HD3  ARG  76           HD3      ARG  76  10.499   8.760 -10.216
  595    HE   ARG  76           HE       ARG  76  12.308  10.651  -9.863
  596   HH11  ARG  76          HH11      ARG  76  11.933   7.698  -8.050
  597   HH12  ARG  76          HH12      ARG  76  13.618   7.386  -7.854
  598   HH21  ARG  76          HH21      ARG  76  14.228  10.523  -9.772
  599   HH22  ARG  76          HH22      ARG  76  15.157   9.276  -9.014
  600    H    TYR  77           H        TYR  77   7.184  13.080  -8.541
  601    HA   TYR  77           HA       TYR  77   9.239  15.078  -8.193
  602    HB2  TYR  77           HB2      TYR  77   7.851  16.960  -8.580
  603    HB3  TYR  77           HB3      TYR  77   7.835  15.962 -10.018
  604    HD1  TYR  77           HD1      TYR  77   5.887  14.244 -10.255
  605    HD2  TYR  77           HD2      TYR  77   5.970  17.860  -8.003
  606    HE1  TYR  77           HE1      TYR  77   3.338  14.230 -10.258
  607    HE2  TYR  77           HE2      TYR  77   3.598  18.005  -8.192
  608    HH   TYR  77           HH       TYR  77   2.399  16.554  -7.595
  609    H    LYS  78           H        LYS  78   8.441  16.491  -6.470
  610    HA   LYS  78           HA       LYS  78   7.574  14.708  -4.309
  611    HB2  LYS  78           HB2      LYS  78   9.895  16.025  -5.037
  612    HB3  LYS  78           HB3      LYS  78   9.151  17.282  -4.055
  613    HG2  LYS  78           HG2      LYS  78   9.620  14.393  -3.178
  614    HG3  LYS  78           HG3      LYS  78  10.820  15.690  -3.111
  615    HD2  LYS  78           HD2      LYS  78   8.912  16.986  -1.719
  616    HD3  LYS  78           HD3      LYS  78   8.297  15.327  -1.491
  617    HE2  LYS  78           HE2      LYS  78   9.893  15.361   0.208
  618    HE3  LYS  78           HE3      LYS  78  10.794  14.682  -1.164
  619    HZ1  LYS  78           HZ1      LYS  78  11.799  16.828  -1.543
  620    HZ2  LYS  78           HZ2      LYS  78  10.929  17.513  -0.322
  621    HZ3  LYS  78           HZ3      LYS  78  12.053  16.350   0.003
  622    H    LEU  79           H        LEU  79   5.836  15.315  -3.079
  623    HA   LEU  79           HA       LEU  79   4.195  17.553  -3.918
  624    HB2  LEU  79           HB2      LEU  79   4.050  15.633  -1.550
  625    HB3  LEU  79           HB3      LEU  79   2.806  16.826  -1.903
  626    HG   LEU  79           HG       LEU  79   3.616  14.618  -3.831
  627   HD11  LEU  79          HD11      LEU  79   2.669  13.625  -1.807
  628   HD12  LEU  79          HD12      LEU  79   1.267  14.710  -1.912
  629   HD13  LEU  79          HD13      LEU  79   1.552  13.465  -3.169
  630   HD21  LEU  79          HD21      LEU  79   1.197  16.438  -3.811
  631   HD22  LEU  79          HD22      LEU  79   2.570  16.528  -4.945
  632   HD23  LEU  79          HD23      LEU  79   1.509  15.115  -4.964
  633    HA   PRO  80           HA       PRO  80   6.019  20.450  -0.978
  634    HB2  PRO  80           HB2      PRO  80   3.878  22.136  -0.558
  635    HB3  PRO  80           HB3      PRO  80   4.926  22.222  -2.007
  636    HG2  PRO  80           HG2      PRO  80   2.228  20.908  -1.695
  637    HG3  PRO  80           HG3      PRO  80   2.838  21.880  -3.068
  638    HD2  PRO  80           HD2      PRO  80   2.797  19.124  -3.066
  639    HD3  PRO  80           HD3      PRO  80   4.052  20.065  -3.935
  640    H    LYS  81           H        LYS  81   5.785  20.833   1.201
  641    HA   LYS  81           HA       LYS  81   5.243  18.703   2.717
  642    HB2  LYS  81           HB2      LYS  81   5.767  21.646   3.005
  643    HB3  LYS  81           HB3      LYS  81   4.775  21.117   4.310
  644    HG2  LYS  81           HG2      LYS  81   7.477  19.862   3.664
  645    HG3  LYS  81           HG3      LYS  81   7.116  21.089   4.920
  646    HD2  LYS  81           HD2      LYS  81   5.173  19.561   5.677
  647    HD3  LYS  81           HD3      LYS  81   5.823  18.324   4.607
  648    HE2  LYS  81           HE2      LYS  81   6.053  18.038   6.963
  649    HE3  LYS  81           HE3      LYS  81   7.549  17.823   6.033
  650    HZ1  LYS  81           HZ1      LYS  81   8.273  19.960   6.833
  651    HZ2  LYS  81           HZ2      LYS  81   6.789  20.298   7.493
  652    HZ3  LYS  81           HZ3      LYS  81   7.726  19.113   8.135
  653    H    ARG  82           H        ARG  82   3.053  21.357   2.243
  654    HA   ARG  82           HA       ARG  82   1.122  20.543   4.239
  655    HB2  ARG  82           HB2      ARG  82  -0.165  22.439   3.385
  656    HB3  ARG  82           HB3      ARG  82   1.513  22.880   3.669
  657    HG2  ARG  82           HG2      ARG  82   1.704  22.273   1.000
  658    HG3  ARG  82           HG3      ARG  82  -0.019  22.639   1.082
  659    HD2  ARG  82           HD2      ARG  82   1.079  24.687   0.545
  660    HD3  ARG  82           HD3      ARG  82   0.619  24.815   2.257
  661    HE   ARG  82           HE       ARG  82   3.255  23.737   2.055
  662   HH11  ARG  82          HH11      ARG  82   1.530  26.814   1.678
  663   HH12  ARG  82          HH12      ARG  82   2.907  27.782   2.034
  664   HH21  ARG  82          HH21      ARG  82   5.105  25.034   2.517
  665   HH22  ARG  82          HH22      ARG  82   4.973  26.750   2.530
  666    H    LEU  83           H        LEU  83   1.747  19.562   0.965
  667    HA   LEU  83           HA       LEU  83  -1.017  18.565   0.688
  668    HB2  LEU  83           HB2      LEU  83   0.097  20.038  -1.074
  669    HB3  LEU  83           HB3      LEU  83   1.207  18.695  -1.375
  670    HG   LEU  83           HG       LEU  83  -0.646  17.284  -2.152
  671   HD11  LEU  83          HD11      LEU  83  -2.524  18.131  -0.742
  672   HD12  LEU  83          HD12      LEU  83  -2.456  19.688  -1.587
  673   HD13  LEU  83          HD13      LEU  83  -2.928  18.211  -2.451
  674   HD21  LEU  83          HD21      LEU  83  -0.653  20.099  -3.327
  675   HD22  LEU  83          HD22      LEU  83   0.495  18.800  -3.708
  676   HD23  LEU  83          HD23      LEU  83  -1.223  18.638  -4.161
  677    H    VAL  84           H        VAL  84   2.241  17.534   1.408
  678    HA   VAL  84           HA       VAL  84   2.116  14.786   0.730
  679    HB   VAL  84           HB       VAL  84   3.345  16.189   3.148
  680   HG11  VAL  84          HG11      VAL  84   2.966  13.825   3.777
  681   HG12  VAL  84          HG12      VAL  84   3.733  13.289   2.274
  682   HG13  VAL  84          HG13      VAL  84   4.673  14.125   3.522
  683   HG21  VAL  84          HG21      VAL  84   4.534  15.037   0.598
  684   HG22  VAL  84          HG22      VAL  84   4.365  16.757   0.970
  685   HG23  VAL  84          HG23      VAL  84   5.467  15.755   1.928
  686    H    ARG  85           H        ARG  85   1.132  13.090   1.662
  687    HA   ARG  85           HA       ARG  85  -1.316  13.806   3.010
  688    HB2  ARG  85           HB2      ARG  85  -0.016  11.059   2.483
  689    HB3  ARG  85           HB3      ARG  85  -1.659  11.263   3.113
  690    HG2  ARG  85           HG2      ARG  85  -0.762  11.244   0.373
  691    HG3  ARG  85           HG3      ARG  85  -2.352  11.068   1.147
  692    HD2  ARG  85           HD2      ARG  85  -2.236  13.682   1.379
  693    HD3  ARG  85           HD3      ARG  85  -0.993  13.576   0.091
  694    HE   ARG  85           HE       ARG  85  -3.117  11.819  -0.400
  695   HH11  ARG  85          HH11      ARG  85  -2.644  15.232   0.090
  696   HH12  ARG  85          HH12      ARG  85  -4.286  15.702  -0.205
  697   HH21  ARG  85          HH21      ARG  85  -5.093  12.157  -0.887
  698   HH22  ARG  85          HH22      ARG  85  -5.825  13.711  -1.022
  699    H    TRP  86           H        TRP  86   1.556  12.506   4.520
  700    HA   TRP  86           HA       TRP  86   1.715  11.355   6.508
  701    HB2  TRP  86           HB2      TRP  86  -0.025  13.440   7.527
  702    HB3  TRP  86           HB3      TRP  86   1.346  12.585   8.277
  703    HD1  TRP  86           HD1      TRP  86   0.555  15.422   5.871
  704    HE1  TRP  86           HE1      TRP  86   2.633  16.733   5.284
  705    HE3  TRP  86           HE3      TRP  86   4.019  12.334   8.006
  706    HZ2  TRP  86           HZ2      TRP  86   5.529  16.396   5.612
  707    HZ3  TRP  86           HZ3      TRP  86   6.437  12.843   7.860
  708    HH2  TRP  86           HH2      TRP  86   7.212  14.887   6.694
  709    H    ASP  87           H        ASP  87  -1.398  10.911   5.223
  710    HA   ASP  87           HA       ASP  87  -2.242   9.223   7.492
  711    HB2  ASP  87           HB2      ASP  87  -3.780  10.892   6.524
  712    HB3  ASP  87           HB3      ASP  87  -3.620  10.139   4.936
  713    H    THR  88           H        THR  88  -0.920   9.009   4.308
  714    HA   THR  88           HA       THR  88  -1.720   6.262   3.753
  715    HB   THR  88           HB       THR  88   0.080   6.635   1.940
  716    HG1  THR  88           HG1      THR  88   0.639   8.753   1.562
  717   HG21  THR  88          HG21      THR  88  -2.338   6.980   1.501
  718   HG22  THR  88          HG22      THR  88  -2.223   8.646   2.079
  719   HG23  THR  88          HG23      THR  88  -1.355   8.157   0.599
  720    H    LYS  89           H        LYS  89  -0.108   4.519   3.924
  721    HA   LYS  89           HA       LYS  89   2.333   5.166   5.468
  722    HB2  LYS  89           HB2      LYS  89   0.251   3.086   6.235
  723    HB3  LYS  89           HB3      LYS  89   1.928   3.149   6.861
  724    HG2  LYS  89           HG2      LYS  89   1.260   5.757   7.151
  725    HG3  LYS  89           HG3      LYS  89  -0.370   5.034   7.234
  726    HD2  LYS  89           HD2      LYS  89   0.572   3.588   9.090
  727    HD3  LYS  89           HD3      LYS  89   2.138   4.487   8.893
  728    HE2  LYS  89           HE2      LYS  89   0.961   6.641   8.991
  729    HE3  LYS  89           HE3      LYS  89  -0.606   5.829   9.074
  730    HZ1  LYS  89           HZ1      LYS  89   0.038   4.910  11.164
  731    HZ2  LYS  89           HZ2      LYS  89   1.515   5.666  11.092
  732    HZ3  LYS  89           HZ3      LYS  89   0.118   6.568  11.200
  733    HA   PRO  90           HA       PRO  90   4.539   4.806   5.015
  734    HB2  PRO  90           HB2      PRO  90   5.569   5.262   2.293
  735    HB3  PRO  90           HB3      PRO  90   6.411   4.646   3.741
  736    HG2  PRO  90           HG2      PRO  90   5.611   3.112   1.497
  737    HG3  PRO  90           HG3      PRO  90   6.073   2.469   3.106
  738    HD2  PRO  90           HD2      PRO  90   3.383   2.684   1.899
  739    HD3  PRO  90           HD3      PRO  90   3.944   1.699   3.281
  740    H    VAL  91           H        VAL  91   4.832   7.076   4.945
  741    HA   VAL  91           HA       VAL  91   2.672   8.613   3.997
  742    HB   VAL  91           HB       VAL  91   4.895  10.382   4.035
  743   HG11  VAL  91          HG11      VAL  91   2.727  10.784   4.730
  744   HG12  VAL  91          HG12      VAL  91   2.816   9.565   6.045
  745   HG13  VAL  91          HG13      VAL  91   3.781  11.062   6.120
  746   HG21  VAL  91          HG21      VAL  91   5.058   8.717   6.583
  747   HG22  VAL  91          HG22      VAL  91   6.358   8.784   5.337
  748   HG23  VAL  91          HG23      VAL  91   5.867  10.243   6.192
  749    H    CYS  92           H        CYS  92   2.251   9.564   2.185
  750    HA   CYS  92           HA       CYS  92   3.925   8.792  -0.107
  751    HB2  CYS  92           HB2      CYS  92   1.545   8.251  -0.106
  752    HB3  CYS  92           HB3      CYS  92   1.146  10.008   0.025
  753    HG   CYS  92           HG       CYS  92   0.773   9.103  -2.443
  754    H    ILE  93           H        ILE  93   5.493  10.183  -0.563
  755    HA   ILE  93           HA       ILE  93   5.196  13.073  -0.005
  756    HB   ILE  93           HB       ILE  93   7.701  13.036  -0.144
  757   HG12  ILE  93          HG12      ILE  93   7.492  10.003  -0.108
  758   HG13  ILE  93          HG13      ILE  93   7.559  10.849  -1.648
  759   HG21  ILE  93          HG21      ILE  93   6.519  12.803   2.037
  760   HG22  ILE  93          HG22      ILE  93   6.493  11.046   1.840
  761   HG23  ILE  93          HG23      ILE  93   8.038  11.879   2.022
  762   HD11  ILE  93          HD11      ILE  93   9.745  11.781  -1.099
  763   HD12  ILE  93          HD12      ILE  93   9.722  10.907   0.464
  764   HD13  ILE  93          HD13      ILE  93   9.704  10.007  -1.067
  765    H    GLY  94           H        GLY  94   4.854  11.000  -2.698
  766    HA2  GLY  94           HA2      GLY  94   4.931  13.282  -4.489
  767    HA3  GLY  94           HA3      GLY  94   6.296  12.233  -4.661
  768    H    GLN  95           H        GLN  95   4.708  12.575  -6.766
  769    HA   GLN  95           HA       GLN  95   3.036  10.111  -7.081
  770    HB2  GLN  95           HB2      GLN  95   3.022  12.913  -8.194
  771    HB3  GLN  95           HB3      GLN  95   2.696  11.648  -9.339
  772    HG2  GLN  95           HG2      GLN  95   0.717  12.885  -8.347
  773    HG3  GLN  95           HG3      GLN  95   0.628  11.163  -8.539
  774   HE21  GLN  95          HE22      GLN  95  -0.669  13.201  -6.236
  775   HE22  GLN  95          HE21      GLN  95  -0.219  12.194  -4.858
  776    H    LYS  96           H        LYS  96   4.160   8.481  -7.932
  777    HA   LYS  96           HA       LYS  96   6.391   8.958  -9.858
  778    HB2  LYS  96           HB2      LYS  96   6.863   7.130  -8.394
  779    HB3  LYS  96           HB3      LYS  96   5.208   6.520  -8.456
  780    HG2  LYS  96           HG2      LYS  96   5.519   5.787 -10.784
  781    HG3  LYS  96           HG3      LYS  96   7.169   6.465 -10.780
  782    HD2  LYS  96           HD2      LYS  96   7.857   4.927  -9.082
  783    HD3  LYS  96           HD3      LYS  96   6.207   4.295  -8.876
  784    HE2  LYS  96           HE2      LYS  96   6.243   3.418 -11.185
  785    HE3  LYS  96           HE3      LYS  96   7.868   4.087 -11.424
  786    HZ1  LYS  96           HZ1      LYS  96   8.625   2.624  -9.606
  787    HZ2  LYS  96           HZ2      LYS  96   7.174   2.017  -9.418
  788    HZ3  LYS  96           HZ3      LYS  96   7.970   1.731 -10.850
  789    H    GLN  97           H        GLN  97   5.745   9.235 -12.026
  790    HA   GLN  97           HA       GLN  97   3.247   7.941 -12.842
  791    HB2  GLN  97           HB2      GLN  97   2.927  10.399 -14.104
  792    HB3  GLN  97           HB3      GLN  97   2.013   9.671 -12.826
  793    HG2  GLN  97           HG2      GLN  97   2.254  11.715 -12.003
  794    HG3  GLN  97           HG3      GLN  97   3.473  10.811 -11.130
  795   HE21  GLN  97          HE22      GLN  97   5.287  11.965 -10.816
  796   HE22  GLN  97          HE21      GLN  97   5.621  13.431 -11.736
  797    H    LYS  98           H        LYS  98   3.216   7.120 -14.762
  798    HA   LYS  98           HA       LYS  98   5.261   7.981 -16.763
  799    HB2  LYS  98           HB2      LYS  98   5.371   5.622 -16.248
  800    HB3  LYS  98           HB3      LYS  98   3.607   5.434 -16.457
  801    HG2  LYS  98           HG2      LYS  98   3.884   6.035 -18.874
  802    HG3  LYS  98           HG3      LYS  98   5.606   6.262 -18.566
  803    HD2  LYS  98           HD2      LYS  98   5.000   3.655 -17.498
  804    HD3  LYS  98           HD3      LYS  98   4.097   3.761 -19.023
  805    HE2  LYS  98           HE2      LYS  98   6.099   4.776 -20.109
  806    HE3  LYS  98           HE3      LYS  98   6.987   4.593 -18.590
  807    HZ1  LYS  98           HZ1      LYS  98   6.842   2.206 -18.873
  808    HZ2  LYS  98           HZ2      LYS  98   6.004   2.384 -20.290
  809    HZ3  LYS  98           HZ3      LYS  98   7.543   2.937 -20.172
  810    H    TRP  99           H        TRP  99   4.372   9.164 -18.447
  811    HA   TRP  99           HA       TRP  99   1.427   9.479 -18.444
  812    HB2  TRP  99           HB2      TRP  99   3.658  11.250 -19.479
  813    HB3  TRP  99           HB3      TRP  99   1.959  11.506 -19.818
  814    HD1  TRP  99           HD1      TRP  99   4.353  11.447 -16.762
  815    HE1  TRP  99           HE1      TRP  99   3.465  13.055 -14.997
  816    HE3  TRP  99           HE3      TRP  99  -0.168  12.616 -18.860
  817    HZ2  TRP  99           HZ2      TRP  99   1.200  14.800 -14.629
  818    HZ3  TRP  99           HZ3      TRP  99  -1.642  14.284 -17.815
  819    HH2  TRP  99           HH2      TRP  99  -0.987  15.367 -15.683
  820    H    PHE 100           H        PHE 100   0.343   9.035 -20.328
  821    HA   PHE 100           HA       PHE 100   1.888   7.808 -22.584
  822    HB2  PHE 100           HB2      PHE 100  -0.832   7.086 -21.429
  823    HB3  PHE 100           HB3      PHE 100  -0.266   6.576 -23.013
  824    HD1  PHE 100           HD2      PHE 100   0.547   6.327 -19.362
  825    HD2  PHE 100           HD1      PHE 100   1.118   4.684 -23.309
  826    HE1  PHE 100           HE2      PHE 100   1.549   4.290 -18.378
  827    HE2  PHE 100           HE1      PHE 100   2.139   2.655 -22.319
  828    HZ   PHE 100           HZ       PHE 100   2.326   2.432 -19.853
  829    H    LEU 101           H        LEU 101   1.633   8.820 -24.433
  830    HA   LEU 101           HA       LEU 101  -0.241  11.079 -24.723
  831    HB2  LEU 101           HB2      LEU 101   1.987  11.357 -25.625
  832    HB3  LEU 101           HB3      LEU 101   1.851   9.849 -26.543
  833    HG   LEU 101           HG       LEU 101  -0.073  10.862 -27.835
  834   HD11  LEU 101          HD11      LEU 101  -0.743  12.688 -26.246
  835   HD12  LEU 101          HD12      LEU 101   0.813  13.495 -26.585
  836   HD13  LEU 101          HD13      LEU 101  -0.371  13.215 -27.883
  837   HD21  LEU 101          HD21      LEU 101   2.566  12.356 -27.934
  838   HD22  LEU 101          HD22      LEU 101   2.151  10.857 -28.782
  839   HD23  LEU 101          HD23      LEU 101   1.321  12.365 -29.200
  840    H    LEU 102           H        LEU 102  -2.253  10.576 -25.212
  841    HA   LEU 102           HA       LEU 102  -2.872   8.157 -26.852
  842    HB2  LEU 102           HB2      LEU 102  -4.272   9.726 -24.660
  843    HB3  LEU 102           HB3      LEU 102  -5.218   8.833 -25.828
  844    HG   LEU 102           HG       LEU 102  -4.761   7.654 -23.630
  845   HD11  LEU 102          HD11      LEU 102  -5.468   6.580 -25.465
  846   HD12  LEU 102          HD12      LEU 102  -3.926   6.282 -26.219
  847   HD13  LEU 102          HD13      LEU 102  -4.427   5.453 -24.695
  848   HD21  LEU 102          HD21      LEU 102  -2.042   7.042 -24.854
  849   HD22  LEU 102          HD22      LEU 102  -2.317   8.010 -23.365
  850   HD23  LEU 102          HD23      LEU 102  -2.761   6.300 -23.419
  851    H    GLN 103           H        GLN 103  -3.473   8.626 -28.885
  852    HA   GLN 103           HA       GLN 103  -4.513  11.320 -29.550
  853    HB2  GLN 103           HB2      GLN 103  -3.942   8.830 -31.221
  854    HB3  GLN 103           HB3      GLN 103  -4.786  10.247 -31.853
  855    HG2  GLN 103           HG2      GLN 103  -1.947  10.158 -30.773
  856    HG3  GLN 103           HG3      GLN 103  -2.426  10.370 -32.454
  857   HE21  GLN 103          HE22      GLN 103  -0.688  12.233 -30.947
  858   HE22  GLN 103          HE21      GLN 103  -1.625  13.702 -30.780
  859    H    LEU 104           H        LEU 104  -6.572  11.728 -29.722
  860    HA   LEU 104           HA       LEU 104  -8.493   9.960 -28.545
  861    HB2  LEU 104           HB2      LEU 104  -8.347  12.554 -28.572
  862    HB3  LEU 104           HB3      LEU 104  -8.977  12.459 -30.216
  863    HG   LEU 104           HG       LEU 104 -10.983  11.366 -29.403
  864   HD11  LEU 104          HD11      LEU 104 -10.279  10.268 -27.288
  865   HD12  LEU 104          HD12      LEU 104 -10.017  11.880 -26.572
  866   HD13  LEU 104          HD13      LEU 104 -11.639  11.347 -27.042
  867   HD21  LEU 104          HD21      LEU 104 -10.233  13.934 -27.951
  868   HD22  LEU 104          HD22      LEU 104 -10.918  13.801 -29.603
  869   HD23  LEU 104          HD23      LEU 104 -11.895  13.426 -28.174
  870    H    VAL 105           H        VAL 105  -9.654   8.312 -29.574
  871    HA   VAL 105           HA       VAL 105  -9.766   8.366 -32.551
  872    HB   VAL 105           HB       VAL 105 -10.116   6.046 -30.623
  873   HG11  VAL 105          HG11      VAL 105 -11.444   5.705 -32.643
  874   HG12  VAL 105          HG12      VAL 105 -10.031   6.083 -33.658
  875   HG13  VAL 105          HG13      VAL 105 -10.048   4.632 -32.621
  876   HG21  VAL 105          HG21      VAL 105  -7.840   6.714 -32.539
  877   HG22  VAL 105          HG22      VAL 105  -7.747   6.801 -30.780
  878   HG23  VAL 105          HG23      VAL 105  -7.993   5.233 -31.559
  879    H    SER 106           H        SER 106 -11.739   7.921 -29.555
  880    HA   SER 106           HA       SER 106 -14.176   8.408 -31.177
  881    HB2  SER 106           HB2      SER 106 -14.360   8.123 -28.204
  882    HB3  SER 106           HB3      SER 106 -15.362   7.497 -29.540
  883    HG   SER 106           HG       SER 106 -14.200   5.891 -28.431
  884    H    GLY 107           H        GLY 107 -15.161  10.042 -28.562
  885    HA2  GLY 107           HA2      GLY 107 -13.347  12.093 -28.296
  886    HA3  GLY 107           HA3      GLY 107 -14.383  12.569 -29.668
  887    H    ASP 108           H        ASP 108 -14.773  14.285 -28.049
  888    HA   ASP 108           HA       ASP 108 -16.038  14.491 -25.749
  889    HB2  ASP 108           HB2      ASP 108 -15.576  16.302 -27.181
  890    HB3  ASP 108           HB3      ASP 108 -16.595  15.664 -28.478
  891    H    ALA 109           H        ALA 109 -17.761  13.191 -28.651
  892    HA   ALA 109           HA       ALA 109 -20.318  13.120 -27.391
  893    HB1  ALA 109           HB1      ALA 109 -20.000  13.176 -29.825
  894    HB2  ALA 109           HB2      ALA 109 -19.169  11.597 -29.781
  895    HB3  ALA 109           HB3      ALA 109 -20.892  11.707 -29.365
  896    H    GLU 110           H        GLU 110 -17.624  10.893 -27.312
  897    HA   GLU 110           HA       GLU 110 -19.240   8.692 -26.123
  898    HB2  GLU 110           HB2      GLU 110 -16.452   8.726 -27.344
  899    HB3  GLU 110           HB3      GLU 110 -17.261   7.296 -26.723
  900    HG2  GLU 110           HG2      GLU 110 -18.290   9.014 -29.047
  901    HG3  GLU 110           HG3      GLU 110 -17.306   7.599 -29.256
  902    H    ILE 111           H        ILE 111 -16.749  11.090 -25.495
  903    HA   ILE 111           HA       ILE 111 -15.659   9.999 -23.062
  904    HB   ILE 111           HB       ILE 111 -15.931  12.753 -24.297
  905   HG12  ILE 111          HG12      ILE 111 -13.610  11.021 -23.361
  906   HG13  ILE 111          HG13      ILE 111 -14.141  11.244 -25.033
  907   HG21  ILE 111          HG21      ILE 111 -16.381  13.214 -21.939
  908   HG22  ILE 111          HG22      ILE 111 -14.921  12.307 -21.462
  909   HG23  ILE 111          HG23      ILE 111 -14.815  13.820 -22.407
  910   HD11  ILE 111          HD11      ILE 111 -13.478  13.614 -24.927
  911   HD12  ILE 111          HD12      ILE 111 -12.864  13.359 -23.270
  912   HD13  ILE 111          HD13      ILE 111 -12.118  12.507 -24.617
  913    H    ASN 112           H        ASN 112 -16.514   9.833 -21.100
  914    HA   ASN 112           HA       ASN 112 -19.280  10.953 -20.745
  915    HB2  ASN 112           HB2      ASN 112 -19.389   8.574 -21.209
  916    HB3  ASN 112           HB3      ASN 112 -18.294   8.219 -19.869
  917   HD21  ASN 112          HD22      ASN 112 -20.049   6.960 -18.666
  918   HD22  ASN 112          HD21      ASN 112 -21.347   7.920 -17.958
  919    H    MET 113           H        MET 113 -16.118  10.728 -19.347
  920    HA   MET 113           HA       MET 113 -15.308  10.902 -17.236
  921    HB2  MET 113           HB2      MET 113 -16.953  13.447 -17.270
  922    HB3  MET 113           HB3      MET 113 -15.414  13.140 -16.454
  923    HG2  MET 113           HG2      MET 113 -14.368  12.741 -18.691
  924    HG3  MET 113           HG3      MET 113 -15.879  13.276 -19.444
  925    HE1  MET 113           HE1      MET 113 -12.825  14.344 -19.727
  926    HE2  MET 113           HE2      MET 113 -14.144  14.978 -20.752
  927    HE3  MET 113           HE3      MET 113 -13.081  16.091 -19.870
  928    H    GLN 114           H        GLN 114 -18.734  10.398 -16.928
  929    HA   GLN 114           HA       GLN 114 -18.508  10.431 -13.968
  930    HB2  GLN 114           HB2      GLN 114 -20.916  10.861 -15.775
  931    HB3  GLN 114           HB3      GLN 114 -20.954  10.802 -14.006
  932    HG2  GLN 114           HG2      GLN 114 -19.278  12.715 -13.979
  933    HG3  GLN 114           HG3      GLN 114 -19.522  12.866 -15.723
  934   HE21  GLN 114          HE22      GLN 114 -20.978  13.380 -12.538
  935   HE22  GLN 114          HE21      GLN 114 -22.368  14.259 -13.161
  936    H    THR 115           H        THR 115 -17.752   8.322 -15.838
  937    HA   THR 115           HA       THR 115 -19.465   6.074 -15.645
  938    HB   THR 115           HB       THR 115 -16.743   5.263 -15.630
  939    HG1  THR 115           HG1      THR 115 -15.856   6.671 -17.181
  940   HG21  THR 115          HG21      THR 115 -18.398   4.472 -17.305
  941   HG22  THR 115          HG22      THR 115 -18.332   6.076 -18.093
  942   HG23  THR 115          HG23      THR 115 -16.893   5.037 -18.053
  943    H    SER 116           H        SER 116 -16.916   7.462 -13.518
  944    HA   SER 116           HA       SER 116 -16.798   5.085 -11.917
  945    HB2  SER 116           HB2      SER 116 -15.516   7.530 -10.855
  946    HB3  SER 116           HB3      SER 116 -14.810   5.957 -11.256
  947    HG   SER 116           HG       SER 116 -14.095   7.754 -12.598
  948    H    SER 117           H        SER 117 -19.217   7.223 -11.856
  949    HA   SER 117           HA       SER 117 -20.682   8.073 -10.420
  950    HB2  SER 117           HB2      SER 117 -19.530   6.186  -8.349
  951    HB3  SER 117           HB3      SER 117 -21.161   6.877  -8.405
  952    HG   SER 117           HG       SER 117 -21.050   4.726  -9.262
  953    H    THR 118           H        THR 118 -17.414   8.011  -8.858
  954    HA   THR 118           HA       THR 118 -17.884  10.851  -8.123
  955    HB   THR 118           HB       THR 118 -16.340  10.392  -6.162
  956    HG1  THR 118           HG1      THR 118 -16.456   8.245  -5.393
  957   HG21  THR 118          HG21      THR 118 -18.767  10.810  -5.915
  958   HG22  THR 118          HG22      THR 118 -19.093   9.081  -6.173
  959   HG23  THR 118          HG23      THR 118 -18.196   9.609  -4.732
  960    HA   PRO 119           HA       PRO 119 -14.308  10.015 -10.916
  961    HB2  PRO 119           HB2      PRO 119 -14.968  11.673 -12.966
  962    HB3  PRO 119           HB3      PRO 119 -15.805  10.113 -12.731
  963    HG2  PRO 119           HG2      PRO 119 -16.704  12.874 -11.770
  964    HG3  PRO 119           HG3      PRO 119 -17.640  11.711 -12.730
  965    HD2  PRO 119           HD2      PRO 119 -17.876  11.831 -10.050
  966    HD3  PRO 119           HD3      PRO 119 -17.963  10.272 -10.934
  967    H    GLU 120           H        GLU 120 -13.089  12.054 -12.137
  968    HA   GLU 120           HA       GLU 120 -12.809  14.221 -10.101
  969    HB2  GLU 120           HB2      GLU 120 -10.882  12.945 -12.068
  970    HB3  GLU 120           HB3      GLU 120 -10.568  14.516 -11.304
  971    HG2  GLU 120           HG2      GLU 120 -11.352  13.050  -9.105
  972    HG3  GLU 120           HG3      GLU 120 -10.644  11.775 -10.080
  973    H    PHE 121           H        PHE 121 -13.854  13.626 -13.412
  974    HA   PHE 121           HA       PHE 121 -13.555  16.561 -13.834
  975    HB2  PHE 121           HB2      PHE 121 -13.325  14.300 -15.812
  976    HB3  PHE 121           HB3      PHE 121 -13.333  16.023 -16.209
  977    HD1  PHE 121           HD2      PHE 121 -11.588  17.384 -14.393
  978    HD2  PHE 121           HD1      PHE 121 -11.155  13.409 -16.001
  979    HE1  PHE 121           HE2      PHE 121  -9.144  17.541 -14.201
  980    HE2  PHE 121           HE1      PHE 121  -8.703  13.549 -15.683
  981    HZ   PHE 121           HZ       PHE 121  -7.696  15.601 -14.778
  982    H    ASP 122           H        ASP 122 -15.042  17.657 -14.926
  983    HA   ASP 122           HA       ASP 122 -17.814  16.515 -14.881
  984    HB2  ASP 122           HB2      ASP 122 -17.661  18.010 -13.096
  985    HB3  ASP 122           HB3      ASP 122 -16.561  19.096 -13.936
  986    H    GLY 123           H        GLY 123 -15.412  18.164 -16.782
  987    HA2  GLY 123           HA2      GLY 123 -16.429  17.735 -19.235
  988    HA3  GLY 123           HA3      GLY 123 -17.336  19.171 -18.698
  989    H    TRP 124           H        TRP 124 -15.409  19.131 -20.595
  990    HA   TRP 124           HA       TRP 124 -12.825  20.265 -19.895
  991    HB2  TRP 124           HB2      TRP 124 -12.518  18.688 -21.911
  992    HB3  TRP 124           HB3      TRP 124 -13.503  17.879 -20.717
  993    HD1  TRP 124           HD1      TRP 124 -14.873  16.751 -22.894
  994    HE1  TRP 124           HE1      TRP 124 -16.902  17.878 -24.080
  995    HE3  TRP 124           HE3      TRP 124 -16.026  21.326 -20.997
  996    HZ2  TRP 124           HZ2      TRP 124 -16.119  21.530 -24.871
  997    HZ3  TRP 124           HZ3      TRP 124 -16.691  22.667 -22.699
  998    HH2  TRP 124           HH2      TRP 124 -18.692  21.493 -24.121
  999    H    ARG 125           H        ARG 125 -11.320  20.730 -21.871
 1000    HA   ARG 125           HA       ARG 125 -12.752  21.604 -24.260
 1001    HB2  ARG 125           HB2      ARG 125 -13.474  23.506 -22.963
 1002    HB3  ARG 125           HB3      ARG 125 -11.944  23.519 -22.054
 1003    HG2  ARG 125           HG2      ARG 125 -10.979  24.102 -24.243
 1004    HG3  ARG 125           HG3      ARG 125 -12.644  24.080 -24.977
 1005    HD2  ARG 125           HD2      ARG 125 -13.446  25.803 -23.636
 1006    HD3  ARG 125           HD3      ARG 125 -12.309  25.493 -22.276
 1007    HE   ARG 125           HE       ARG 125 -10.666  25.709 -24.324
 1008   HH11  ARG 125          HH11      ARG 125 -13.159  27.765 -23.127
 1009   HH12  ARG 125          HH12      ARG 125 -12.473  29.264 -23.666
 1010   HH21  ARG 125          HH21      ARG 125  -9.703  27.239 -25.112
 1011   HH22  ARG 125          HH22      ARG 125 -10.142  28.915 -24.983
 1012    H    TRP 126           H        TRP 126 -11.367  21.321 -25.817
 1013    HA   TRP 126           HA       TRP 126  -8.694  20.531 -25.018
 1014    HB2  TRP 126           HB2      TRP 126  -9.680  20.945 -27.835
 1015    HB3  TRP 126           HB3      TRP 126  -8.377  19.893 -27.246
 1016    HD1  TRP 126           HD1      TRP 126 -11.445  19.404 -28.766
 1017    HE1  TRP 126           HE1      TRP 126 -12.885  17.470 -27.935
 1018    HE3  TRP 126           HE3      TRP 126  -9.166  18.563 -24.241
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.073  15.789 -25.579
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.135  16.941 -22.676
 1021    HH2  TRP 126           HH2      TRP 126 -12.025  15.489 -23.336
 1022    H    VAL 127           H        VAL 127  -6.953  21.804 -25.064
 1023    HA   VAL 127           HA       VAL 127  -7.336  24.687 -25.730
 1024    HB   VAL 127           HB       VAL 127  -6.071  25.242 -23.686
 1025   HG11  VAL 127          HG11      VAL 127  -8.529  25.329 -23.503
 1026   HG12  VAL 127          HG12      VAL 127  -8.534  23.623 -23.020
 1027   HG13  VAL 127          HG13      VAL 127  -7.776  24.810 -21.979
 1028   HG21  VAL 127          HG21      VAL 127  -6.382  22.293 -22.956
 1029   HG22  VAL 127          HG22      VAL 127  -4.858  23.131 -23.301
 1030   HG23  VAL 127          HG23      VAL 127  -5.809  23.560 -21.870
 1031    H    SER 128           H        SER 128  -5.227  25.824 -25.951
 1032    HA   SER 128           HA       SER 128  -3.582  24.642 -27.866
 1033    HB2  SER 128           HB2      SER 128  -2.699  26.712 -25.812
 1034    HB3  SER 128           HB3      SER 128  -2.121  26.515 -27.475
 1035    HG   SER 128           HG       SER 128  -3.636  28.211 -27.392
 1036    H    TYR 129           H        TYR 129  -1.485  23.774 -27.727
 1037    HA   TYR 129           HA       TYR 129  -1.087  21.748 -25.988
 1038    HB2  TYR 129           HB2      TYR 129  -0.108  22.157 -28.259
 1039    HB3  TYR 129           HB3      TYR 129   1.193  23.051 -27.496
 1040    HD1  TYR 129           HD1      TYR 129  -0.570  19.733 -27.576
 1041    HD2  TYR 129           HD2      TYR 129   3.060  21.834 -26.681
 1042    HE1  TYR 129           HE1      TYR 129   0.441  17.608 -26.778
 1043    HE2  TYR 129           HE2      TYR 129   4.137  19.712 -26.071
 1044    HH   TYR 129           HH       TYR 129   2.529  16.592 -25.935
 1045    H    TRP 130           H        TRP 130   1.783  23.788 -25.379
 1046    HA   TRP 130           HA       TRP 130   2.016  23.614 -22.801
 1047    HB2  TRP 130           HB2      TRP 130   2.220  26.291 -24.179
 1048    HB3  TRP 130           HB3      TRP 130   3.285  25.647 -22.925
 1049    HD1  TRP 130           HD1      TRP 130   2.685  25.657 -26.658
 1050    HE1  TRP 130           HE1      TRP 130   4.342  24.168 -27.905
 1051    HE3  TRP 130           HE3      TRP 130   4.827  23.347 -22.648
 1052    HZ2  TRP 130           HZ2      TRP 130   6.449  22.264 -27.229
 1053    HZ3  TRP 130           HZ3      TRP 130   6.673  21.709 -22.966
 1054    HH2  TRP 130           HH2      TRP 130   7.496  21.190 -25.256
 1055    H    TYR 131           H        TYR 131  -1.126  24.836 -23.512
 1056    HA   TYR 131           HA       TYR 131  -1.268  27.009 -21.611
 1057    HB2  TYR 131           HB2      TYR 131  -2.847  26.805 -23.418
 1058    HB3  TYR 131           HB3      TYR 131  -3.465  25.295 -22.815
 1059    HD1  TYR 131           HD2      TYR 131  -3.368  28.922 -22.341
 1060    HD2  TYR 131           HD1      TYR 131  -4.976  25.236 -20.806
 1061    HE1  TYR 131           HE2      TYR 131  -5.075  30.187 -21.094
 1062    HE2  TYR 131           HE1      TYR 131  -6.747  26.478 -19.622
 1063    HH   TYR 131           HH       TYR 131  -7.660  28.719 -19.148
 1064    HA   PRO 132           HA       PRO 132  -3.007  23.781 -18.474
 1065    HB2  PRO 132           HB2      PRO 132  -1.512  21.320 -19.351
 1066    HB3  PRO 132           HB3      PRO 132  -3.073  21.456 -18.524
 1067    HG2  PRO 132           HG2      PRO 132  -3.006  20.951 -21.166
 1068    HG3  PRO 132           HG3      PRO 132  -4.184  22.146 -20.524
 1069    HD2  PRO 132           HD2      PRO 132  -1.487  22.671 -21.758
 1070    HD3  PRO 132           HD3      PRO 132  -3.037  23.453 -22.128
 1071    H    VAL 133           H        VAL 133   0.299  23.542 -19.812
 1072    HA   VAL 133           HA       VAL 133   1.698  22.980 -17.376
 1073    HB   VAL 133           HB       VAL 133   2.410  24.227 -20.039
 1074   HG11  VAL 133          HG11      VAL 133   3.918  25.403 -18.489
 1075   HG12  VAL 133          HG12      VAL 133   4.444  23.808 -17.847
 1076   HG13  VAL 133          HG13      VAL 133   4.700  24.269 -19.562
 1077   HG21  VAL 133          HG21      VAL 133   3.361  21.726 -18.616
 1078   HG22  VAL 133          HG22      VAL 133   2.193  21.858 -19.934
 1079   HG23  VAL 133          HG23      VAL 133   3.856  22.261 -20.251
 1080    H    ARG 134           H        ARG 134   0.397  26.039 -18.824
 1081    HA   ARG 134           HA       ARG 134   1.601  27.519 -16.567
 1082    HB2  ARG 134           HB2      ARG 134  -0.426  28.314 -18.713
 1083    HB3  ARG 134           HB3      ARG 134   0.244  29.432 -17.530
 1084    HG2  ARG 134           HG2      ARG 134   1.519  28.178 -19.951
 1085    HG3  ARG 134           HG3      ARG 134   1.401  29.873 -19.462
 1086    HD2  ARG 134           HD2      ARG 134   3.492  27.845 -18.870
 1087    HD3  ARG 134           HD3      ARG 134   3.581  29.561 -19.232
 1088    HE   ARG 134           HE       ARG 134   2.985  28.335 -16.589
 1089   HH11  ARG 134          HH11      ARG 134   3.687  31.222 -18.445
 1090   HH12  ARG 134          HH12      ARG 134   4.598  32.032 -17.220
 1091   HH21  ARG 134          HH21      ARG 134   3.963  29.306 -14.928
 1092   HH22  ARG 134          HH22      ARG 134   4.781  30.832 -15.064
 1093    H    GLN 135           H        GLN 135  -1.388  25.962 -17.195
 1094    HA   GLN 135           HA       GLN 135  -2.613  27.462 -15.013
 1095    HB2  GLN 135           HB2      GLN 135  -3.567  25.022 -16.612
 1096    HB3  GLN 135           HB3      GLN 135  -4.562  25.880 -15.437
 1097    HG2  GLN 135           HG2      GLN 135  -3.687  26.810 -18.176
 1098    HG3  GLN 135           HG3      GLN 135  -5.293  26.623 -17.514
 1099   HE21  GLN 135          HE22      GLN 135  -5.438  29.097 -18.451
 1100   HE22  GLN 135          HE21      GLN 135  -4.893  30.264 -17.240
 1101    H    VAL 136           H        VAL 136  -0.870  24.583 -15.132
 1102    HA   VAL 136           HA       VAL 136  -2.048  23.782 -12.636
 1103    HB   VAL 136           HB       VAL 136  -1.361  22.300 -14.374
 1104   HG11  VAL 136          HG11      VAL 136   0.714  23.302 -15.247
 1105   HG12  VAL 136          HG12      VAL 136   1.562  22.789 -13.750
 1106   HG13  VAL 136          HG13      VAL 136   0.773  21.615 -14.737
 1107   HG21  VAL 136          HG21      VAL 136  -0.063  21.935 -11.697
 1108   HG22  VAL 136          HG22      VAL 136  -1.469  21.128 -12.454
 1109   HG23  VAL 136          HG23      VAL 136   0.191  20.739 -12.953
 1110    H    VAL 137           H        VAL 137  -0.886  23.521 -10.655
 1111    HA   VAL 137           HA       VAL 137   0.200  25.883  -9.642
 1112    HB   VAL 137           HB       VAL 137   0.831  24.390  -7.668
 1113   HG11  VAL 137          HG11      VAL 137  -1.282  25.614  -7.778
 1114   HG12  VAL 137          HG12      VAL 137  -2.037  24.297  -8.696
 1115   HG13  VAL 137          HG13      VAL 137  -1.521  24.038  -7.016
 1116   HG21  VAL 137          HG21      VAL 137  -0.590  22.214  -9.286
 1117   HG22  VAL 137          HG22      VAL 137   1.127  22.223  -8.798
 1118   HG23  VAL 137          HG23      VAL 137  -0.148  22.131  -7.579
 1119    H    SER 138           H        SER 138   2.248  26.430  -8.873
 1120    HA   SER 138           HA       SER 138   4.099  26.309 -10.861
 1121    HB2  SER 138           HB2      SER 138   4.667  26.944  -7.938
 1122    HB3  SER 138           HB3      SER 138   5.517  27.585  -9.360
 1123    HG   SER 138           HG       SER 138   3.847  28.997  -8.488
 1124    H    PHE 139           H        PHE 139   4.037  24.142  -7.996
 1125    HA   PHE 139           HA       PHE 139   6.735  23.224  -8.472
 1126    HB2  PHE 139           HB2      PHE 139   6.356  21.648  -6.746
 1127    HB3  PHE 139           HB3      PHE 139   5.644  23.163  -6.244
 1128    HD1  PHE 139           HD1      PHE 139   3.150  23.373  -5.992
 1129    HD2  PHE 139           HD2      PHE 139   5.043  19.661  -7.053
 1130    HE1  PHE 139           HE1      PHE 139   1.060  22.157  -5.455
 1131    HE2  PHE 139           HE2      PHE 139   2.960  18.445  -6.370
 1132    HZ   PHE 139           HZ       PHE 139   0.940  19.692  -5.731
 1133    H    LYS 140           H        LYS 140   3.554  22.281  -9.684
 1134    HA   LYS 140           HA       LYS 140   4.614  19.799 -10.875
 1135    HB2  LYS 140           HB2      LYS 140   1.922  21.170 -10.643
 1136    HB3  LYS 140           HB3      LYS 140   2.190  20.167 -12.099
 1137    HG2  LYS 140           HG2      LYS 140   3.106  18.374 -10.619
 1138    HG3  LYS 140           HG3      LYS 140   2.591  19.423  -9.242
 1139    HD2  LYS 140           HD2      LYS 140   0.356  19.240 -10.798
 1140    HD3  LYS 140           HD3      LYS 140   1.069  17.623 -11.041
 1141    HE2  LYS 140           HE2      LYS 140   1.561  17.860  -8.440
 1142    HE3  LYS 140           HE3      LYS 140   0.239  18.981  -8.427
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.163  17.236  -9.239
 1144    HZ2  LYS 140           HZ2      LYS 140   0.037  16.170  -9.462
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.386  16.609  -7.934
 1146    H    ARG 141           H        ARG 141   3.859  23.069 -11.869
 1147    HA   ARG 141           HA       ARG 141   3.679  22.879 -14.552
 1148    HB2  ARG 141           HB2      ARG 141   3.545  24.881 -13.127
 1149    HB3  ARG 141           HB3      ARG 141   5.314  24.870 -12.919
 1150    HG2  ARG 141           HG2      ARG 141   5.708  25.275 -15.228
 1151    HG3  ARG 141           HG3      ARG 141   4.103  24.822 -15.687
 1152    HD2  ARG 141           HD2      ARG 141   4.033  27.158 -15.745
 1153    HD3  ARG 141           HD3      ARG 141   3.328  26.864 -14.126
 1154    HE   ARG 141           HE       ARG 141   6.231  27.038 -14.585
 1155   HH11  ARG 141          HH11      ARG 141   3.574  28.625 -12.720
 1156   HH12  ARG 141          HH12      ARG 141   4.578  29.935 -12.266
 1157   HH21  ARG 141          HH21      ARG 141   7.363  28.599 -14.233
 1158   HH22  ARG 141          HH22      ARG 141   6.995  29.941 -13.211
 1159    H    ASP 142           H        ASP 142   6.830  22.822 -12.766
 1160    HA   ASP 142           HA       ASP 142   8.430  22.928 -15.138
 1161    HB2  ASP 142           HB2      ASP 142   9.268  23.539 -12.937
 1162    HB3  ASP 142           HB3      ASP 142   9.077  21.888 -12.350
 1163    H    VAL 143           H        VAL 143   7.133  20.206 -13.242
 1164    HA   VAL 143           HA       VAL 143   8.527  18.202 -14.759
 1165    HB   VAL 143           HB       VAL 143   6.906  18.489 -12.353
 1166   HG11  VAL 143          HG11      VAL 143   5.110  17.224 -13.482
 1167   HG12  VAL 143          HG12      VAL 143   6.295  15.938 -13.859
 1168   HG13  VAL 143          HG13      VAL 143   5.895  16.342 -12.175
 1169   HG21  VAL 143          HG21      VAL 143   8.790  16.358 -13.452
 1170   HG22  VAL 143          HG22      VAL 143   9.218  17.751 -12.393
 1171   HG23  VAL 143          HG23      VAL 143   8.204  16.435 -11.833
 1172    H    TYR 144           H        TYR 144   5.293  19.663 -14.875
 1173    HA   TYR 144           HA       TYR 144   4.228  17.801 -16.761
 1174    HB2  TYR 144           HB2      TYR 144   3.031  19.450 -15.227
 1175    HB3  TYR 144           HB3      TYR 144   3.360  20.683 -16.395
 1176    HD1  TYR 144           HD1      TYR 144   2.537  17.537 -18.237
 1177    HD2  TYR 144           HD2      TYR 144   1.054  21.076 -16.467
 1178    HE1  TYR 144           HE1      TYR 144   0.201  16.962 -18.990
 1179    HE2  TYR 144           HE2      TYR 144  -1.220  20.446 -16.698
 1180    HH   TYR 144           HH       TYR 144  -2.265  19.409 -17.674
 1181    H    ARG 145           H        ARG 145   6.036  20.820 -17.036
 1182    HA   ARG 145           HA       ARG 145   5.995  21.237 -19.809
 1183    HB2  ARG 145           HB2      ARG 145   7.357  22.216 -17.530
 1184    HB3  ARG 145           HB3      ARG 145   8.654  21.483 -18.465
 1185    HG2  ARG 145           HG2      ARG 145   7.674  22.745 -20.492
 1186    HG3  ARG 145           HG3      ARG 145   6.568  23.503 -19.331
 1187    HD2  ARG 145           HD2      ARG 145   8.342  25.024 -19.652
 1188    HD3  ARG 145           HD3      ARG 145   8.565  24.300 -18.026
 1189    HE   ARG 145           HE       ARG 145   9.841  22.773 -20.086
 1190   HH11  ARG 145          HH11      ARG 145  10.300  25.574 -18.043
 1191   HH12  ARG 145          HH12      ARG 145  12.002  25.709 -18.276
 1192   HH21  ARG 145          HH21      ARG 145  11.965  22.844 -20.507
 1193   HH22  ARG 145          HH22      ARG 145  13.040  24.003 -19.795
 1194    H    ARG 146           H        ARG 146   7.933  18.915 -17.912
 1195    HA   ARG 146           HA       ARG 146   9.571  18.112 -20.142
 1196    HB2  ARG 146           HB2      ARG 146   8.887  16.413 -17.723
 1197    HB3  ARG 146           HB3      ARG 146  10.334  16.312 -18.752
 1198    HG2  ARG 146           HG2      ARG 146  10.513  18.911 -18.074
 1199    HG3  ARG 146           HG3      ARG 146   9.446  18.378 -16.752
 1200    HD2  ARG 146           HD2      ARG 146  11.225  16.687 -16.178
 1201    HD3  ARG 146           HD3      ARG 146  12.239  17.532 -17.391
 1202    HE   ARG 146           HE       ARG 146  10.970  19.418 -15.575
 1203   HH11  ARG 146          HH11      ARG 146  13.591  17.141 -15.935
 1204   HH12  ARG 146          HH12      ARG 146  14.615  17.876 -14.753
 1205   HH21  ARG 146          HH21      ARG 146  12.219  20.460 -14.083
 1206   HH22  ARG 146          HH22      ARG 146  13.783  19.893 -13.587
 1207    H    VAL 147           H        VAL 147   6.570  16.810 -18.682
 1208    HA   VAL 147           HA       VAL 147   6.209  14.643 -20.440
 1209    HB   VAL 147           HB       VAL 147   4.088  16.472 -19.225
 1210   HG11  VAL 147          HG11      VAL 147   3.174  15.002 -20.979
 1211   HG12  VAL 147          HG12      VAL 147   3.917  13.611 -20.132
 1212   HG13  VAL 147          HG13      VAL 147   2.605  14.527 -19.377
 1213   HG21  VAL 147          HG21      VAL 147   5.315  13.921 -18.096
 1214   HG22  VAL 147          HG22      VAL 147   5.568  15.561 -17.451
 1215   HG23  VAL 147          HG23      VAL 147   3.966  14.844 -17.396
 1216    H    MET 148           H        MET 148   5.139  18.098 -20.805
 1217    HA   MET 148           HA       MET 148   3.953  17.634 -23.351
 1218    HB2  MET 148           HB2      MET 148   5.019  20.183 -22.059
 1219    HB3  MET 148           HB3      MET 148   4.078  20.127 -23.560
 1220    HG2  MET 148           HG2      MET 148   2.549  18.542 -21.883
 1221    HG3  MET 148           HG3      MET 148   3.207  19.716 -20.752
 1222    HE1  MET 148           HE1      MET 148   0.088  19.317 -21.121
 1223    HE2  MET 148           HE2      MET 148   0.797  20.495 -20.036
 1224    HE3  MET 148           HE3      MET 148  -0.411  21.022 -21.211
 1225    H    LYS 149           H        LYS 149   7.269  18.664 -22.489
 1226    HA   LYS 149           HA       LYS 149   8.115  19.136 -25.172
 1227    HB2  LYS 149           HB2      LYS 149   9.215  20.043 -23.260
 1228    HB3  LYS 149           HB3      LYS 149   9.494  18.455 -22.545
 1229    HG2  LYS 149           HG2      LYS 149  10.759  19.301 -25.171
 1230    HG3  LYS 149           HG3      LYS 149  11.426  19.700 -23.578
 1231    HD2  LYS 149           HD2      LYS 149  11.428  17.186 -23.042
 1232    HD3  LYS 149           HD3      LYS 149  11.105  16.911 -24.778
 1233    HE2  LYS 149           HE2      LYS 149  12.938  18.543 -25.311
 1234    HE3  LYS 149           HE3      LYS 149  13.346  18.579 -23.583
 1235    HZ1  LYS 149           HZ1      LYS 149  13.723  16.196 -23.717
 1236    HZ2  LYS 149           HZ2      LYS 149  13.388  16.204 -25.327
 1237    HZ3  LYS 149           HZ3      LYS 149  14.710  17.027 -24.768
 1238    H    GLU 150           H        GLU 150   8.018  16.126 -23.217
 1239    HA   GLU 150           HA       GLU 150   9.521  14.524 -25.041
 1240    HB2  GLU 150           HB2      GLU 150   7.381  13.925 -22.968
 1241    HB3  GLU 150           HB3      GLU 150   8.166  12.647 -23.881
 1242    HG2  GLU 150           HG2      GLU 150   9.773  14.693 -22.298
 1243    HG3  GLU 150           HG3      GLU 150   9.108  13.249 -21.535
 1244    H    PHE 151           H        PHE 151   6.187  15.692 -25.186
 1245    HA   PHE 151           HA       PHE 151   5.638  13.747 -27.381
 1246    HB2  PHE 151           HB2      PHE 151   3.770  15.205 -25.498
 1247    HB3  PHE 151           HB3      PHE 151   3.263  14.097 -26.763
 1248    HD1  PHE 151           HD2      PHE 151   4.696  11.734 -26.513
 1249    HD2  PHE 151           HD1      PHE 151   3.402  14.367 -23.383
 1250    HE1  PHE 151           HE2      PHE 151   4.752   9.859 -24.890
 1251    HE2  PHE 151           HE1      PHE 151   3.477  12.475 -21.774
 1252    HZ   PHE 151           HZ       PHE 151   4.190  10.247 -22.493
 1253    H    ALA 152           H        ALA 152   6.273  17.062 -26.940
 1254    HA   ALA 152           HA       ALA 152   4.234  18.337 -28.250
 1255    HB1  ALA 152           HB1      ALA 152   6.060  19.536 -27.098
 1256    HB2  ALA 152           HB2      ALA 152   7.208  19.049 -28.347
 1257    HB3  ALA 152           HB3      ALA 152   5.869  20.152 -28.746
 1258    H    SER 153           H        SER 153   7.262  17.239 -29.861
 1259    HA   SER 153           HA       SER 153   6.346  17.958 -32.438
 1260    HB2  SER 153           HB2      SER 153   8.361  15.759 -31.943
 1261    HB3  SER 153           HB3      SER 153   8.286  16.946 -33.263
 1262    HG   SER 153           HG       SER 153   9.885  17.461 -31.688
 1263    H    VAL 154           H        VAL 154   5.462  15.177 -30.453
 1264    HA   VAL 154           HA       VAL 154   4.901  13.446 -32.738
 1265    HB   VAL 154           HB       VAL 154   3.974  13.170 -29.848
 1266   HG11  VAL 154          HG11      VAL 154   2.841  11.660 -31.440
 1267   HG12  VAL 154          HG12      VAL 154   4.415  11.120 -32.061
 1268   HG13  VAL 154          HG13      VAL 154   3.940  10.751 -30.391
 1269   HG21  VAL 154          HG21      VAL 154   6.560  12.146 -31.116
 1270   HG22  VAL 154          HG22      VAL 154   6.454  13.385 -29.848
 1271   HG23  VAL 154          HG23      VAL 154   5.967  11.738 -29.486
 1272    H    VAL 155           H        VAL 155   3.169  15.827 -30.746
 1273    HA   VAL 155           HA       VAL 155   0.580  15.201 -31.959
 1274    HB   VAL 155           HB       VAL 155   1.479  17.401 -30.068
 1275   HG11  VAL 155          HG11      VAL 155  -0.536  18.066 -31.328
 1276   HG12  VAL 155          HG12      VAL 155  -1.322  16.521 -30.935
 1277   HG13  VAL 155          HG13      VAL 155  -0.955  17.695 -29.652
 1278   HG21  VAL 155          HG21      VAL 155  -0.024  14.785 -29.612
 1279   HG22  VAL 155          HG22      VAL 155   1.647  15.095 -29.100
 1280   HG23  VAL 155          HG23      VAL 155   0.350  16.032 -28.388
 1281    H    MET 156           H        MET 156   3.128  17.727 -32.098
 1282    HA   MET 156           HA       MET 156   1.689  19.455 -33.846
 1283    HB2  MET 156           HB2      MET 156   4.672  19.192 -33.356
 1284    HB3  MET 156           HB3      MET 156   3.899  20.535 -34.222
 1285    HG2  MET 156           HG2      MET 156   2.546  19.975 -31.669
 1286    HG3  MET 156           HG3      MET 156   4.262  20.281 -31.436
 1287    HE1  MET 156           HE1      MET 156   1.969  21.762 -30.098
 1288    HE2  MET 156           HE2      MET 156   3.708  22.040 -29.869
 1289    HE3  MET 156           HE3      MET 156   2.618  23.424 -30.171
 1290    H    SER 157           H        SER 157   3.876  16.658 -34.565
 1291    HA   SER 157           HA       SER 157   4.180  17.122 -37.303
 1292    HB2  SER 157           HB2      SER 157   3.642  14.520 -35.805
 1293    HB3  SER 157           HB3      SER 157   4.169  14.611 -37.503
 1294    HG   SER 157           HG       SER 157   5.798  14.417 -35.683
 1295    H    LEU 158           H        LEU 158   1.222  16.165 -35.534
 1296    HA   LEU 158           HA       LEU 158  -0.115  15.218 -37.944
 1297    HB2  LEU 158           HB2      LEU 158  -1.126  16.095 -35.233
 1298    HB3  LEU 158           HB3      LEU 158  -2.152  15.424 -36.497
 1299    HG   LEU 158           HG       LEU 158   0.177  13.699 -36.057
 1300   HD11  LEU 158          HD11      LEU 158   0.103  14.514 -33.784
 1301   HD12  LEU 158          HD12      LEU 158  -1.634  14.128 -33.636
 1302   HD13  LEU 158          HD13      LEU 158  -0.404  12.843 -33.869
 1303   HD21  LEU 158          HD21      LEU 158  -2.807  13.304 -35.641
 1304   HD22  LEU 158          HD22      LEU 158  -1.913  13.013 -37.161
 1305   HD23  LEU 158          HD23      LEU 158  -1.576  12.013 -35.725
 1306    H    GLN 159           H        GLN 159   0.388  18.379 -36.442
 1307    HA   GLN 159           HA       GLN 159  -1.738  19.617 -38.113
 1308    HB2  GLN 159           HB2      GLN 159  -0.110  20.929 -35.940
 1309    HB3  GLN 159           HB3      GLN 159  -1.586  21.501 -36.721
 1310    HG2  GLN 159           HG2      GLN 159  -1.275  19.556 -34.473
 1311    HG3  GLN 159           HG3      GLN 159  -2.410  20.882 -34.753
 1312   HE21  GLN 159          HE22      GLN 159  -2.281  17.374 -34.834
 1313   HE22  GLN 159          HE21      GLN 159  -3.851  17.322 -35.630
 1314    H    GLU 160           H        GLU 160   1.634  19.220 -37.677
 1315    HA   GLU 160           HA       GLU 160   2.559  20.876 -39.842
 1316    HB2  GLU 160           HB2      GLU 160   3.408  20.881 -37.335
 1317    HB3  GLU 160           HB3      GLU 160   4.486  19.677 -38.026
 1318    HG2  GLU 160           HG2      GLU 160   5.120  21.366 -39.843
 1319    HG3  GLU 160           HG3      GLU 160   4.031  22.513 -39.137
 1320    H    ASN 161           H        ASN 161   2.258  17.373 -40.091
 1321    HA   ASN 161           HA       ASN 161   3.805  16.352 -42.346
 1322    HB2  ASN 161           HB2      ASN 161   2.563  14.964 -40.809
 1323    HB3  ASN 161           HB3      ASN 161   1.203  15.899 -40.898
 1324   HD21  ASN 161          HD22      ASN 161  -0.182  14.258 -41.044
 1325   HD22  ASN 161          HD21      ASN 161  -0.388  13.460 -42.593
 1326    H    THR 162           H        THR 162   0.562  18.262 -43.690
 1327    HA   THR 162           HA       THR 162   1.239  19.412 -46.094
 1328    HB   THR 162           HB       THR 162  -0.177  20.972 -46.603
 1329    HG1  THR 162           HG1      THR 162  -1.684  21.098 -44.661
 1330   HG21  THR 162          HG21      THR 162  -1.882  19.698 -48.172
 1331   HG22  THR 162          HG22      THR 162  -3.003  19.651 -46.831
 1332   HG23  THR 162          HG23      THR 162  -2.411  21.177 -47.538
 1333    HA   PRO 163           HA       PRO 163  -0.993  21.568 -43.925
 1334    HB2  PRO 163           HB2      PRO 163   0.193  23.453 -44.974
 1335    HB3  PRO 163           HB3      PRO 163  -1.571  23.233 -44.430
 1336    HG2  PRO 163           HG2      PRO 163   0.697  23.935 -42.673
 1337    HG3  PRO 163           HG3      PRO 163  -0.977  23.929 -42.163
 1338    HD2  PRO 163           HD2      PRO 163   0.828  22.151 -41.790
 1339    HD3  PRO 163           HD3      PRO 163  -0.537  21.681 -41.088
 1340    H    LYS 164           H        LYS 164   1.240  20.847 -42.192
 1341    HA   LYS 164           HA       LYS 164   2.209  19.919 -41.496
 1342    HB2  LYS 164           HB2      LYS 164   0.303  17.711 -42.457
 1343    HB3  LYS 164           HB3      LYS 164   0.986  17.706 -41.414
 1344    HG2  LYS 164           HG2      LYS 164   0.317  18.187 -39.812
 1345    HG3  LYS 164           HG3      LYS 164  -0.171  19.732 -40.632
 1346    HD2  LYS 164           HD2      LYS 164  -1.475  16.985 -40.779
 1347    HD3  LYS 164           HD3      LYS 164  -2.082  18.536 -40.000
 1348    HE2  LYS 164           HE2      LYS 164  -1.312  18.738 -42.391
 1349    HE3  LYS 164           HE3      LYS 164  -2.402  17.712 -42.767
 1350    HZ1  LYS 164           HZ1      LYS 164  -1.647  19.885 -41.899
 1351    HZ2  LYS 164           HZ2      LYS 164  -2.262  20.691 -41.691
 1352    HZ3  LYS 164           HZ3      LYS 164  -2.766  19.983 -43.062
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1  -0.220   1.254  -1.173
    2    H2   MET   1           H2       MET   1   0.038  -0.363  -1.134
    3    H3   MET   1           H3       MET   1   1.069   0.648  -0.373
    4    HA   MET   1           HA       MET   1   2.065  -0.162  -2.400
    5    HB2  MET   1           HB2      MET   1  -0.124  -0.522  -3.577
    6    HB3  MET   1           HB3      MET   1  -0.235   1.220  -3.853
    7    HG2  MET   1           HG2      MET   1   1.847   1.133  -5.197
    8    HG3  MET   1           HG3      MET   1   2.009  -0.592  -4.850
    9    HE1  MET   1           HE1      MET   1   2.313  -1.139  -7.395
   10    HE2  MET   1           HE2      MET   1   1.191  -0.624  -8.670
   11    HE3  MET   1           HE3      MET   1   2.172   0.586  -7.809
   12    H    ILE   2           H        ILE   2   3.846   1.087  -2.188
   13    HA   ILE   2           HA       ILE   2   3.830   3.798  -3.278
   14    HB   ILE   2           HB       ILE   2   4.898   3.022  -0.530
   15   HG12  ILE   2          HG12      ILE   2   2.618   3.957  -0.498
   16   HG13  ILE   2          HG13      ILE   2   3.765   4.992   0.314
   17   HG21  ILE   2          HG21      ILE   2   6.031   5.239  -0.451
   18   HG22  ILE   2          HG22      ILE   2   6.757   4.118  -1.592
   19   HG23  ILE   2          HG23      ILE   2   5.711   5.425  -2.191
   20   HD11  ILE   2          HD11      ILE   2   2.687   5.508  -2.490
   21   HD12  ILE   2          HD12      ILE   2   2.151   6.292  -1.000
   22   HD13  ILE   2          HD13      ILE   2   3.798   6.563  -1.586
   23    H    ASP   3           H        ASP   3   5.878   4.156  -4.338
   24    HA   ASP   3           HA       ASP   3   6.767   1.780  -5.610
   25    HB2  ASP   3           HB2      ASP   3   6.615   4.006  -6.671
   26    HB3  ASP   3           HB3      ASP   3   7.953   4.574  -5.677
   27    H    ASP   4           H        ASP   4   8.427   3.956  -3.316
   28    HA   ASP   4           HA       ASP   4   9.940   1.730  -2.223
   29    HB2  ASP   4           HB2      ASP   4  11.464   2.308  -4.010
   30    HB3  ASP   4           HB3      ASP   4  11.413   4.012  -3.558
   31    H    ASP   5           H        ASP   5  10.841   5.159  -1.995
   32    HA   ASP   5           HA       ASP   5  10.572   4.957   0.858
   33    HB2  ASP   5           HB2      ASP   5  12.536   5.947  -0.178
   34    HB3  ASP   5           HB3      ASP   5  11.546   7.224  -0.897
   35    H    GLY   6           H        GLY   6   8.999   6.953  -1.632
   36    HA2  GLY   6           HA2      GLY   6   6.644   7.468  -0.008
   37    HA3  GLY   6           HA3      GLY   6   7.772   8.829  -0.014
   38    H    TYR   7           H        TYR   7   7.444   6.784  -2.917
   39    HA   TYR   7           HA       TYR   7   6.130   9.093  -4.263
   40    HB2  TYR   7           HB2      TYR   7   8.365   7.289  -5.236
   41    HB3  TYR   7           HB3      TYR   7   7.364   8.247  -6.323
   42    HD1  TYR   7           HD1      TYR   7   7.269  10.714  -6.179
   43    HD2  TYR   7           HD2      TYR   7  10.084   8.408  -3.865
   44    HE1  TYR   7           HE1      TYR   7   8.499  12.784  -5.628
   45    HE2  TYR   7           HE2      TYR   7  11.351  10.466  -3.343
   46    HH   TYR   7           HH       TYR   7  11.542  12.766  -3.685
   47    H    ARG   8           H        ARG   8   4.408   8.703  -5.514
   48    HA   ARG   8           HA       ARG   8   3.229   5.948  -5.218
   49    HB2  ARG   8           HB2      ARG   8   2.142   7.758  -4.035
   50    HB3  ARG   8           HB3      ARG   8   2.070   8.734  -5.483
   51    HG2  ARG   8           HG2      ARG   8  -0.106   7.932  -5.055
   52    HG3  ARG   8           HG3      ARG   8   0.462   7.065  -6.485
   53    HD2  ARG   8           HD2      ARG   8   0.904   5.061  -5.132
   54    HD3  ARG   8           HD3      ARG   8   0.562   5.975  -3.643
   55    HE   ARG   8           HE       ARG   8  -1.614   5.958  -5.596
   56   HH11  ARG   8          HH12      ARG   8  -0.227   4.048  -2.906
   57   HH12  ARG   8          HH11      ARG   8  -1.783   3.590  -2.286
   58   HH21  ARG   8          HH21      ARG   8  -3.650   5.199  -4.830
   59   HH22  ARG   8          HH22      ARG   8  -3.733   4.134  -3.482
   60    HA   PRO   9           HA       PRO   9   3.836   5.908  -9.702
   61    HB2  PRO   9           HB2      PRO   9   2.296   3.327  -9.503
   62    HB3  PRO   9           HB3      PRO   9   3.808   3.682 -10.405
   63    HG2  PRO   9           HG2      PRO   9   3.908   2.347  -8.054
   64    HG3  PRO   9           HG3      PRO   9   5.090   3.651  -8.397
   65    HD2  PRO   9           HD2      PRO   9   2.544   3.812  -6.754
   66    HD3  PRO   9           HD3      PRO   9   4.191   4.406  -6.361
   67    H    ASN  10           H        ASN  10   2.644   6.771 -11.337
   68    HA   ASN  10           HA       ASN  10  -0.314   6.782 -11.280
   69    HB2  ASN  10           HB2      ASN  10   1.569   9.176 -11.118
   70    HB3  ASN  10           HB3      ASN  10   0.000   9.331 -11.889
   71   HD21  ASN  10          HD22      ASN  10   1.538   8.442  -8.781
   72   HD22  ASN  10          HD21      ASN  10   0.256   9.141  -7.827
   73    H    VAL  11           H        VAL  11  -1.228   7.553 -13.238
   74    HA   VAL  11           HA       VAL  11   0.445   7.414 -15.703
   75    HB   VAL  11           HB       VAL  11  -1.584   6.077 -16.554
   76   HG11  VAL  11          HG11      VAL  11   0.677   5.149 -16.285
   77   HG12  VAL  11          HG12      VAL  11   0.336   4.772 -14.587
   78   HG13  VAL  11          HG13      VAL  11  -0.556   3.940 -15.880
   79   HG21  VAL  11          HG21      VAL  11  -3.042   6.368 -14.526
   80   HG22  VAL  11          HG22      VAL  11  -2.804   4.682 -14.981
   81   HG23  VAL  11          HG23      VAL  11  -1.921   5.333 -13.607
   82    H    GLY  12           H        GLY  12   0.175   9.883 -15.519
   83    HA2  GLY  12           HA2      GLY  12  -2.430  11.061 -15.839
   84    HA3  GLY  12           HA3      GLY  12  -0.884  11.803 -16.251
   85    H    ILE  13           H        ILE  13  -3.749  11.037 -17.650
   86    HA   ILE  13           HA       ILE  13  -2.696   9.882 -20.141
   87    HB   ILE  13           HB       ILE  13  -5.535  10.853 -19.750
   88   HG12  ILE  13          HG12      ILE  13  -5.286   9.476 -17.780
   89   HG13  ILE  13          HG13      ILE  13  -6.343   8.732 -18.964
   90   HG21  ILE  13          HG21      ILE  13  -4.739  10.167 -21.986
   91   HG22  ILE  13          HG22      ILE  13  -4.385   8.543 -21.359
   92   HG23  ILE  13          HG23      ILE  13  -6.051   9.151 -21.368
   93   HD11  ILE  13          HD11      ILE  13  -4.677   7.097 -19.555
   94   HD12  ILE  13          HD12      ILE  13  -3.430   7.936 -18.597
   95   HD13  ILE  13          HD13      ILE  13  -4.797   7.152 -17.789
   96    H    VAL  14           H        VAL  14  -1.576  11.425 -21.402
   97    HA   VAL  14           HA       VAL  14  -2.671  14.175 -21.534
   98    HB   VAL  14           HB       VAL  14  -0.356  13.014 -23.135
   99   HG11  VAL  14          HG11      VAL  14  -1.204  15.903 -22.619
  100   HG12  VAL  14          HG12      VAL  14   0.176  15.358 -23.598
  101   HG13  VAL  14          HG13      VAL  14  -1.462  15.018 -24.134
  102   HG21  VAL  14          HG21      VAL  14   0.341  12.939 -20.877
  103   HG22  VAL  14          HG22      VAL  14   1.059  14.391 -21.585
  104   HG23  VAL  14          HG23      VAL  14  -0.353  14.562 -20.528
  105    H    ILE  15           H        ILE  15  -4.796  13.390 -22.172
  106    HA   ILE  15           HA       ILE  15  -5.148  12.113 -24.756
  107    HB   ILE  15           HB       ILE  15  -6.973  14.001 -23.206
  108   HG12  ILE  15          HG12      ILE  15  -6.612  11.795 -22.117
  109   HG13  ILE  15          HG13      ILE  15  -8.279  12.133 -22.550
  110   HG21  ILE  15          HG21      ILE  15  -7.653  14.286 -25.445
  111   HG22  ILE  15          HG22      ILE  15  -7.487  12.555 -25.799
  112   HG23  ILE  15          HG23      ILE  15  -8.798  13.153 -24.736
  113   HD11  ILE  15          HD11      ILE  15  -8.182  10.649 -24.488
  114   HD12  ILE  15          HD12      ILE  15  -6.441  10.429 -24.284
  115   HD13  ILE  15          HD13      ILE  15  -7.577   9.771 -23.075
  116    H    CYS  16           H        CYS  16  -5.024  13.031 -26.740
  117    HA   CYS  16           HA       CYS  16  -4.922  16.006 -26.878
  118    HB2  CYS  16           HB2      CYS  16  -3.128  14.074 -28.396
  119    HB3  CYS  16           HB3      CYS  16  -3.446  15.760 -28.902
  120    HG   CYS  16           HG       CYS  16  -2.375  14.674 -25.964
  121    H    ASN  17           H        ASN  17  -6.366  16.793 -28.174
  122    HA   ASN  17           HA       ASN  17  -8.047  14.946 -29.774
  123    HB2  ASN  17           HB2      ASN  17  -9.190  16.637 -28.294
  124    HB3  ASN  17           HB3      ASN  17  -8.408  17.935 -29.218
  125   HD21  ASN  17          HD22      ASN  17 -11.103  15.710 -29.182
  126   HD22  ASN  17          HD21      ASN  17 -11.621  15.976 -30.831
  127    H    ARG  18           H        ARG  18  -7.835  14.955 -31.924
  128    HA   ARG  18           HA       ARG  18  -5.452  15.652 -33.153
  129    HB2  ARG  18           HB2      ARG  18  -8.117  15.148 -34.547
  130    HB3  ARG  18           HB3      ARG  18  -6.494  14.831 -35.179
  131    HG2  ARG  18           HG2      ARG  18  -6.169  13.138 -33.309
  132    HG3  ARG  18           HG3      ARG  18  -7.866  13.409 -32.839
  133    HD2  ARG  18           HD2      ARG  18  -8.590  12.843 -35.121
  134    HD3  ARG  18           HD3      ARG  18  -6.890  12.504 -35.553
  135    HE   ARG  18           HE       ARG  18  -7.921  11.039 -33.208
  136   HH11  ARG  18          HH11      ARG  18  -7.636  10.868 -36.757
  137   HH12  ARG  18          HH12      ARG  18  -7.701   9.144 -36.812
  138   HH21  ARG  18          HH21      ARG  18  -8.011   8.814 -33.266
  139   HH22  ARG  18          HH22      ARG  18  -7.924   7.928 -34.773
  140    H    GLN  19           H        GLN  19  -8.092  17.850 -32.616
  141    HA   GLN  19           HA       GLN  19  -7.486  19.635 -34.813
  142    HB2  GLN  19           HB2      GLN  19  -8.729  20.070 -32.072
  143    HB3  GLN  19           HB3      GLN  19  -8.640  21.312 -33.333
  144    HG2  GLN  19           HG2      GLN  19 -10.118  20.177 -34.779
  145    HG3  GLN  19           HG3      GLN  19  -9.989  18.655 -33.893
  146   HE21  GLN  19          HE22      GLN  19 -10.984  18.430 -31.829
  147   HE22  GLN  19          HE21      GLN  19 -12.253  19.521 -31.262
  148    H    GLY  20           H        GLY  20  -5.673  18.728 -32.001
  149    HA2  GLY  20           HA2      GLY  20  -3.374  19.272 -31.780
  150    HA3  GLY  20           HA3      GLY  20  -3.654  20.878 -32.488
  151    H    GLN  21           H        GLN  21  -5.323  19.120 -29.866
  152    HA   GLN  21           HA       GLN  21  -4.742  21.368 -28.021
  153    HB2  GLN  21           HB2      GLN  21  -7.499  20.673 -29.135
  154    HB3  GLN  21           HB3      GLN  21  -7.296  21.406 -27.557
  155    HG2  GLN  21           HG2      GLN  21  -7.558  23.320 -28.743
  156    HG3  GLN  21           HG3      GLN  21  -5.815  23.198 -28.855
  157   HE21  GLN  21          HE22      GLN  21  -4.892  23.086 -31.030
  158   HE22  GLN  21          HE21      GLN  21  -5.857  22.862 -32.462
  159    H    VAL  22           H        VAL  22  -5.122  20.826 -25.807
  160    HA   VAL  22           HA       VAL  22  -4.651  17.912 -25.433
  161    HB   VAL  22           HB       VAL  22  -3.345  18.621 -23.464
  162   HG11  VAL  22          HG11      VAL  22  -1.430  19.499 -24.688
  163   HG12  VAL  22          HG12      VAL  22  -2.253  18.285 -25.666
  164   HG13  VAL  22          HG13      VAL  22  -2.478  20.007 -26.032
  165   HG21  VAL  22          HG21      VAL  22  -4.497  20.784 -23.018
  166   HG22  VAL  22          HG22      VAL  22  -2.730  20.950 -23.127
  167   HG23  VAL  22          HG23      VAL  22  -3.752  21.480 -24.472
  168    H    MET  23           H        MET  23  -5.105  17.018 -23.331
  169    HA   MET  23           HA       MET  23  -7.773  17.082 -22.568
  170    HB2  MET  23           HB2      MET  23  -5.747  15.412 -22.086
  171    HB3  MET  23           HB3      MET  23  -5.609  16.306 -20.589
  172    HG2  MET  23           HG2      MET  23  -8.127  14.933 -21.619
  173    HG3  MET  23           HG3      MET  23  -7.008  14.248 -20.443
  174    HE1  MET  23           HE1      MET  23 -10.460  14.969 -18.629
  175    HE2  MET  23           HE2      MET  23 -10.262  14.656 -20.367
  176    HE3  MET  23           HE3      MET  23  -9.335  13.712 -19.179
  177    H    TRP  24           H        TRP  24  -8.941  18.497 -21.307
  178    HA   TRP  24           HA       TRP  24  -7.885  19.505 -18.854
  179    HB2  TRP  24           HB2      TRP  24  -7.209  21.255 -20.610
  180    HB3  TRP  24           HB3      TRP  24  -8.915  21.610 -20.793
  181    HD1  TRP  24           HD1      TRP  24  -9.464  23.736 -19.557
  182    HE1  TRP  24           HE1      TRP  24  -8.647  24.993 -17.487
  183    HE3  TRP  24           HE3      TRP  24  -6.013  20.350 -17.856
  184    HZ2  TRP  24           HZ2      TRP  24  -6.612  24.649 -15.426
  185    HZ3  TRP  24           HZ3      TRP  24  -4.645  20.860 -15.851
  186    HH2  TRP  24           HH2      TRP  24  -4.943  22.994 -14.627
  187    H    ALA  25           H        ALA  25  -9.653  19.539 -17.403
  188    HA   ALA  25           HA       ALA  25 -12.387  19.411 -18.472
  189    HB1  ALA  25           HB1      ALA  25 -12.751  17.154 -17.369
  190    HB2  ALA  25           HB2      ALA  25 -11.729  17.107 -18.814
  191    HB3  ALA  25           HB3      ALA  25 -10.984  17.023 -17.202
  192    H    ARG  26           H        ARG  26 -13.964  19.706 -16.927
  193    HA   ARG  26           HA       ARG  26 -13.150  21.223 -14.569
  194    HB2  ARG  26           HB2      ARG  26 -15.128  21.801 -15.962
  195    HB3  ARG  26           HB3      ARG  26 -15.926  20.300 -15.465
  196    HG2  ARG  26           HG2      ARG  26 -15.964  21.046 -13.120
  197    HG3  ARG  26           HG3      ARG  26 -14.962  22.447 -13.522
  198    HD2  ARG  26           HD2      ARG  26 -17.229  23.210 -13.294
  199    HD3  ARG  26           HD3      ARG  26 -16.752  23.323 -14.993
  200    HE   ARG  26           HE       ARG  26 -18.164  20.835 -14.266
  201   HH11  ARG  26          HH11      ARG  26 -18.698  24.206 -15.351
  202   HH12  ARG  26          HH12      ARG  26 -20.276  23.862 -15.963
  203   HH21  ARG  26          HH21      ARG  26 -20.126  20.423 -15.008
  204   HH22  ARG  26          HH22      ARG  26 -21.147  21.625 -15.782
  205    H    ARG  27           H        ARG  27 -12.858  20.348 -12.511
  206    HA   ARG  27           HA       ARG  27 -12.859  17.448 -12.416
  207    HB2  ARG  27           HB2      ARG  27 -11.046  19.049 -11.647
  208    HB3  ARG  27           HB3      ARG  27 -12.008  19.343 -10.221
  209    HG2  ARG  27           HG2      ARG  27 -10.862  16.652 -11.101
  210    HG3  ARG  27           HG3      ARG  27 -10.175  17.734  -9.893
  211    HD2  ARG  27           HD2      ARG  27 -12.142  17.420  -8.448
  212    HD3  ARG  27           HD3      ARG  27 -12.788  16.249  -9.628
  213    HE   ARG  27           HE       ARG  27 -10.198  15.406  -9.038
  214   HH11  ARG  27          HH11      ARG  27 -13.309  15.776  -7.318
  215   HH12  ARG  27          HH12      ARG  27 -12.940  14.559  -6.138
  216   HH21  ARG  27          HH21      ARG  27  -9.823  13.682  -7.660
  217   HH22  ARG  27          HH22      ARG  27 -10.867  13.351  -6.302
  218    H    PHE  28           H        PHE  28 -14.305  16.181 -11.440
  219    HA   PHE  28           HA       PHE  28 -16.888  16.982 -10.590
  220    HB2  PHE  28           HB2      PHE  28 -16.496  14.765 -11.373
  221    HB3  PHE  28           HB3      PHE  28 -15.142  14.523 -10.283
  222    HD1  PHE  28           HD2      PHE  28 -18.850  14.579 -10.499
  223    HD2  PHE  28           HD1      PHE  28 -15.404  13.836  -8.017
  224    HE1  PHE  28           HE2      PHE  28 -20.294  13.410  -8.846
  225    HE2  PHE  28           HE1      PHE  28 -16.856  12.647  -6.365
  226    HZ   PHE  28           HZ       PHE  28 -19.306  12.455  -6.778
  227    H    GLY  29           H        GLY  29 -17.721  17.557  -8.596
  228    HA2  GLY  29           HA2      GLY  29 -17.893  17.850  -6.337
  229    HA3  GLY  29           HA3      GLY  29 -16.326  17.059  -6.106
  230    H    GLN  30           H        GLN  30 -14.749  18.801  -7.807
  231    HA   GLN  30           HA       GLN  30 -14.392  21.075  -5.995
  232    HB2  GLN  30           HB2      GLN  30 -12.493  19.779  -6.850
  233    HB3  GLN  30           HB3      GLN  30 -12.964  20.153  -8.512
  234    HG2  GLN  30           HG2      GLN  30 -12.526  22.546  -8.116
  235    HG3  GLN  30           HG3      GLN  30 -12.101  22.202  -6.438
  236   HE21  GLN  30          HE21      GLN  30 -11.063  21.554  -9.892
  237   HE22  GLN  30          HE22      GLN  30  -9.389  21.371  -9.463
  238    H    HIS  31           H        HIS  31 -15.487  20.474  -9.329
  239    HA   HIS  31           HA       HIS  31 -16.388  21.680 -10.927
  240    HB2  HIS  31           HB2      HIS  31 -17.619  23.413  -8.788
  241    HB3  HIS  31           HB3      HIS  31 -18.204  23.147 -10.431
  242    HD1  HIS  31           HD1      HIS  31 -19.333  22.110  -7.262
  243    HD2  HIS  31           HD2      HIS  31 -18.041  19.994 -10.663
  244    HE1  HIS  31           HE1      HIS  31 -20.272  19.758  -7.041
  245    H    SER  32           H        SER  32 -13.750  22.230 -10.339
  246    HA   SER  32           HA       SER  32 -13.432  24.651 -11.957
  247    HB2  SER  32           HB2      SER  32 -11.643  24.146  -9.533
  248    HB3  SER  32           HB3      SER  32 -11.559  25.497 -10.669
  249    HG   SER  32           HG       SER  32 -12.616  26.098  -8.726
  250    H    TRP  33           H        TRP  33 -11.293  24.464 -13.133
  251    HA   TRP  33           HA       TRP  33 -11.136  21.886 -14.272
  252    HB2  TRP  33           HB2      TRP  33  -9.139  24.144 -14.569
  253    HB3  TRP  33           HB3      TRP  33  -9.474  22.825 -15.693
  254    HD1  TRP  33           HD1      TRP  33 -10.752  26.233 -14.609
  255    HE1  TRP  33           HE1      TRP  33 -12.696  26.984 -16.073
  256    HE3  TRP  33           HE3      TRP  33 -11.321  22.008 -17.418
  257    HZ2  TRP  33           HZ2      TRP  33 -14.416  25.837 -18.117
  258    HZ3  TRP  33           HZ3      TRP  33 -13.177  21.820 -19.062
  259    HH2  TRP  33           HH2      TRP  33 -14.736  23.725 -19.408
  260    H    GLN  34           H        GLN  34  -9.389  20.348 -14.440
  261    HA   GLN  34           HA       GLN  34  -7.049  20.731 -12.766
  262    HB2  GLN  34           HB2      GLN  34  -8.762  19.662 -11.243
  263    HB3  GLN  34           HB3      GLN  34  -8.754  18.245 -12.298
  264    HG2  GLN  34           HG2      GLN  34  -6.424  17.796 -11.743
  265    HG3  GLN  34           HG3      GLN  34  -6.265  19.359 -10.932
  266   HE21  GLN  34          HE22      GLN  34  -6.987  19.557  -8.730
  267   HE22  GLN  34          HE21      GLN  34  -7.585  18.187  -7.835
  268    H    PHE  35           H        PHE  35  -5.407  19.224 -13.206
  269    HA   PHE  35           HA       PHE  35  -5.023  18.443 -15.944
  270    HB2  PHE  35           HB2      PHE  35  -2.871  17.461 -14.761
  271    HB3  PHE  35           HB3      PHE  35  -3.084  19.196 -14.846
  272    HD1  PHE  35           HD1      PHE  35  -3.678  16.267 -12.515
  273    HD2  PHE  35           HD2      PHE  35  -3.166  20.532 -12.909
  274    HE1  PHE  35           HE1      PHE  35  -3.896  16.526 -10.063
  275    HE2  PHE  35           HE2      PHE  35  -3.292  20.770 -10.437
  276    HZ   PHE  35           HZ       PHE  35  -3.693  18.775  -9.015
  277    HA   PRO  36           HA       PRO  36  -6.067  14.052 -15.572
  278    HB2  PRO  36           HB2      PRO  36  -3.457  13.455 -16.920
  279    HB3  PRO  36           HB3      PRO  36  -5.092  12.905 -17.359
  280    HG2  PRO  36           HG2      PRO  36  -3.869  14.894 -18.786
  281    HG3  PRO  36           HG3      PRO  36  -5.617  14.981 -18.401
  282    HD2  PRO  36           HD2      PRO  36  -3.301  16.345 -16.999
  283    HD3  PRO  36           HD3      PRO  36  -4.874  17.024 -17.512
  284    H    GLN  37           H        GLN  37  -5.524  12.328 -14.239
  285    HA   GLN  37           HA       GLN  37  -2.930  11.734 -13.206
  286    HB2  GLN  37           HB2      GLN  37  -3.323  12.017 -10.856
  287    HB3  GLN  37           HB3      GLN  37  -3.255  13.563 -11.678
  288    HG2  GLN  37           HG2      GLN  37  -5.717  13.796 -11.515
  289    HG3  GLN  37           HG3      GLN  37  -5.830  12.192 -10.786
  290   HE21  GLN  37          HE22      GLN  37  -6.996  13.474  -9.007
  291   HE22  GLN  37          HE21      GLN  37  -5.981  14.205  -7.783
  292    H    GLY  38           H        GLY  38  -3.017   9.567 -12.240
  293    HA2  GLY  38           HA2      GLY  38  -5.409   8.514 -11.131
  294    HA3  GLY  38           HA3      GLY  38  -5.144   7.823 -12.747
  295    H    GLY  39           H        GLY  39  -4.758   6.769  -9.807
  296    HA2  GLY  39           HA2      GLY  39  -1.911   6.219  -9.601
  297    HA3  GLY  39           HA3      GLY  39  -3.210   5.585  -8.582
  298    H    ILE  40           H        ILE  40  -1.253   3.914  -9.314
  299    HA   ILE  40           HA       ILE  40  -2.289   2.212 -11.525
  300    HB   ILE  40           HB       ILE  40   0.338   2.213 -10.011
  301   HG12  ILE  40          HG12      ILE  40  -0.538   2.920 -12.850
  302   HG13  ILE  40          HG13      ILE  40   0.187   3.982 -11.654
  303   HG21  ILE  40          HG21      ILE  40  -0.307  -0.140 -10.502
  304   HG22  ILE  40          HG22      ILE  40  -0.480   0.285 -12.221
  305   HG23  ILE  40          HG23      ILE  40   1.095   0.371 -11.410
  306   HD11  ILE  40          HD11      ILE  40   1.542   1.799 -13.270
  307   HD12  ILE  40          HD12      ILE  40   1.866   3.535 -13.261
  308   HD13  ILE  40          HD13      ILE  40   2.309   2.552 -11.853
  309    H    ASN  41           H        ASN  41  -3.079   0.152 -11.175
  310    HA   ASN  41           HA       ASN  41  -4.076  -0.397  -8.462
  311    HB2  ASN  41           HB2      ASN  41  -5.699  -0.567 -10.268
  312    HB3  ASN  41           HB3      ASN  41  -4.641  -1.642 -11.175
  313   HD21  ASN  41          HD22      ASN  41  -6.677  -1.428  -8.217
  314   HD22  ASN  41          HD21      ASN  41  -6.819  -3.156  -8.010
  315    HA   PRO  42           HA       PRO  42  -0.668  -2.909  -7.627
  316    HB2  PRO  42           HB2      PRO  42  -2.517  -4.687  -6.011
  317    HB3  PRO  42           HB3      PRO  42  -0.914  -4.022  -5.557
  318    HG2  PRO  42           HG2      PRO  42  -3.189  -2.856  -4.647
  319    HG3  PRO  42           HG3      PRO  42  -1.836  -1.841  -5.242
  320    HD2  PRO  42           HD2      PRO  42  -4.370  -2.627  -6.688
  321    HD3  PRO  42           HD3      PRO  42  -3.544  -1.041  -6.609
  322    H    GLY  43           H        GLY  43   0.211  -4.011  -9.129
  323    HA2  GLY  43           HA2      GLY  43   0.941  -6.018 -10.093
  324    HA3  GLY  43           HA3      GLY  43  -0.581  -6.805  -9.660
  325    H    GLU  44           H        GLU  44  -1.429  -3.850 -11.032
  326    HA   GLU  44           HA       GLU  44  -1.763  -5.019 -13.770
  327    HB2  GLU  44           HB2      GLU  44  -3.778  -4.204 -12.613
  328    HB3  GLU  44           HB3      GLU  44  -3.048  -2.583 -12.494
  329    HG2  GLU  44           HG2      GLU  44  -2.964  -2.365 -14.873
  330    HG3  GLU  44           HG3      GLU  44  -3.374  -4.060 -15.121
  331    H    SER  45           H        SER  45  -0.186  -4.519 -15.205
  332    HA   SER  45           HA       SER  45   1.851  -2.635 -14.586
  333    HB2  SER  45           HB2      SER  45   1.395  -3.960 -17.259
  334    HB3  SER  45           HB3      SER  45   2.909  -3.369 -16.576
  335    HG   SER  45           HG       SER  45   2.675  -5.670 -16.364
  336    H    ALA  46           H        ALA  46   2.630  -0.983 -16.120
  337    HA   ALA  46           HA       ALA  46   1.038   1.226 -15.950
  338    HB1  ALA  46           HB1      ALA  46   3.201   0.650 -18.031
  339    HB2  ALA  46           HB2      ALA  46   2.656   2.272 -17.513
  340    HB3  ALA  46           HB3      ALA  46   3.495   1.215 -16.361
  341    H    GLU  47           H        GLU  47   1.419  -0.853 -18.861
  342    HA   GLU  47           HA       GLU  47  -0.447   0.873 -20.344
  343    HB2  GLU  47           HB2      GLU  47   1.191  -1.563 -21.165
  344    HB3  GLU  47           HB3      GLU  47   0.110  -0.693 -22.262
  345    HG2  GLU  47           HG2      GLU  47   1.378   1.362 -22.009
  346    HG3  GLU  47           HG3      GLU  47   2.453   0.612 -20.825
  347    H    GLN  48           H        GLN  48  -1.364  -0.601 -18.026
  348    HA   GLN  48           HA       GLN  48  -3.822  -1.711 -19.236
  349    HB2  GLN  48           HB2      GLN  48  -2.297  -3.075 -16.957
  350    HB3  GLN  48           HB3      GLN  48  -3.964  -3.382 -17.412
  351    HG2  GLN  48           HG2      GLN  48  -3.074  -5.073 -18.571
  352    HG3  GLN  48           HG3      GLN  48  -2.856  -3.865 -19.821
  353   HE21  GLN  48          HE22      GLN  48  -0.644  -3.136 -20.257
  354   HE22  GLN  48          HE21      GLN  48   0.759  -3.926 -19.554
  355    H    ALA  49           H        ALA  49  -2.112  -0.684 -16.226
  356    HA   ALA  49           HA       ALA  49  -4.348   0.388 -14.888
  357    HB1  ALA  49           HB1      ALA  49  -2.219  -0.109 -13.774
  358    HB2  ALA  49           HB2      ALA  49  -1.397   1.153 -14.730
  359    HB3  ALA  49           HB3      ALA  49  -2.651   1.602 -13.563
  360    H    MET  50           H        MET  50  -2.166   1.888 -17.334
  361    HA   MET  50           HA       MET  50  -3.114   4.541 -17.132
  362    HB2  MET  50           HB2      MET  50  -1.125   3.908 -18.351
  363    HB3  MET  50           HB3      MET  50  -2.064   2.953 -19.504
  364    HG2  MET  50           HG2      MET  50  -2.466   5.934 -19.103
  365    HG3  MET  50           HG3      MET  50  -1.277   5.283 -20.210
  366    HE1  MET  50           HE1      MET  50  -1.597   4.582 -22.538
  367    HE2  MET  50           HE2      MET  50  -2.262   3.061 -21.899
  368    HE3  MET  50           HE3      MET  50  -3.112   3.920 -23.199
  369    H    TYR  51           H        TYR  51  -4.455   1.763 -18.992
  370    HA   TYR  51           HA       TYR  51  -6.712   3.278 -19.903
  371    HB2  TYR  51           HB2      TYR  51  -6.373   0.277 -19.698
  372    HB3  TYR  51           HB3      TYR  51  -7.601   1.159 -20.604
  373    HD1  TYR  51           HD2      TYR  51  -6.987   2.509 -22.610
  374    HD2  TYR  51           HD1      TYR  51  -4.100   0.037 -20.586
  375    HE1  TYR  51           HE2      TYR  51  -5.667   2.401 -24.660
  376    HE2  TYR  51           HE1      TYR  51  -2.681   0.024 -22.602
  377    HH   TYR  51           HH       TYR  51  -3.747   1.503 -25.719
  378    H    ARG  52           H        ARG  52  -6.088   1.301 -16.962
  379    HA   ARG  52           HA       ARG  52  -8.806   1.220 -16.069
  380    HB2  ARG  52           HB2      ARG  52  -6.750   0.018 -15.060
  381    HB3  ARG  52           HB3      ARG  52  -6.348   1.549 -14.284
  382    HG2  ARG  52           HG2      ARG  52  -7.485   0.322 -12.636
  383    HG3  ARG  52           HG3      ARG  52  -8.645   1.522 -13.198
  384    HD2  ARG  52           HD2      ARG  52  -9.749  -0.613 -12.903
  385    HD3  ARG  52           HD3      ARG  52  -9.714  -0.236 -14.636
  386    HE   ARG  52           HE       ARG  52  -7.393  -1.769 -13.999
  387   HH11  ARG  52          HH11      ARG  52 -10.917  -2.311 -13.882
  388   HH12  ARG  52          HH12      ARG  52 -10.812  -3.974 -14.327
  389   HH21  ARG  52          HH21      ARG  52  -7.274  -3.865 -14.799
  390   HH22  ARG  52          HH22      ARG  52  -8.662  -4.927 -14.767
  391    H    ALA  53           H        ALA  53  -6.203   3.692 -15.628
  392    HA   ALA  53           HA       ALA  53  -7.774   5.480 -14.086
  393    HB1  ALA  53           HB1      ALA  53  -5.348   5.649 -14.136
  394    HB2  ALA  53           HB2      ALA  53  -5.364   5.916 -15.894
  395    HB3  ALA  53           HB3      ALA  53  -6.045   7.146 -14.813
  396    H    LEU  54           H        LEU  54  -7.259   5.096 -17.592
  397    HA   LEU  54           HA       LEU  54  -8.477   7.403 -18.630
  398    HB2  LEU  54           HB2      LEU  54  -7.137   5.710 -19.835
  399    HB3  LEU  54           HB3      LEU  54  -8.440   4.554 -19.553
  400    HG   LEU  54           HG       LEU  54  -9.916   5.713 -21.099
  401   HD11  LEU  54          HD11      LEU  54  -7.387   7.297 -21.761
  402   HD12  LEU  54          HD12      LEU  54  -8.950   7.414 -22.601
  403   HD13  LEU  54          HD13      LEU  54  -8.796   8.000 -20.934
  404   HD21  LEU  54          HD21      LEU  54  -7.276   4.798 -22.170
  405   HD22  LEU  54          HD22      LEU  54  -8.676   3.799 -21.659
  406   HD23  LEU  54          HD23      LEU  54  -8.851   4.893 -23.039
  407    H    PHE  55           H        PHE  55  -9.884   4.197 -17.883
  408    HA   PHE  55           HA       PHE  55 -12.590   4.876 -18.376
  409    HB2  PHE  55           HB2      PHE  55 -12.298   2.627 -18.362
  410    HB3  PHE  55           HB3      PHE  55 -11.061   2.656 -17.126
  411    HD1  PHE  55           HD2      PHE  55 -14.748   2.770 -17.653
  412    HD2  PHE  55           HD1      PHE  55 -11.518   2.320 -14.847
  413    HE1  PHE  55           HE2      PHE  55 -16.372   2.050 -15.908
  414    HE2  PHE  55           HE1      PHE  55 -13.139   1.568 -13.096
  415    HZ   PHE  55           HZ       PHE  55 -15.563   1.420 -13.638
  416    H    GLU  56           H        GLU  56 -10.741   5.025 -15.245
  417    HA   GLU  56           HA       GLU  56 -12.998   5.926 -13.765
  418    HB2  GLU  56           HB2      GLU  56 -10.006   6.144 -13.231
  419    HB3  GLU  56           HB3      GLU  56 -11.247   6.638 -12.083
  420    HG2  GLU  56           HG2      GLU  56 -12.151   4.352 -11.996
  421    HG3  GLU  56           HG3      GLU  56 -10.925   3.806 -13.143
  422    H    GLU  57           H        GLU  57 -10.640   7.724 -15.716
  423    HA   GLU  57           HA       GLU  57 -11.522  10.246 -14.550
  424    HB2  GLU  57           HB2      GLU  57  -9.770  11.315 -15.614
  425    HB3  GLU  57           HB3      GLU  57  -9.148   9.878 -14.819
  426    HG2  GLU  57           HG2      GLU  57  -8.479   8.892 -16.830
  427    HG3  GLU  57           HG3      GLU  57  -9.684   9.755 -17.766
  428    H    VAL  58           H        VAL  58 -11.640   8.811 -17.907
  429    HA   VAL  58           HA       VAL  58 -13.755  10.786 -18.485
  430    HB   VAL  58           HB       VAL  58 -12.908  10.779 -20.760
  431   HG11  VAL  58          HG11      VAL  58 -10.802  11.676 -18.765
  432   HG12  VAL  58          HG12      VAL  58 -11.073  12.294 -20.406
  433   HG13  VAL  58          HG13      VAL  58 -12.302  12.550 -19.151
  434   HG21  VAL  58          HG21      VAL  58 -10.744   9.987 -21.401
  435   HG22  VAL  58          HG22      VAL  58 -10.405   9.393 -19.770
  436   HG23  VAL  58          HG23      VAL  58 -11.665   8.623 -20.744
  437    H    GLY  59           H        GLY  59 -13.455   7.532 -17.944
  438    HA2  GLY  59           HA2      GLY  59 -14.906   5.824 -18.399
  439    HA3  GLY  59           HA3      GLY  59 -16.038   7.018 -19.045
  440    H    LEU  60           H        LEU  60 -12.749   6.430 -20.207
  441    HA   LEU  60           HA       LEU  60 -13.783   5.264 -22.752
  442    HB2  LEU  60           HB2      LEU  60 -11.272   6.894 -22.221
  443    HB3  LEU  60           HB3      LEU  60 -11.560   5.997 -23.686
  444    HG   LEU  60           HG       LEU  60 -13.078   8.383 -22.619
  445   HD11  LEU  60          HD11      LEU  60 -11.430   7.993 -25.171
  446   HD12  LEU  60          HD12      LEU  60 -12.230   9.488 -24.683
  447   HD13  LEU  60          HD13      LEU  60 -10.896   8.855 -23.710
  448   HD21  LEU  60          HD21      LEU  60 -14.383   8.419 -24.742
  449   HD22  LEU  60          HD22      LEU  60 -13.783   6.792 -25.111
  450   HD23  LEU  60          HD23      LEU  60 -14.794   7.072 -23.680
  451    H    SER  61           H        SER  61 -12.629   3.382 -23.444
  452    HA   SER  61           HA       SER  61 -11.302   1.958 -21.171
  453    HB2  SER  61           HB2      SER  61 -13.060   0.962 -23.438
  454    HB3  SER  61           HB3      SER  61 -12.376  -0.039 -22.138
  455    HG   SER  61           HG       SER  61 -14.559   0.628 -21.707
  456    H    ARG  62           H        ARG  62 -10.176  -0.151 -22.274
  457    HA   ARG  62           HA       ARG  62  -7.879   0.861 -23.704
  458    HB2  ARG  62           HB2      ARG  62  -6.945  -1.392 -23.380
  459    HB3  ARG  62           HB3      ARG  62  -7.495  -0.650 -21.902
  460    HG2  ARG  62           HG2      ARG  62  -9.598  -2.070 -22.013
  461    HG3  ARG  62           HG3      ARG  62  -8.862  -2.901 -23.387
  462    HD2  ARG  62           HD2      ARG  62  -8.408  -4.221 -21.454
  463    HD3  ARG  62           HD3      ARG  62  -6.880  -3.443 -21.908
  464    HE   ARG  62           HE       ARG  62  -8.317  -1.881 -19.939
  465   HH11  ARG  62          HH11      ARG  62  -6.534  -4.947 -20.131
  466   HH12  ARG  62          HH12      ARG  62  -6.037  -4.919 -18.477
  467   HH21  ARG  62          HH21      ARG  62  -7.488  -1.761 -17.772
  468   HH22  ARG  62          HH22      ARG  62  -6.529  -3.040 -17.120
  469    H    LYS  63           H        LYS  63  -9.690   1.518 -25.240
  470    HA   LYS  63           HA       LYS  63  -9.192   0.106 -27.740
  471    HB2  LYS  63           HB2      LYS  63 -11.472  -0.546 -28.254
  472    HB3  LYS  63           HB3      LYS  63 -10.947  -1.326 -26.759
  473    HG2  LYS  63           HG2      LYS  63 -12.260   0.244 -25.413
  474    HG3  LYS  63           HG3      LYS  63 -12.712   1.157 -26.856
  475    HD2  LYS  63           HD2      LYS  63 -14.564  -0.212 -26.201
  476    HD3  LYS  63           HD3      LYS  63 -13.932  -0.784 -27.749
  477    HE2  LYS  63           HE2      LYS  63 -12.741  -2.636 -26.584
  478    HE3  LYS  63           HE3      LYS  63 -13.337  -2.046 -25.025
  479    HZ1  LYS  63           HZ1      LYS  63 -14.689  -3.862 -25.867
  480    HZ2  LYS  63           HZ2      LYS  63 -15.606  -2.514 -25.807
  481    HZ3  LYS  63           HZ3      LYS  63 -15.037  -3.062 -27.243
  482    H    ASP  64           H        ASP  64 -10.468   2.794 -25.900
  483    HA   ASP  64           HA       ASP  64 -11.654   4.124 -28.229
  484    HB2  ASP  64           HB2      ASP  64 -11.422   4.664 -25.276
  485    HB3  ASP  64           HB3      ASP  64 -12.177   5.819 -26.376
  486    H    VAL  65           H        VAL  65  -8.506   3.871 -27.249
  487    HA   VAL  65           HA       VAL  65  -7.797   6.521 -28.268
  488    HB   VAL  65           HB       VAL  65  -6.351   7.008 -26.368
  489   HG11  VAL  65          HG11      VAL  65  -7.982   7.829 -24.831
  490   HG12  VAL  65          HG12      VAL  65  -8.674   7.927 -26.459
  491   HG13  VAL  65          HG13      VAL  65  -9.187   6.636 -25.358
  492   HG21  VAL  65          HG21      VAL  65  -5.990   4.719 -25.467
  493   HG22  VAL  65          HG22      VAL  65  -6.576   5.820 -24.213
  494   HG23  VAL  65          HG23      VAL  65  -7.682   4.638 -24.962
  495    H    ARG  66           H        ARG  66  -5.306   6.637 -28.412
  496    HA   ARG  66           HA       ARG  66  -4.113   4.033 -29.271
  497    HB2  ARG  66           HB2      ARG  66  -5.185   4.928 -31.232
  498    HB3  ARG  66           HB3      ARG  66  -4.796   6.585 -30.795
  499    HG2  ARG  66           HG2      ARG  66  -3.492   6.038 -32.656
  500    HG3  ARG  66           HG3      ARG  66  -2.424   6.174 -31.273
  501    HD2  ARG  66           HD2      ARG  66  -3.476   3.423 -31.956
  502    HD3  ARG  66           HD3      ARG  66  -2.356   4.147 -33.112
  503    HE   ARG  66           HE       ARG  66  -0.949   4.521 -30.854
  504   HH11  ARG  66          HH11      ARG  66  -2.455   1.583 -32.211
  505   HH12  ARG  66          HH12      ARG  66  -1.231   0.534 -31.598
  506   HH21  ARG  66          HH21      ARG  66   0.638   3.172 -30.091
  507   HH22  ARG  66          HH22      ARG  66   0.581   1.458 -30.345
  508    H    ILE  67           H        ILE  67  -2.085   4.009 -28.196
  509    HA   ILE  67           HA       ILE  67  -1.030   6.459 -27.049
  510    HB   ILE  67           HB       ILE  67   0.197   3.690 -27.326
  511   HG12  ILE  67          HG12      ILE  67  -1.093   4.890 -24.837
  512   HG13  ILE  67          HG13      ILE  67  -2.018   3.894 -25.954
  513   HG21  ILE  67          HG21      ILE  67   0.952   6.071 -25.565
  514   HG22  ILE  67          HG22      ILE  67   1.704   4.461 -25.490
  515   HG23  ILE  67          HG23      ILE  67   1.896   5.431 -26.934
  516   HD11  ILE  67          HD11      ILE  67  -0.363   2.039 -25.648
  517   HD12  ILE  67          HD12      ILE  67   0.464   3.006 -24.404
  518   HD13  ILE  67          HD13      ILE  67  -1.199   2.479 -24.155
  519    H    LEU  68           H        LEU  68   0.255   7.892 -28.000
  520    HA   LEU  68           HA       LEU  68   1.575   7.118 -30.594
  521    HB2  LEU  68           HB2      LEU  68   0.243   9.604 -29.670
  522    HB3  LEU  68           HB3      LEU  68   1.828   9.874 -30.357
  523    HG   LEU  68           HG       LEU  68  -0.041  10.126 -31.957
  524   HD11  LEU  68          HD11      LEU  68   2.235   9.670 -32.791
  525   HD12  LEU  68          HD12      LEU  68   1.941   7.921 -32.700
  526   HD13  LEU  68          HD13      LEU  68   1.011   8.931 -33.829
  527   HD21  LEU  68          HD21      LEU  68  -1.234   8.232 -32.835
  528   HD22  LEU  68          HD22      LEU  68  -0.288   7.095 -31.863
  529   HD23  LEU  68          HD23      LEU  68  -1.416   8.219 -31.066
  530    H    ALA  69           H        ALA  69   2.134   8.276 -27.277
  531    HA   ALA  69           HA       ALA  69   4.977   7.708 -27.500
  532    HB1  ALA  69           HB1      ALA  69   5.658  10.049 -26.889
  533    HB2  ALA  69           HB2      ALA  69   4.903   9.990 -28.482
  534    HB3  ALA  69           HB3      ALA  69   3.975  10.586 -27.112
  535    H    SER  70           H        SER  70   6.014   8.059 -25.300
  536    HA   SER  70           HA       SER  70   4.236   8.636 -23.060
  537    HB2  SER  70           HB2      SER  70   5.143   6.634 -21.806
  538    HB3  SER  70           HB3      SER  70   3.945   6.297 -23.066
  539    HG   SER  70           HG       SER  70   5.698   4.833 -23.229
  540    H    THR  71           H        THR  71   5.598   9.173 -21.066
  541    HA   THR  71           HA       THR  71   7.855  10.738 -21.894
  542    HB   THR  71           HB       THR  71   8.237  10.881 -19.342
  543    HG1  THR  71           HG1      THR  71   7.124   9.238 -18.486
  544   HG21  THR  71          HG21      THR  71   6.273  12.379 -19.065
  545   HG22  THR  71          HG22      THR  71   7.123  12.647 -20.596
  546   HG23  THR  71          HG23      THR  71   5.599  11.752 -20.588
  547    H    ARG  72           H        ARG  72  10.050  10.383 -21.765
  548    HA   ARG  72           HA       ARG  72  10.837   7.755 -22.369
  549    HB2  ARG  72           HB2      ARG  72  12.416  10.242 -21.612
  550    HB3  ARG  72           HB3      ARG  72  13.220   8.718 -22.015
  551    HG2  ARG  72           HG2      ARG  72  12.142   8.633 -24.201
  552    HG3  ARG  72           HG3      ARG  72  11.230  10.108 -23.874
  553    HD2  ARG  72           HD2      ARG  72  14.274  10.002 -23.854
  554    HD3  ARG  72           HD3      ARG  72  13.328  10.342 -25.316
  555    HE   ARG  72           HE       ARG  72  12.250  12.185 -23.738
  556   HH11  ARG  72          HH11      ARG  72  15.733  11.465 -24.134
  557   HH12  ARG  72          HH12      ARG  72  16.206  13.100 -23.833
  558   HH21  ARG  72          HH21      ARG  72  12.819  14.189 -23.417
  559   HH22  ARG  72          HH22      ARG  72  14.491  14.748 -23.382
  560    H    ASN  73           H        ASN  73  10.684   9.271 -19.214
  561    HA   ASN  73           HA       ASN  73  11.028   6.686 -17.982
  562    HB2  ASN  73           HB2      ASN  73  12.687   9.077 -17.025
  563    HB3  ASN  73           HB3      ASN  73  12.426   7.590 -16.114
  564   HD21  ASN  73          HD22      ASN  73  14.328   9.025 -18.701
  565   HD22  ASN  73          HD21      ASN  73  15.292   7.601 -19.014
  566    H    TRP  74           H        TRP  74  10.391   7.117 -15.500
  567    HA   TRP  74           HA       TRP  74   7.851   8.482 -15.490
  568    HB2  TRP  74           HB2      TRP  74   9.499   7.487 -13.131
  569    HB3  TRP  74           HB3      TRP  74   7.793   7.928 -13.130
  570    HD1  TRP  74           HD1      TRP  74  10.152   5.236 -14.600
  571    HE1  TRP  74           HE1      TRP  74   8.839   3.151 -15.184
  572    HE3  TRP  74           HE3      TRP  74   5.479   6.767 -13.149
  573    HZ2  TRP  74           HZ2      TRP  74   6.090   2.309 -15.258
  574    HZ3  TRP  74           HZ3      TRP  74   3.521   5.305 -13.521
  575    HH2  TRP  74           HH2      TRP  74   3.773   3.132 -14.678
  576    H    LEU  75           H        LEU  75   7.412  10.538 -14.861
  577    HA   LEU  75           HA       LEU  75   9.625  12.345 -14.057
  578    HB2  LEU  75           HB2      LEU  75   7.061  12.676 -15.491
  579    HB3  LEU  75           HB3      LEU  75   7.151  13.753 -14.119
  580    HG   LEU  75           HG       LEU  75   7.936  14.889 -16.066
  581   HD11  LEU  75          HD11      LEU  75   9.970  15.815 -15.261
  582   HD12  LEU  75          HD12      LEU  75   9.090  15.289 -13.814
  583   HD13  LEU  75          HD13      LEU  75  10.447  14.325 -14.432
  584   HD21  LEU  75          HD21      LEU  75   8.670  12.964 -17.408
  585   HD22  LEU  75          HD22      LEU  75   9.918  14.226 -17.333
  586   HD23  LEU  75          HD23      LEU  75  10.086  12.750 -16.356
  587    H    ARG  76           H        ARG  76   9.457  13.583 -12.088
  588    HA   ARG  76           HA       ARG  76   7.198  13.097 -10.349
  589    HB2  ARG  76           HB2      ARG  76   8.570  12.415  -8.375
  590    HB3  ARG  76           HB3      ARG  76   8.431  11.183  -9.624
  591    HG2  ARG  76           HG2      ARG  76  10.678  11.624 -10.433
  592    HG3  ARG  76           HG3      ARG  76  10.858  13.005  -9.320
  593    HD2  ARG  76           HD2      ARG  76  10.617  11.495  -7.393
  594    HD3  ARG  76           HD3      ARG  76  10.432  10.107  -8.491
  595    HE   ARG  76           HE       ARG  76  12.832  11.382  -9.194
  596   HH11  ARG  76          HH12      ARG  76  11.560   9.677  -6.328
  597   HH12  ARG  76          HH11      ARG  76  13.100   9.071  -5.840
  598   HH21  ARG  76          HH21      ARG  76  14.878  10.595  -8.521
  599   HH22  ARG  76          HH22      ARG  76  15.030   9.628  -7.099
  600    H    TYR  77           H        TYR  77   7.288  14.511  -8.453
  601    HA   TYR  77           HA       TYR  77   9.203  16.727  -8.436
  602    HB2  TYR  77           HB2      TYR  77   7.264  18.374  -8.185
  603    HB3  TYR  77           HB3      TYR  77   7.577  17.777  -9.792
  604    HD1  TYR  77           HD2      TYR  77   5.435  16.821  -6.809
  605    HD2  TYR  77           HD1      TYR  77   5.721  17.258 -11.092
  606    HE1  TYR  77           HE2      TYR  77   3.180  15.929  -7.032
  607    HE2  TYR  77           HE1      TYR  77   3.405  16.417 -11.332
  608    HH   TYR  77           HH       TYR  77   1.450  15.318  -8.498
  609    H    LYS  78           H        LYS  78   8.525  18.054  -6.354
  610    HA   LYS  78           HA       LYS  78   7.822  16.108  -4.207
  611    HB2  LYS  78           HB2      LYS  78  10.076  17.406  -4.146
  612    HB3  LYS  78           HB3      LYS  78   9.115  18.850  -3.887
  613    HG2  LYS  78           HG2      LYS  78   9.761  18.190  -1.730
  614    HG3  LYS  78           HG3      LYS  78   8.085  17.692  -1.861
  615    HD2  LYS  78           HD2      LYS  78   9.337  15.961  -0.740
  616    HD3  LYS  78           HD3      LYS  78   8.788  15.355  -2.295
  617    HE2  LYS  78           HE2      LYS  78  11.034  14.580  -1.917
  618    HE3  LYS  78           HE3      LYS  78  11.055  15.717  -3.264
  619    HZ1  LYS  78           HZ1      LYS  78  11.945  17.405  -1.729
  620    HZ2  LYS  78           HZ2      LYS  78  11.871  16.357  -0.466
  621    HZ3  LYS  78           HZ3      LYS  78  12.889  16.079  -1.708
  622    H    LEU  79           H        LEU  79   5.880  16.439  -3.211
  623    HA   LEU  79           HA       LEU  79   4.025  18.491  -4.104
  624    HB2  LEU  79           HB2      LEU  79   4.042  16.555  -1.742
  625    HB3  LEU  79           HB3      LEU  79   2.701  17.648  -2.056
  626    HG   LEU  79           HG       LEU  79   3.641  15.528  -4.020
  627   HD11  LEU  79          HD11      LEU  79   1.728  14.172  -3.276
  628   HD12  LEU  79          HD12      LEU  79   2.831  14.468  -1.925
  629   HD13  LEU  79          HD13      LEU  79   1.316  15.394  -2.051
  630   HD21  LEU  79          HD21      LEU  79   1.436  15.852  -5.070
  631   HD22  LEU  79          HD22      LEU  79   1.036  17.098  -3.881
  632   HD23  LEU  79          HD23      LEU  79   2.336  17.375  -5.061
  633    HA   PRO  80           HA       PRO  80   5.415  21.611  -1.117
  634    HB2  PRO  80           HB2      PRO  80   3.176  23.135  -0.830
  635    HB3  PRO  80           HB3      PRO  80   4.099  23.119  -2.367
  636    HG2  PRO  80           HG2      PRO  80   1.724  21.382  -1.625
  637    HG3  PRO  80           HG3      PRO  80   1.861  22.484  -3.071
  638    HD2  PRO  80           HD2      PRO  80   2.425  19.873  -3.319
  639    HD3  PRO  80           HD3      PRO  80   3.527  21.072  -4.053
  640    H    LYS  81           H        LYS  81   5.068  21.982   1.209
  641    HA   LYS  81           HA       LYS  81   4.491  19.557   2.431
  642    HB2  LYS  81           HB2      LYS  81   4.672  22.314   3.744
  643    HB3  LYS  81           HB3      LYS  81   4.827  20.796   4.618
  644    HG2  LYS  81           HG2      LYS  81   6.707  21.672   2.376
  645    HG3  LYS  81           HG3      LYS  81   6.995  22.006   4.066
  646    HD2  LYS  81           HD2      LYS  81   6.621  19.171   3.014
  647    HD3  LYS  81           HD3      LYS  81   8.185  19.967   3.015
  648    HE2  LYS  81           HE2      LYS  81   6.515  19.577   5.544
  649    HE3  LYS  81           HE3      LYS  81   7.729  18.425   4.975
  650    HZ1  LYS  81           HZ1      LYS  81   8.298  21.236   5.756
  651    HZ2  LYS  81           HZ2      LYS  81   8.672  19.902   6.610
  652    HZ3  LYS  81           HZ3      LYS  81   9.409  20.174   5.181
  653    H    ARG  82           H        ARG  82   2.293  22.210   2.015
  654    HA   ARG  82           HA       ARG  82   0.288  21.241   3.824
  655    HB2  ARG  82           HB2      ARG  82  -1.129  22.964   2.882
  656    HB3  ARG  82           HB3      ARG  82   0.491  23.579   3.167
  657    HG2  ARG  82           HG2      ARG  82   0.790  22.898   0.534
  658    HG3  ARG  82           HG3      ARG  82  -0.961  23.068   0.570
  659    HD2  ARG  82           HD2      ARG  82  -0.020  25.168  -0.106
  660    HD3  ARG  82           HD3      ARG  82  -0.651  25.371   1.540
  661    HE   ARG  82           HE       ARG  82   2.132  24.617   1.622
  662   HH11  ARG  82          HH11      ARG  82   0.075  27.414   0.836
  663   HH12  ARG  82          HH12      ARG  82   1.273  28.592   1.236
  664   HH21  ARG  82          HH21      ARG  82   3.737  26.205   2.166
  665   HH22  ARG  82          HH22      ARG  82   3.391  27.886   1.988
  666    H    LEU  83           H        LEU  83   1.143  20.305   0.558
  667    HA   LEU  83           HA       LEU  83  -1.486  18.999   0.176
  668    HB2  LEU  83           HB2      LEU  83  -0.513  20.553  -1.571
  669    HB3  LEU  83           HB3      LEU  83   0.742  19.333  -1.833
  670    HG   LEU  83           HG       LEU  83  -0.956  17.711  -2.585
  671   HD11  LEU  83          HD11      LEU  83  -2.959  19.963  -2.077
  672   HD12  LEU  83          HD12      LEU  83  -3.300  18.495  -3.023
  673   HD13  LEU  83          HD13      LEU  83  -2.939  18.359  -1.308
  674   HD21  LEU  83          HD21      LEU  83  -1.519  18.838  -4.686
  675   HD22  LEU  83          HD22      LEU  83  -1.222  20.428  -3.944
  676   HD23  LEU  83          HD23      LEU  83   0.118  19.289  -4.171
  677    H    VAL  84           H        VAL  84   1.887  18.260   0.863
  678    HA   VAL  84           HA       VAL  84   2.039  15.527   0.323
  679    HB   VAL  84           HB       VAL  84   2.982  17.118   2.748
  680   HG11  VAL  84          HG11      VAL  84   4.545  15.257   3.250
  681   HG12  VAL  84          HG12      VAL  84   2.871  14.767   3.482
  682   HG13  VAL  84          HG13      VAL  84   3.744  14.252   2.025
  683   HG21  VAL  84          HG21      VAL  84   5.177  17.020   1.717
  684   HG22  VAL  84          HG22      VAL  84   4.574  15.980   0.417
  685   HG23  VAL  84          HG23      VAL  84   4.045  17.666   0.528
  686    H    ARG  85           H        ARG  85   1.230  13.718   1.265
  687    HA   ARG  85           HA       ARG  85  -1.461  14.124   2.235
  688    HB2  ARG  85           HB2      ARG  85  -0.042  11.441   1.977
  689    HB3  ARG  85           HB3      ARG  85  -1.774  11.740   2.012
  690    HG2  ARG  85           HG2      ARG  85   0.190  12.330  -0.222
  691    HG3  ARG  85           HG3      ARG  85  -1.213  11.268  -0.245
  692    HD2  ARG  85           HD2      ARG  85  -1.169  14.298  -0.233
  693    HD3  ARG  85           HD3      ARG  85  -1.675  13.253  -1.551
  694    HE   ARG  85           HE       ARG  85  -3.503  12.446   0.028
  695   HH11  ARG  85          HH11      ARG  85  -2.288  15.814   0.108
  696   HH12  ARG  85          HH12      ARG  85  -3.776  16.454   0.725
  697   HH21  ARG  85          HH21      ARG  85  -5.462  13.334   0.814
  698   HH22  ARG  85          HH22      ARG  85  -5.621  15.025   1.105
  699    H    TRP  86           H        TRP  86   1.414  12.929   3.822
  700    HA   TRP  86           HA       TRP  86   1.972  12.200   5.880
  701    HB2  TRP  86           HB2      TRP  86  -0.190  14.035   6.876
  702    HB3  TRP  86           HB3      TRP  86   1.226  13.478   7.761
  703    HD1  TRP  86           HD1      TRP  86   0.115  15.968   5.180
  704    HE1  TRP  86           HE1      TRP  86   1.924  17.734   4.741
  705    HE3  TRP  86           HE3      TRP  86   3.954  13.752   7.711
  706    HZ2  TRP  86           HZ2      TRP  86   4.726  18.087   5.381
  707    HZ3  TRP  86           HZ3      TRP  86   6.206  14.785   7.732
  708    HH2  TRP  86           HH2      TRP  86   6.608  16.947   6.580
  709    H    ASP  87           H        ASP  87  -0.663  11.080   4.549
  710    HA   ASP  87           HA       ASP  87  -1.630   9.512   6.915
  711    HB2  ASP  87           HB2      ASP  87  -3.166  11.219   6.045
  712    HB3  ASP  87           HB3      ASP  87  -3.102  10.473   4.444
  713    H    THR  88           H        THR  88  -0.179   9.155   3.740
  714    HA   THR  88           HA       THR  88  -1.558   6.776   2.989
  715    HB   THR  88           HB       THR  88   0.462   6.758   1.327
  716    HG1  THR  88           HG1      THR  88   1.919   8.041   2.130
  717   HG21  THR  88          HG21      THR  88  -0.471   8.658   0.054
  718   HG22  THR  88          HG22      THR  88  -1.770   7.648   0.706
  719   HG23  THR  88          HG23      THR  88  -1.371   9.188   1.492
  720    H    LYS  89           H        LYS  89   1.466   7.381   4.657
  721    HA   LYS  89           HA       LYS  89   3.076   6.083   5.659
  722    HB2  LYS  89           HB2      LYS  89   0.563   4.629   6.487
  723    HB3  LYS  89           HB3      LYS  89   2.176   4.310   7.153
  724    HG2  LYS  89           HG2      LYS  89   2.392   6.686   7.832
  725    HG3  LYS  89           HG3      LYS  89   0.808   7.044   7.140
  726    HD2  LYS  89           HD2      LYS  89   0.631   6.867   9.522
  727    HD3  LYS  89           HD3      LYS  89  -0.272   5.540   8.763
  728    HE2  LYS  89           HE2      LYS  89   1.599   3.983   9.256
  729    HE3  LYS  89           HE3      LYS  89   2.536   5.311   9.954
  730    HZ1  LYS  89           HZ1      LYS  89   1.437   4.006  11.664
  731    HZ2  LYS  89           HZ2      LYS  89   0.828   5.519  11.678
  732    HZ3  LYS  89           HZ3      LYS  89  -0.039   4.287  11.028
  733    HA   PRO  90           HA       PRO  90   5.156   5.664   4.802
  734    HB2  PRO  90           HB2      PRO  90   5.757   5.577   1.853
  735    HB3  PRO  90           HB3      PRO  90   6.882   5.575   3.246
  736    HG2  PRO  90           HG2      PRO  90   6.324   3.278   1.937
  737    HG3  PRO  90           HG3      PRO  90   6.412   3.296   3.731
  738    HD2  PRO  90           HD2      PRO  90   3.944   3.361   1.975
  739    HD3  PRO  90           HD3      PRO  90   4.257   2.417   3.455
  740    H    VAL  91           H        VAL  91   5.290   7.917   4.713
  741    HA   VAL  91           HA       VAL  91   3.084   9.456   3.856
  742    HB   VAL  91           HB       VAL  91   5.941  10.221   4.620
  743   HG11  VAL  91          HG11      VAL  91   5.039  12.096   3.367
  744   HG12  VAL  91          HG12      VAL  91   3.505  12.017   4.253
  745   HG13  VAL  91          HG13      VAL  91   5.000  12.499   5.083
  746   HG21  VAL  91          HG21      VAL  91   3.335  10.210   6.213
  747   HG22  VAL  91          HG22      VAL  91   4.715   9.124   6.453
  748   HG23  VAL  91          HG23      VAL  91   4.889  10.845   6.788
  749    H    CYS  92           H        CYS  92   2.545  10.100   1.889
  750    HA   CYS  92           HA       CYS  92   4.342   9.549  -0.360
  751    HB2  CYS  92           HB2      CYS  92   2.085   8.702  -0.378
  752    HB3  CYS  92           HB3      CYS  92   1.413  10.325  -0.134
  753    HG   CYS  92           HG       CYS  92   1.008   9.641  -2.627
  754    H    ILE  93           H        ILE  93   5.594  11.058  -1.150
  755    HA   ILE  93           HA       ILE  93   5.045  13.926  -0.561
  756    HB   ILE  93           HB       ILE  93   7.474  14.223  -0.498
  757   HG12  ILE  93          HG12      ILE  93   7.655  11.185  -0.737
  758   HG13  ILE  93          HG13      ILE  93   8.189  12.357  -1.947
  759   HG21  ILE  93          HG21      ILE  93   6.092  13.762   1.549
  760   HG22  ILE  93          HG22      ILE  93   6.612  12.062   1.455
  761   HG23  ILE  93          HG23      ILE  93   7.796  13.353   1.718
  762   HD11  ILE  93          HD11      ILE  93  10.101  11.533  -0.751
  763   HD12  ILE  93          HD12      ILE  93   9.852  13.223  -0.258
  764   HD13  ILE  93          HD13      ILE  93   9.364  11.887   0.817
  765    H    GLY  94           H        GLY  94   5.034  11.761  -3.192
  766    HA2  GLY  94           HA2      GLY  94   4.788  13.961  -5.020
  767    HA3  GLY  94           HA3      GLY  94   6.336  13.145  -5.227
  768    H    GLN  95           H        GLN  95   4.128  13.240  -7.129
  769    HA   GLN  95           HA       GLN  95   3.160  10.420  -7.172
  770    HB2  GLN  95           HB2      GLN  95   2.719  12.619  -9.221
  771    HB3  GLN  95           HB3      GLN  95   1.937  11.057  -9.175
  772    HG2  GLN  95           HG2      GLN  95   1.496  13.433  -7.338
  773    HG3  GLN  95           HG3      GLN  95   0.379  12.756  -8.532
  774   HE21  GLN  95          HE22      GLN  95  -0.605  13.253  -5.981
  775   HE22  GLN  95          HE21      GLN  95  -0.834  11.736  -5.145
  776    H    LYS  96           H        LYS  96   4.307   8.900  -8.297
  777    HA   LYS  96           HA       LYS  96   6.644   9.669  -9.997
  778    HB2  LYS  96           HB2      LYS  96   7.264   7.889  -8.557
  779    HB3  LYS  96           HB3      LYS  96   5.689   7.109  -8.636
  780    HG2  LYS  96           HG2      LYS  96   6.090   6.371 -10.919
  781    HG3  LYS  96           HG3      LYS  96   7.622   7.269 -10.979
  782    HD2  LYS  96           HD2      LYS  96   8.605   5.797  -9.324
  783    HD3  LYS  96           HD3      LYS  96   7.047   4.979  -9.057
  784    HE2  LYS  96           HE2      LYS  96   7.030   4.130 -11.370
  785    HE3  LYS  96           HE3      LYS  96   8.496   5.043 -11.756
  786    HZ1  LYS  96           HZ1      LYS  96   9.752   3.657 -10.260
  787    HZ2  LYS  96           HZ2      LYS  96   8.424   2.867  -9.724
  788    HZ3  LYS  96           HZ3      LYS  96   8.931   2.677 -11.277
  789    H    GLN  97           H        GLN  97   5.968  10.125 -12.104
  790    HA   GLN  97           HA       GLN  97   3.293   9.041 -12.964
  791    HB2  GLN  97           HB2      GLN  97   4.666  11.653 -13.689
  792    HB3  GLN  97           HB3      GLN  97   3.055  11.156 -14.182
  793    HG2  GLN  97           HG2      GLN  97   2.103  11.824 -12.213
  794    HG3  GLN  97           HG3      GLN  97   3.470  11.323 -11.229
  795   HE21  GLN  97          HE22      GLN  97   4.952  12.882 -10.549
  796   HE22  GLN  97          HE21      GLN  97   4.897  14.551 -11.105
  797    H    LYS  98           H        LYS  98   3.373   7.708 -14.790
  798    HA   LYS  98           HA       LYS  98   5.471   8.405 -16.841
  799    HB2  LYS  98           HB2      LYS  98   5.615   6.043 -16.286
  800    HB3  LYS  98           HB3      LYS  98   3.867   5.829 -16.532
  801    HG2  LYS  98           HG2      LYS  98   4.116   6.429 -18.906
  802    HG3  LYS  98           HG3      LYS  98   5.830   6.778 -18.684
  803    HD2  LYS  98           HD2      LYS  98   4.624   4.042 -18.110
  804    HD3  LYS  98           HD3      LYS  98   5.177   4.527 -19.727
  805    HE2  LYS  98           HE2      LYS  98   7.445   5.046 -18.786
  806    HE3  LYS  98           HE3      LYS  98   6.918   4.420 -17.216
  807    HZ1  LYS  98           HZ1      LYS  98   6.581   2.242 -18.284
  808    HZ2  LYS  98           HZ2      LYS  98   7.057   2.835 -19.736
  809    HZ3  LYS  98           HZ3      LYS  98   8.119   2.742 -18.504
  810    H    TRP  99           H        TRP  99   4.562   9.924 -18.139
  811    HA   TRP  99           HA       TRP  99   1.596  10.070 -18.282
  812    HB2  TRP  99           HB2      TRP  99   3.786  11.921 -19.241
  813    HB3  TRP  99           HB3      TRP  99   2.094  12.120 -19.634
  814    HD1  TRP  99           HD1      TRP  99   4.419  12.233 -16.558
  815    HE1  TRP  99           HE1      TRP  99   3.365  13.790 -14.798
  816    HE3  TRP  99           HE3      TRP  99  -0.121  13.046 -18.765
  817    HZ2  TRP  99           HZ2      TRP  99   0.948  15.319 -14.482
  818    HZ3  TRP  99           HZ3      TRP  99  -1.727  14.653 -17.783
  819    HH2  TRP  99           HH2      TRP  99  -1.244  15.734 -15.598
  820    H    PHE 100           H        PHE 100   0.507   9.630 -20.191
  821    HA   PHE 100           HA       PHE 100   2.126   8.449 -22.419
  822    HB2  PHE 100           HB2      PHE 100  -0.554   7.569 -21.300
  823    HB3  PHE 100           HB3      PHE 100   0.058   7.118 -22.883
  824    HD1  PHE 100           HD2      PHE 100   0.791   6.780 -19.218
  825    HD2  PHE 100           HD1      PHE 100   1.572   5.342 -23.210
  826    HE1  PHE 100           HE2      PHE 100   1.875   4.755 -18.285
  827    HE2  PHE 100           HE1      PHE 100   2.691   3.349 -22.276
  828    HZ   PHE 100           HZ       PHE 100   2.812   3.022 -19.814
  829    H    LEU 101           H        LEU 101   1.738   9.346 -24.360
  830    HA   LEU 101           HA       LEU 101  -0.257  11.508 -24.620
  831    HB2  LEU 101           HB2      LEU 101   1.879  11.955 -25.675
  832    HB3  LEU 101           HB3      LEU 101   1.868  10.369 -26.455
  833    HG   LEU 101           HG       LEU 101  -0.080  11.033 -27.845
  834   HD11  LEU 101          HD11      LEU 101   0.276  13.801 -26.640
  835   HD12  LEU 101          HD12      LEU 101  -0.835  13.308 -27.942
  836   HD13  LEU 101          HD13      LEU 101  -1.093  12.708 -26.320
  837   HD21  LEU 101          HD21      LEU 101   1.126  12.544 -29.326
  838   HD22  LEU 101          HD22      LEU 101   2.242  12.993 -28.024
  839   HD23  LEU 101          HD23      LEU 101   2.246  11.344 -28.656
  840    H    LEU 102           H        LEU 102  -2.254  10.924 -25.137
  841    HA   LEU 102           HA       LEU 102  -2.701   8.422 -26.679
  842    HB2  LEU 102           HB2      LEU 102  -4.224   9.708 -24.384
  843    HB3  LEU 102           HB3      LEU 102  -5.109   8.780 -25.576
  844    HG   LEU 102           HG       LEU 102  -4.673   7.357 -23.746
  845   HD11  LEU 102          HD11      LEU 102  -3.865   5.488 -24.921
  846   HD12  LEU 102          HD12      LEU 102  -4.231   6.599 -26.281
  847   HD13  LEU 102          HD13      LEU 102  -2.593   6.413 -25.712
  848   HD21  LEU 102          HD21      LEU 102  -2.647   8.586 -22.868
  849   HD22  LEU 102          HD22      LEU 102  -2.484   6.822 -22.884
  850   HD23  LEU 102          HD23      LEU 102  -1.685   7.796 -24.126
  851    H    GLN 103           H        GLN 103  -3.556   8.645 -28.618
  852    HA   GLN 103           HA       GLN 103  -4.788  11.291 -29.322
  853    HB2  GLN 103           HB2      GLN 103  -3.980   8.904 -31.031
  854    HB3  GLN 103           HB3      GLN 103  -4.940  10.257 -31.633
  855    HG2  GLN 103           HG2      GLN 103  -2.141  10.492 -30.434
  856    HG3  GLN 103           HG3      GLN 103  -2.516  10.492 -32.155
  857   HE21  GLN 103          HE22      GLN 103  -1.072  12.637 -30.836
  858   HE22  GLN 103          HE21      GLN 103  -2.129  14.043 -30.956
  859    H    LEU 104           H        LEU 104  -6.974  11.459 -29.345
  860    HA   LEU 104           HA       LEU 104  -8.618   9.322 -28.320
  861    HB2  LEU 104           HB2      LEU 104  -9.338  11.802 -29.932
  862    HB3  LEU 104           HB3      LEU 104 -10.561  10.674 -29.341
  863    HG   LEU 104           HG       LEU 104  -8.561  11.882 -27.468
  864   HD11  LEU 104          HD11      LEU 104 -10.226  13.662 -26.911
  865   HD12  LEU 104          HD12      LEU 104  -9.617  13.785 -28.575
  866   HD13  LEU 104          HD13      LEU 104 -11.232  13.109 -28.269
  867   HD21  LEU 104          HD21      LEU 104  -9.979   9.969 -26.644
  868   HD22  LEU 104          HD22      LEU 104 -10.212  11.465 -25.726
  869   HD23  LEU 104          HD23      LEU 104 -11.406  10.978 -26.928
  870    H    VAL 105           H        VAL 105  -9.654   7.667 -29.265
  871    HA   VAL 105           HA       VAL 105  -9.725   7.498 -32.246
  872    HB   VAL 105           HB       VAL 105  -9.678   5.254 -30.194
  873   HG11  VAL 105          HG11      VAL 105  -9.489   3.740 -32.130
  874   HG12  VAL 105          HG12      VAL 105 -11.025   4.608 -32.136
  875   HG13  VAL 105          HG13      VAL 105  -9.721   5.115 -33.234
  876   HG21  VAL 105          HG21      VAL 105  -7.492   4.685 -31.124
  877   HG22  VAL 105          HG22      VAL 105  -7.571   6.061 -32.248
  878   HG23  VAL 105          HG23      VAL 105  -7.435   6.340 -30.504
  879    H    SER 106           H        SER 106 -11.415   7.415 -29.124
  880    HA   SER 106           HA       SER 106 -13.988   7.797 -30.581
  881    HB2  SER 106           HB2      SER 106 -13.682   6.609 -27.809
  882    HB3  SER 106           HB3      SER 106 -15.133   6.684 -28.810
  883    HG   SER 106           HG       SER 106 -13.944   4.651 -28.601
  884    H    GLY 107           H        GLY 107 -14.619   9.897 -30.258
  885    HA2  GLY 107           HA2      GLY 107 -12.933  11.609 -28.631
  886    HA3  GLY 107           HA3      GLY 107 -14.227  12.091 -29.727
  887    H    ASP 108           H        ASP 108 -14.554  13.666 -27.941
  888    HA   ASP 108           HA       ASP 108 -15.562  13.227 -25.456
  889    HB2  ASP 108           HB2      ASP 108 -16.471  15.326 -25.521
  890    HB3  ASP 108           HB3      ASP 108 -15.160  15.436 -26.684
  891    H    ALA 109           H        ALA 109 -17.278  12.611 -28.512
  892    HA   ALA 109           HA       ALA 109 -19.913  12.462 -27.494
  893    HB1  ALA 109           HB1      ALA 109 -19.351  12.572 -29.906
  894    HB2  ALA 109           HB2      ALA 109 -18.650  10.935 -29.816
  895    HB3  ALA 109           HB3      ALA 109 -20.386  11.177 -29.543
  896    H    GLU 110           H        GLU 110 -17.236  10.184 -27.193
  897    HA   GLU 110           HA       GLU 110 -19.042   8.095 -26.160
  898    HB2  GLU 110           HB2      GLU 110 -16.246   7.868 -27.292
  899    HB3  GLU 110           HB3      GLU 110 -17.196   6.532 -26.651
  900    HG2  GLU 110           HG2      GLU 110 -17.792   8.176 -29.141
  901    HG3  GLU 110           HG3      GLU 110 -17.313   6.484 -29.071
  902    H    ILE 111           H        ILE 111 -16.803  10.479 -25.209
  903    HA   ILE 111           HA       ILE 111 -15.719   9.227 -22.845
  904    HB   ILE 111           HB       ILE 111 -16.087  12.002 -23.883
  905   HG12  ILE 111          HG12      ILE 111 -13.719  10.418 -22.916
  906   HG13  ILE 111          HG13      ILE 111 -14.168  10.774 -24.590
  907   HG21  ILE 111          HG21      ILE 111 -15.272  13.105 -21.899
  908   HG22  ILE 111          HG22      ILE 111 -16.755  12.270 -21.512
  909   HG23  ILE 111          HG23      ILE 111 -15.191  11.560 -21.018
  910   HD11  ILE 111          HD11      ILE 111 -13.065  12.688 -22.508
  911   HD12  ILE 111          HD12      ILE 111 -12.337  12.183 -24.038
  912   HD13  ILE 111          HD13      ILE 111 -13.776  13.223 -24.054
  913    H    ASN 112           H        ASN 112 -16.624   8.919 -20.901
  914    HA   ASN 112           HA       ASN 112 -19.407   9.770 -20.340
  915    HB2  ASN 112           HB2      ASN 112 -19.467   7.597 -21.640
  916    HB3  ASN 112           HB3      ASN 112 -18.569   6.846 -20.317
  917   HD21  ASN 112          HD22      ASN 112 -19.663   6.992 -18.083
  918   HD22  ASN 112          HD21      ASN 112 -21.423   6.899 -18.046
  919    H    MET 113           H        MET 113 -17.675  10.998 -19.107
  920    HA   MET 113           HA       MET 113 -15.826  10.075 -17.352
  921    HB2  MET 113           HB2      MET 113 -17.680  12.476 -16.996
  922    HB3  MET 113           HB3      MET 113 -16.225  12.199 -16.035
  923    HG2  MET 113           HG2      MET 113 -14.787  12.426 -17.900
  924    HG3  MET 113           HG3      MET 113 -16.130  12.435 -19.053
  925    HE1  MET 113           HE1      MET 113 -14.560  14.476 -20.019
  926    HE2  MET 113           HE2      MET 113 -14.303  15.990 -19.123
  927    HE3  MET 113           HE3      MET 113 -13.518  14.499 -18.577
  928    H    GLN 114           H        GLN 114 -19.306   9.805 -16.694
  929    HA   GLN 114           HA       GLN 114 -18.782   9.481 -13.816
  930    HB2  GLN 114           HB2      GLN 114 -21.436   9.631 -15.299
  931    HB3  GLN 114           HB3      GLN 114 -21.221   9.593 -13.545
  932    HG2  GLN 114           HG2      GLN 114 -19.925  11.747 -13.687
  933    HG3  GLN 114           HG3      GLN 114 -20.251  11.798 -15.420
  934   HE21  GLN 114          HE22      GLN 114 -21.871  11.832 -12.185
  935   HE22  GLN 114          HE21      GLN 114 -23.311  12.645 -12.742
  936    H    THR 115           H        THR 115 -17.869   7.498 -15.760
  937    HA   THR 115           HA       THR 115 -19.281   5.067 -15.678
  938    HB   THR 115           HB       THR 115 -16.603   4.376 -15.543
  939    HG1  THR 115           HG1      THR 115 -15.349   6.014 -16.124
  940   HG21  THR 115          HG21      THR 115 -16.624   4.368 -17.986
  941   HG22  THR 115          HG22      THR 115 -18.197   3.841 -17.382
  942   HG23  THR 115          HG23      THR 115 -17.996   5.490 -18.016
  943    H    SER 116           H        SER 116 -16.918   6.448 -13.353
  944    HA   SER 116           HA       SER 116 -17.156   4.098 -11.643
  945    HB2  SER 116           HB2      SER 116 -15.404   6.559 -11.492
  946    HB3  SER 116           HB3      SER 116 -15.164   5.051 -10.582
  947    HG   SER 116           HG       SER 116 -14.835   3.963 -12.547
  948    H    SER 117           H        SER 117 -19.187   6.505 -11.795
  949    HA   SER 117           HA       SER 117 -20.778   7.401 -10.549
  950    HB2  SER 117           HB2      SER 117 -19.952   5.543  -8.304
  951    HB3  SER 117           HB3      SER 117 -21.519   6.338  -8.530
  952    HG   SER 117           HG       SER 117 -21.525   4.145  -9.281
  953    H    THR 118           H        THR 118 -17.713   7.288  -8.708
  954    HA   THR 118           HA       THR 118 -18.096  10.178  -8.083
  955    HB   THR 118           HB       THR 118 -16.671   9.700  -6.039
  956    HG1  THR 118           HG1      THR 118 -16.005   7.573  -6.470
  957   HG21  THR 118          HG21      THR 118 -19.117  10.156  -5.923
  958   HG22  THR 118          HG22      THR 118 -19.444   8.422  -6.094
  959   HG23  THR 118          HG23      THR 118 -18.582   9.029  -4.662
  960    HA   PRO 119           HA       PRO 119 -14.496   9.184 -10.852
  961    HB2  PRO 119           HB2      PRO 119 -15.058  10.735 -12.982
  962    HB3  PRO 119           HB3      PRO 119 -16.063   9.304 -12.601
  963    HG2  PRO 119           HG2      PRO 119 -16.611  12.195 -11.774
  964    HG3  PRO 119           HG3      PRO 119 -17.682  11.121 -12.728
  965    HD2  PRO 119           HD2      PRO 119 -17.908  11.303 -10.020
  966    HD3  PRO 119           HD3      PRO 119 -18.129   9.743 -10.874
  967    H    GLU 120           H        GLU 120 -13.126  11.158 -12.178
  968    HA   GLU 120           HA       GLU 120 -12.721  13.340 -10.173
  969    HB2  GLU 120           HB2      GLU 120 -10.726  12.212 -12.160
  970    HB3  GLU 120           HB3      GLU 120 -10.504  13.661 -11.168
  971    HG2  GLU 120           HG2      GLU 120 -11.180  12.068  -9.162
  972    HG3  GLU 120           HG3      GLU 120 -10.713  10.784 -10.272
  973    H    PHE 121           H        PHE 121 -13.918  12.794 -13.455
  974    HA   PHE 121           HA       PHE 121 -13.798  15.757 -13.768
  975    HB2  PHE 121           HB2      PHE 121 -13.527  13.679 -15.935
  976    HB3  PHE 121           HB3      PHE 121 -13.674  15.409 -16.185
  977    HD1  PHE 121           HD1      PHE 121 -11.889  16.681 -14.263
  978    HD2  PHE 121           HD2      PHE 121 -11.327  13.089 -16.585
  979    HE1  PHE 121           HE1      PHE 121  -9.449  17.010 -14.184
  980    HE2  PHE 121           HE2      PHE 121  -8.871  13.437 -16.503
  981    HZ   PHE 121           HZ       PHE 121  -7.938  15.404 -15.316
  982    H    ASP 122           H        ASP 122 -15.389  16.746 -14.944
  983    HA   ASP 122           HA       ASP 122 -18.083  15.462 -14.783
  984    HB2  ASP 122           HB2      ASP 122 -17.724  16.688 -12.779
  985    HB3  ASP 122           HB3      ASP 122 -17.006  18.052 -13.633
  986    H    GLY 123           H        GLY 123 -15.937  17.737 -16.524
  987    HA2  GLY 123           HA2      GLY 123 -17.690  17.570 -18.830
  988    HA3  GLY 123           HA3      GLY 123 -17.564  19.216 -18.174
  989    H    TRP 124           H        TRP 124 -16.586  18.105 -20.752
  990    HA   TRP 124           HA       TRP 124 -13.638  18.226 -20.454
  991    HB2  TRP 124           HB2      TRP 124 -13.584  17.288 -22.685
  992    HB3  TRP 124           HB3      TRP 124 -14.603  16.289 -21.657
  993    HD1  TRP 124           HD1      TRP 124 -17.255  16.296 -22.182
  994    HE1  TRP 124           HE1      TRP 124 -18.645  17.039 -24.188
  995    HE3  TRP 124           HE3      TRP 124 -13.637  18.830 -24.780
  996    HZ2  TRP 124           HZ2      TRP 124 -18.268  18.630 -26.591
  997    HZ3  TRP 124           HZ3      TRP 124 -14.183  19.943 -26.929
  998    HH2  TRP 124           HH2      TRP 124 -16.494  19.855 -27.835
  999    H    ARG 125           H        ARG 125 -12.405  19.612 -21.733
 1000    HA   ARG 125           HA       ARG 125 -13.610  21.439 -23.692
 1001    HB2  ARG 125           HB2      ARG 125 -13.856  22.709 -21.565
 1002    HB3  ARG 125           HB3      ARG 125 -12.151  22.423 -21.192
 1003    HG2  ARG 125           HG2      ARG 125 -11.557  23.756 -23.263
 1004    HG3  ARG 125           HG3      ARG 125 -13.277  24.161 -23.425
 1005    HD2  ARG 125           HD2      ARG 125 -13.274  25.254 -21.241
 1006    HD3  ARG 125           HD3      ARG 125 -11.638  24.659 -20.906
 1007    HE   ARG 125           HE       ARG 125 -12.009  26.390 -23.273
 1008   HH11  ARG 125          HH11      ARG 125 -11.075  26.329 -19.830
 1009   HH12  ARG 125          HH12      ARG 125  -9.978  27.666 -19.969
 1010   HH21  ARG 125          HH21      ARG 125 -10.653  28.242 -23.406
 1011   HH22  ARG 125          HH22      ARG 125  -9.819  28.826 -22.012
 1012    H    TRP 126           H        TRP 126 -12.126  20.889 -25.461
 1013    HA   TRP 126           HA       TRP 126  -9.362  20.261 -24.708
 1014    HB2  TRP 126           HB2      TRP 126 -10.426  20.627 -27.505
 1015    HB3  TRP 126           HB3      TRP 126  -8.991  19.748 -26.985
 1016    HD1  TRP 126           HD1      TRP 126 -11.973  18.891 -28.479
 1017    HE1  TRP 126           HE1      TRP 126 -13.161  16.803 -27.660
 1018    HE3  TRP 126           HE3      TRP 126  -9.445  18.195 -24.065
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.111  15.080 -25.332
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.132  16.384 -22.519
 1021    HH2  TRP 126           HH2      TRP 126 -11.987  14.858 -23.119
 1022    H    VAL 127           H        VAL 127  -7.643  21.621 -24.826
 1023    HA   VAL 127           HA       VAL 127  -8.188  24.491 -25.440
 1024    HB   VAL 127           HB       VAL 127  -6.779  24.977 -23.439
 1025   HG11  VAL 127          HG11      VAL 127  -8.520  24.668 -21.790
 1026   HG12  VAL 127          HG12      VAL 127  -9.264  25.056 -23.348
 1027   HG13  VAL 127          HG13      VAL 127  -9.269  23.382 -22.750
 1028   HG21  VAL 127          HG21      VAL 127  -7.138  22.011 -22.789
 1029   HG22  VAL 127          HG22      VAL 127  -5.613  22.816 -23.216
 1030   HG23  VAL 127          HG23      VAL 127  -6.462  23.244 -21.719
 1031    H    SER 128           H        SER 128  -6.196  25.784 -25.830
 1032    HA   SER 128           HA       SER 128  -4.550  24.730 -27.779
 1033    HB2  SER 128           HB2      SER 128  -3.722  26.909 -25.832
 1034    HB3  SER 128           HB3      SER 128  -3.167  26.678 -27.490
 1035    HG   SER 128           HG       SER 128  -4.828  28.287 -27.380
 1036    H    TYR 129           H        TYR 129  -2.338  24.087 -27.842
 1037    HA   TYR 129           HA       TYR 129  -1.493  22.365 -25.715
 1038    HB2  TYR 129           HB2      TYR 129  -0.950  22.499 -28.327
 1039    HB3  TYR 129           HB3      TYR 129   0.388  23.513 -27.777
 1040    HD1  TYR 129           HD1      TYR 129   2.142  22.501 -26.315
 1041    HD2  TYR 129           HD2      TYR 129  -1.076  20.148 -27.937
 1042    HE1  TYR 129           HE1      TYR 129   3.426  20.450 -25.839
 1043    HE2  TYR 129           HE2      TYR 129   0.119  18.072 -27.286
 1044    HH   TYR 129           HH       TYR 129   3.394  18.131 -25.824
 1045    H    TRP 130           H        TRP 130   0.272  22.789 -24.246
 1046    HA   TRP 130           HA       TRP 130   1.210  23.901 -22.573
 1047    HB2  TRP 130           HB2      TRP 130   1.276  26.522 -23.993
 1048    HB3  TRP 130           HB3      TRP 130   2.405  25.847 -22.839
 1049    HD1  TRP 130           HD1      TRP 130   1.724  26.245 -26.442
 1050    HE1  TRP 130           HE1      TRP 130   3.298  24.954 -27.921
 1051    HE3  TRP 130           HE3      TRP 130   3.995  23.434 -22.829
 1052    HZ2  TRP 130           HZ2      TRP 130   5.576  23.093 -27.542
 1053    HZ3  TRP 130           HZ3      TRP 130   5.890  21.917 -23.411
 1054    HH2  TRP 130           HH2      TRP 130   6.672  21.749 -25.750
 1055    H    TYR 131           H        TYR 131  -1.967  24.950 -23.553
 1056    HA   TYR 131           HA       TYR 131  -2.233  27.104 -21.751
 1057    HB2  TYR 131           HB2      TYR 131  -3.814  26.810 -23.496
 1058    HB3  TYR 131           HB3      TYR 131  -4.360  25.275 -22.880
 1059    HD1  TYR 131           HD1      TYR 131  -5.727  25.124 -20.780
 1060    HD2  TYR 131           HD2      TYR 131  -4.639  28.908 -22.549
 1061    HE1  TYR 131           HE1      TYR 131  -7.579  26.204 -19.580
 1062    HE2  TYR 131           HE2      TYR 131  -6.467  30.013 -21.300
 1063    HH   TYR 131           HH       TYR 131  -8.255  29.733 -19.793
 1064    HA   PRO 132           HA       PRO 132  -3.730  24.063 -18.296
 1065    HB2  PRO 132           HB2      PRO 132  -2.216  21.588 -19.147
 1066    HB3  PRO 132           HB3      PRO 132  -3.719  21.710 -18.221
 1067    HG2  PRO 132           HG2      PRO 132  -3.826  21.077 -20.820
 1068    HG3  PRO 132           HG3      PRO 132  -4.971  22.304 -20.174
 1069    HD2  PRO 132           HD2      PRO 132  -2.348  22.781 -21.647
 1070    HD3  PRO 132           HD3      PRO 132  -3.939  23.513 -21.933
 1071    H    VAL 133           H        VAL 133  -0.544  23.860 -19.869
 1072    HA   VAL 133           HA       VAL 133   1.006  23.507 -17.486
 1073    HB   VAL 133           HB       VAL 133   1.406  23.697 -20.329
 1074   HG11  VAL 133          HG11      VAL 133   3.584  24.782 -20.495
 1075   HG12  VAL 133          HG12      VAL 133   2.333  25.949 -20.091
 1076   HG13  VAL 133          HG13      VAL 133   3.449  25.372 -18.819
 1077   HG21  VAL 133          HG21      VAL 133   2.067  21.864 -18.840
 1078   HG22  VAL 133          HG22      VAL 133   3.379  22.427 -19.870
 1079   HG23  VAL 133          HG23      VAL 133   3.338  22.903 -18.148
 1080    H    ARG 134           H        ARG 134  -0.298  26.422 -19.162
 1081    HA   ARG 134           HA       ARG 134   1.103  28.083 -17.169
 1082    HB2  ARG 134           HB2      ARG 134  -0.996  28.899 -19.225
 1083    HB3  ARG 134           HB3      ARG 134  -0.033  29.983 -18.231
 1084    HG2  ARG 134           HG2      ARG 134   0.891  28.243 -20.532
 1085    HG3  ARG 134           HG3      ARG 134   0.940  29.987 -20.394
 1086    HD2  ARG 134           HD2      ARG 134   2.712  27.944 -19.003
 1087    HD3  ARG 134           HD3      ARG 134   3.200  29.146 -20.176
 1088    HE   ARG 134           HE       ARG 134   2.986  29.433 -17.329
 1089   HH11  ARG 134          HH11      ARG 134   2.821  31.334 -20.343
 1090   HH12  ARG 134          HH12      ARG 134   3.090  32.848 -19.560
 1091   HH21  ARG 134          HH21      ARG 134   3.277  31.497 -16.288
 1092   HH22  ARG 134          HH22      ARG 134   3.381  32.930 -17.237
 1093    H    GLN 135           H        GLN 135  -2.095  26.596 -17.513
 1094    HA   GLN 135           HA       GLN 135  -3.254  28.244 -15.436
 1095    HB2  GLN 135           HB2      GLN 135  -4.104  25.532 -16.528
 1096    HB3  GLN 135           HB3      GLN 135  -5.035  26.493 -15.382
 1097    HG2  GLN 135           HG2      GLN 135  -4.367  27.304 -18.240
 1098    HG3  GLN 135           HG3      GLN 135  -5.924  26.781 -17.617
 1099   HE21  GLN 135          HE22      GLN 135  -6.998  28.231 -15.947
 1100   HE22  GLN 135          HE21      GLN 135  -6.651  29.943 -16.002
 1101    H    VAL 136           H        VAL 136  -1.354  25.217 -15.349
 1102    HA   VAL 136           HA       VAL 136  -2.340  24.462 -12.826
 1103    HB   VAL 136           HB       VAL 136  -1.368  22.989 -14.574
 1104   HG11  VAL 136          HG11      VAL 136   1.282  23.980 -13.447
 1105   HG12  VAL 136          HG12      VAL 136   1.111  22.497 -14.384
 1106   HG13  VAL 136          HG13      VAL 136   0.714  24.066 -15.120
 1107   HG21  VAL 136          HG21      VAL 136  -0.617  21.306 -13.076
 1108   HG22  VAL 136          HG22      VAL 136  -0.163  22.501 -11.845
 1109   HG23  VAL 136          HG23      VAL 136  -1.872  22.242 -12.244
 1110    H    VAL 137           H        VAL 137  -1.250  24.261 -10.798
 1111    HA   VAL 137           HA       VAL 137   0.036  26.458  -9.659
 1112    HB   VAL 137           HB       VAL 137   0.768  24.678  -7.933
 1113   HG11  VAL 137          HG11      VAL 137  -2.199  24.993  -8.597
 1114   HG12  VAL 137          HG12      VAL 137  -1.526  24.504  -7.027
 1115   HG13  VAL 137          HG13      VAL 137  -1.210  26.125  -7.651
 1116   HG21  VAL 137          HG21      VAL 137  -1.124  22.856  -9.506
 1117   HG22  VAL 137          HG22      VAL 137   0.645  22.665  -9.402
 1118   HG23  VAL 137          HG23      VAL 137  -0.356  22.524  -7.956
 1119    H    SER 138           H        SER 138   2.133  26.900  -8.997
 1120    HA   SER 138           HA       SER 138   4.008  26.688 -11.004
 1121    HB2  SER 138           HB2      SER 138   4.459  27.403  -8.084
 1122    HB3  SER 138           HB3      SER 138   5.408  27.963  -9.476
 1123    HG   SER 138           HG       SER 138   3.628  29.386  -8.606
 1124    H    PHE 139           H        PHE 139   3.793  24.583  -8.056
 1125    HA   PHE 139           HA       PHE 139   6.444  23.575  -8.460
 1126    HB2  PHE 139           HB2      PHE 139   6.027  22.016  -6.780
 1127    HB3  PHE 139           HB3      PHE 139   5.191  23.478  -6.308
 1128    HD1  PHE 139           HD2      PHE 139   4.827  19.974  -7.435
 1129    HD2  PHE 139           HD1      PHE 139   2.726  23.509  -6.117
 1130    HE1  PHE 139           HE2      PHE 139   2.767  18.642  -7.134
 1131    HE2  PHE 139           HE1      PHE 139   0.673  22.163  -5.795
 1132    HZ   PHE 139           HZ       PHE 139   0.671  19.737  -6.351
 1133    H    LYS 140           H        LYS 140   3.325  22.670  -9.895
 1134    HA   LYS 140           HA       LYS 140   4.538  20.314 -11.228
 1135    HB2  LYS 140           HB2      LYS 140   1.785  21.548 -11.579
 1136    HB3  LYS 140           HB3      LYS 140   2.373  20.066 -12.337
 1137    HG2  LYS 140           HG2      LYS 140   2.804  19.216  -9.917
 1138    HG3  LYS 140           HG3      LYS 140   1.759  20.563  -9.411
 1139    HD2  LYS 140           HD2      LYS 140  -0.005  19.700 -11.031
 1140    HD3  LYS 140           HD3      LYS 140   1.067  18.319 -11.353
 1141    HE2  LYS 140           HE2      LYS 140   1.019  17.988  -8.741
 1142    HE3  LYS 140           HE3      LYS 140  -0.393  19.055  -8.785
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.361  17.444 -10.441
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.082  16.436 -10.183
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.119  16.770  -8.957
 1146    H    ARG 141           H        ARG 141   3.441  23.619 -12.142
 1147    HA   ARG 141           HA       ARG 141   3.354  23.563 -14.823
 1148    HB2  ARG 141           HB2      ARG 141   3.077  25.555 -13.438
 1149    HB3  ARG 141           HB3      ARG 141   4.813  25.681 -13.169
 1150    HG2  ARG 141           HG2      ARG 141   5.238  26.466 -15.338
 1151    HG3  ARG 141           HG3      ARG 141   3.806  25.718 -16.016
 1152    HD2  ARG 141           HD2      ARG 141   3.433  28.068 -15.967
 1153    HD3  ARG 141           HD3      ARG 141   2.373  27.357 -14.759
 1154    HE   ARG 141           HE       ARG 141   4.934  28.832 -14.279
 1155   HH11  ARG 141          HH21      ARG 141   1.771  27.753 -12.895
 1156   HH12  ARG 141          HH22      ARG 141   2.048  28.619 -11.427
 1157   HH21  ARG 141          HH11      ARG 141   5.178  29.957 -12.319
 1158   HH22  ARG 141          HH12      ARG 141   4.004  29.764 -11.058
 1159    H    ASP 142           H        ASP 142   6.580  23.807 -13.216
 1160    HA   ASP 142           HA       ASP 142   7.994  23.915 -15.711
 1161    HB2  ASP 142           HB2      ASP 142   8.902  24.784 -13.599
 1162    HB3  ASP 142           HB3      ASP 142   8.977  23.143 -12.943
 1163    H    VAL 143           H        VAL 143   6.957  21.187 -13.692
 1164    HA   VAL 143           HA       VAL 143   8.510  19.230 -15.226
 1165    HB   VAL 143           HB       VAL 143   6.546  19.094 -12.923
 1166   HG11  VAL 143          HG11      VAL 143   5.881  17.138 -14.077
 1167   HG12  VAL 143          HG12      VAL 143   7.531  16.777 -14.601
 1168   HG13  VAL 143          HG13      VAL 143   7.069  16.581 -12.895
 1169   HG21  VAL 143          HG21      VAL 143   9.462  18.254 -13.302
 1170   HG22  VAL 143          HG22      VAL 143   8.894  19.698 -12.434
 1171   HG23  VAL 143          HG23      VAL 143   8.534  18.086 -11.805
 1172    H    TYR 144           H        TYR 144   5.107  20.381 -15.074
 1173    HA   TYR 144           HA       TYR 144   4.141  18.516 -16.973
 1174    HB2  TYR 144           HB2      TYR 144   2.854  19.875 -15.294
 1175    HB3  TYR 144           HB3      TYR 144   3.024  21.274 -16.333
 1176    HD1  TYR 144           HD1      TYR 144   2.346  17.910 -17.877
 1177    HD2  TYR 144           HD2      TYR 144   0.572  21.470 -16.194
 1178    HE1  TYR 144           HE1      TYR 144   0.129  17.166 -18.621
 1179    HE2  TYR 144           HE2      TYR 144  -1.641  20.729 -16.904
 1180    HH   TYR 144           HH       TYR 144  -2.877  19.068 -18.087
 1181    H    ARG 145           H        ARG 145   5.748  21.687 -17.382
 1182    HA   ARG 145           HA       ARG 145   5.548  21.940 -20.199
 1183    HB2  ARG 145           HB2      ARG 145   7.411  22.840 -18.031
 1184    HB3  ARG 145           HB3      ARG 145   8.169  22.738 -19.604
 1185    HG2  ARG 145           HG2      ARG 145   5.585  24.245 -19.111
 1186    HG3  ARG 145           HG3      ARG 145   7.169  24.988 -18.936
 1187    HD2  ARG 145           HD2      ARG 145   6.196  23.693 -21.526
 1188    HD3  ARG 145           HD3      ARG 145   6.089  25.424 -21.165
 1189    HE   ARG 145           HE       ARG 145   8.752  24.787 -20.744
 1190   HH11  ARG 145          HH11      ARG 145   6.569  24.668 -23.580
 1191   HH12  ARG 145          HH12      ARG 145   7.825  25.022 -24.702
 1192   HH21  ARG 145          HH21      ARG 145  10.405  25.189 -22.276
 1193   HH22  ARG 145          HH22      ARG 145  10.032  25.313 -23.957
 1194    H    ARG 146           H        ARG 146   7.705  19.791 -18.281
 1195    HA   ARG 146           HA       ARG 146   9.266  19.014 -20.616
 1196    HB2  ARG 146           HB2      ARG 146   8.906  17.240 -18.171
 1197    HB3  ARG 146           HB3      ARG 146  10.258  17.320 -19.288
 1198    HG2  ARG 146           HG2      ARG 146   9.498  19.297 -17.135
 1199    HG3  ARG 146           HG3      ARG 146  10.905  18.260 -17.168
 1200    HD2  ARG 146           HD2      ARG 146  11.880  19.563 -18.997
 1201    HD3  ARG 146           HD3      ARG 146  10.424  20.567 -19.113
 1202    HE   ARG 146           HE       ARG 146  10.821  21.229 -16.733
 1203   HH11  ARG 146          HH11      ARG 146  13.590  20.494 -18.883
 1204   HH12  ARG 146          HH12      ARG 146  14.718  21.397 -17.939
 1205   HH21  ARG 146          HH21      ARG 146  12.320  22.354 -15.480
 1206   HH22  ARG 146          HH22      ARG 146  13.983  22.500 -15.975
 1207    H    VAL 147           H        VAL 147   6.487  17.550 -18.856
 1208    HA   VAL 147           HA       VAL 147   6.138  15.282 -20.501
 1209    HB   VAL 147           HB       VAL 147   4.088  17.003 -19.041
 1210   HG11  VAL 147          HG11      VAL 147   2.647  15.006 -19.017
 1211   HG12  VAL 147          HG12      VAL 147   2.918  15.610 -20.650
 1212   HG13  VAL 147          HG13      VAL 147   3.802  14.172 -20.099
 1213   HG21  VAL 147          HG21      VAL 147   5.464  14.434 -18.145
 1214   HG22  VAL 147          HG22      VAL 147   5.847  16.058 -17.530
 1215   HG23  VAL 147          HG23      VAL 147   4.255  15.363 -17.239
 1216    H    MET 148           H        MET 148   4.793  18.639 -20.921
 1217    HA   MET 148           HA       MET 148   3.469  17.917 -23.355
 1218    HB2  MET 148           HB2      MET 148   4.262  20.586 -22.125
 1219    HB3  MET 148           HB3      MET 148   3.394  20.456 -23.660
 1220    HG2  MET 148           HG2      MET 148   1.679  19.004 -22.478
 1221    HG3  MET 148           HG3      MET 148   2.453  19.466 -20.958
 1222    HE1  MET 148           HE1      MET 148  -0.681  21.636 -20.641
 1223    HE2  MET 148           HE2      MET 148  -0.591  19.956 -21.229
 1224    HE3  MET 148           HE3      MET 148   0.424  20.484 -19.864
 1225    H    LYS 149           H        LYS 149   6.756  19.253 -22.735
 1226    HA   LYS 149           HA       LYS 149   7.380  19.711 -25.481
 1227    HB2  LYS 149           HB2      LYS 149   8.586  20.709 -23.614
 1228    HB3  LYS 149           HB3      LYS 149   9.168  19.136 -23.074
 1229    HG2  LYS 149           HG2      LYS 149   9.812  20.038 -25.884
 1230    HG3  LYS 149           HG3      LYS 149  10.640  20.812 -24.537
 1231    HD2  LYS 149           HD2      LYS 149  11.555  18.678 -23.757
 1232    HD3  LYS 149           HD3      LYS 149  10.633  17.789 -24.959
 1233    HE2  LYS 149           HE2      LYS 149  12.857  17.920 -25.766
 1234    HE3  LYS 149           HE3      LYS 149  11.860  18.949 -26.791
 1235    HZ1  LYS 149           HZ1      LYS 149  13.641  19.923 -24.608
 1236    HZ2  LYS 149           HZ2      LYS 149  13.967  19.995 -26.202
 1237    HZ3  LYS 149           HZ3      LYS 149  12.748  20.884 -25.601
 1238    H    GLU 150           H        GLU 150   7.647  16.800 -23.447
 1239    HA   GLU 150           HA       GLU 150   9.121  15.164 -25.229
 1240    HB2  GLU 150           HB2      GLU 150   6.947  14.531 -23.192
 1241    HB3  GLU 150           HB3      GLU 150   7.821  13.275 -24.038
 1242    HG2  GLU 150           HG2      GLU 150   9.433  15.353 -22.566
 1243    HG3  GLU 150           HG3      GLU 150   8.545  14.173 -21.621
 1244    H    PHE 151           H        PHE 151   5.749  16.206 -25.309
 1245    HA   PHE 151           HA       PHE 151   5.102  14.226 -27.437
 1246    HB2  PHE 151           HB2      PHE 151   3.394  15.737 -25.439
 1247    HB3  PHE 151           HB3      PHE 151   2.764  14.623 -26.638
 1248    HD1  PHE 151           HD1      PHE 151   5.263  12.577 -26.141
 1249    HD2  PHE 151           HD2      PHE 151   2.372  14.546 -23.614
 1250    HE1  PHE 151           HE1      PHE 151   5.538  10.825 -24.469
 1251    HE2  PHE 151           HE2      PHE 151   2.605  12.709 -21.952
 1252    HZ   PHE 151           HZ       PHE 151   4.179  10.853 -22.373
 1253    H    ALA 152           H        ALA 152   5.637  17.615 -27.102
 1254    HA   ALA 152           HA       ALA 152   3.604  18.753 -28.517
 1255    HB1  ALA 152           HB1      ALA 152   6.558  19.523 -28.600
 1256    HB2  ALA 152           HB2      ALA 152   5.212  20.563 -29.096
 1257    HB3  ALA 152           HB3      ALA 152   5.351  20.050 -27.402
 1258    H    SER 153           H        SER 153   6.706  17.817 -30.164
 1259    HA   SER 153           HA       SER 153   5.554  18.194 -32.721
 1260    HB2  SER 153           HB2      SER 153   8.051  16.580 -32.135
 1261    HB3  SER 153           HB3      SER 153   7.662  17.548 -33.576
 1262    HG   SER 153           HG       SER 153   9.110  18.660 -32.172
 1263    H    VAL 154           H        VAL 154   4.571  15.868 -30.707
 1264    HA   VAL 154           HA       VAL 154   4.215  13.789 -32.791
 1265    HB   VAL 154           HB       VAL 154   3.882  13.309 -29.829
 1266   HG11  VAL 154          HG11      VAL 154   4.464  10.977 -30.485
 1267   HG12  VAL 154          HG12      VAL 154   3.088  11.567 -31.416
 1268   HG13  VAL 154          HG13      VAL 154   4.692  11.511 -32.163
 1269   HG21  VAL 154          HG21      VAL 154   6.534  13.125 -31.309
 1270   HG22  VAL 154          HG22      VAL 154   6.173  14.140 -29.892
 1271   HG23  VAL 154          HG23      VAL 154   6.208  12.391 -29.724
 1272    H    VAL 155           H        VAL 155   2.779  16.414 -31.358
 1273    HA   VAL 155           HA       VAL 155   0.046  15.348 -31.895
 1274    HB   VAL 155           HB       VAL 155   0.936  17.538 -29.963
 1275   HG11  VAL 155          HG11      VAL 155  -1.865  16.509 -30.653
 1276   HG12  VAL 155          HG12      VAL 155  -1.471  17.592 -29.294
 1277   HG13  VAL 155          HG13      VAL 155  -1.223  18.139 -30.959
 1278   HG21  VAL 155          HG21      VAL 155   1.330  15.198 -29.139
 1279   HG22  VAL 155          HG22      VAL 155   0.093  16.034 -28.223
 1280   HG23  VAL 155          HG23      VAL 155  -0.377  14.833 -29.448
 1281    H    MET 156           H        MET 156   2.136  18.284 -31.935
 1282    HA   MET 156           HA       MET 156   0.567  19.825 -33.724
 1283    HB2  MET 156           HB2      MET 156   3.565  19.817 -33.187
 1284    HB3  MET 156           HB3      MET 156   2.676  21.116 -33.998
 1285    HG2  MET 156           HG2      MET 156   1.354  21.543 -31.997
 1286    HG3  MET 156           HG3      MET 156   2.076  20.162 -31.168
 1287    HE1  MET 156           HE1      MET 156   1.947  22.815 -29.663
 1288    HE2  MET 156           HE2      MET 156   2.742  21.335 -29.078
 1289    HE3  MET 156           HE3      MET 156   3.596  22.889 -29.000
 1290    H    SER 157           H        SER 157   2.663  17.068 -34.405
 1291    HA   SER 157           HA       SER 157   3.362  17.494 -37.094
 1292    HB2  SER 157           HB2      SER 157   3.098  14.873 -37.036
 1293    HB3  SER 157           HB3      SER 157   4.347  15.658 -36.051
 1294    HG   SER 157           HG       SER 157   2.956  14.039 -34.967
 1295    H    LEU 158           H        LEU 158   0.363  16.303 -35.604
 1296    HA   LEU 158           HA       LEU 158  -0.946  15.478 -38.023
 1297    HB2  LEU 158           HB2      LEU 158  -1.885  16.250 -35.267
 1298    HB3  LEU 158           HB3      LEU 158  -3.040  15.858 -36.528
 1299    HG   LEU 158           HG       LEU 158  -2.222  13.557 -36.586
 1300   HD11  LEU 158          HD11      LEU 158  -0.335  14.386 -34.324
 1301   HD12  LEU 158          HD12      LEU 158  -0.698  12.715 -34.798
 1302   HD13  LEU 158          HD13      LEU 158   0.133  13.783 -35.931
 1303   HD21  LEU 158          HD21      LEU 158  -3.095  12.947 -34.330
 1304   HD22  LEU 158          HD22      LEU 158  -2.857  14.617 -33.765
 1305   HD23  LEU 158          HD23      LEU 158  -4.039  14.261 -35.038
 1306    H    GLN 159           H        GLN 159  -0.834  18.605 -36.241
 1307    HA   GLN 159           HA       GLN 159  -2.920  19.763 -37.951
 1308    HB2  GLN 159           HB2      GLN 159  -1.270  21.065 -35.721
 1309    HB3  GLN 159           HB3      GLN 159  -2.629  21.797 -36.562
 1310    HG2  GLN 159           HG2      GLN 159  -3.444  21.090 -34.585
 1311    HG3  GLN 159           HG3      GLN 159  -4.109  19.949 -35.771
 1312   HE21  GLN 159          HE22      GLN 159  -4.135  17.819 -34.861
 1313   HE22  GLN 159          HE21      GLN 159  -2.871  17.251 -33.779
 1314    H    GLU 160           H        GLU 160   0.639  20.040 -37.587
 1315    HA   GLU 160           HA       GLU 160   1.027  22.002 -39.636
 1316    HB2  GLU 160           HB2      GLU 160   2.700  21.217 -37.877
 1317    HB3  GLU 160           HB3      GLU 160   2.844  19.703 -38.763
 1318    HG2  GLU 160           HG2      GLU 160   4.693  21.042 -39.397
 1319    HG3  GLU 160           HG3      GLU 160   3.605  21.043 -40.777
 1320    H    ASN 161           H        ASN 161   0.628  18.519 -39.567
 1321    HA   ASN 161           HA       ASN 161  -0.013  16.960 -40.903
 1322    HB2  ASN 161           HB2      ASN 161  -1.782  18.796 -41.223
 1323    HB3  ASN 161           HB3      ASN 161  -1.116  18.976 -42.852
 1324   HD21  ASN 161          HD22      ASN 161  -2.570  16.668 -40.538
 1325   HD22  ASN 161          HD21      ASN 161  -3.174  15.536 -41.738
 1326    H    THR 162           H        THR 162   2.255  19.139 -42.409
 1327    HA   THR 162           HA       THR 162   2.817  17.314 -44.540
 1328    HB   THR 162           HB       THR 162   4.891  18.819 -44.777
 1329    HG1  THR 162           HG1      THR 162   4.801  20.739 -43.653
 1330   HG21  THR 162          HG21      THR 162   2.097  20.054 -44.937
 1331   HG22  THR 162          HG22      THR 162   3.547  20.607 -45.807
 1332   HG23  THR 162          HG23      THR 162   2.852  19.023 -46.176
 1333    HA   PRO 163           HA       PRO 163   6.401  15.899 -41.697
 1334    HB2  PRO 163           HB2      PRO 163   4.904  15.716 -39.085
 1335    HB3  PRO 163           HB3      PRO 163   6.638  16.061 -39.372
 1336    HG2  PRO 163           HG2      PRO 163   4.951  18.092 -38.780
 1337    HG3  PRO 163           HG3      PRO 163   6.145  18.294 -40.105
 1338    HD2  PRO 163           HD2      PRO 163   3.210  17.524 -40.351
 1339    HD3  PRO 163           HD3      PRO 163   4.126  18.758 -41.252
 1340    H    LYS 164           H        LYS 164   3.073  14.983 -40.913
 1341    HA   LYS 164           HA       LYS 164   1.958  13.031 -40.661
 1342    HB2  LYS 164           HB2      LYS 164   3.614  12.156 -43.057
 1343    HB3  LYS 164           HB3      LYS 164   2.082  11.465 -42.507
 1344    HG2  LYS 164           HG2      LYS 164   1.010  13.727 -42.851
 1345    HG3  LYS 164           HG3      LYS 164   2.535  14.270 -43.598
 1346    HD2  LYS 164           HD2      LYS 164   2.300  12.355 -45.245
 1347    HD3  LYS 164           HD3      LYS 164   0.681  12.071 -44.595
 1348    HE2  LYS 164           HE2      LYS 164   1.713  14.613 -45.948
 1349    HE3  LYS 164           HE3      LYS 164   0.612  13.428 -46.652
 1350    HZ1  LYS 164           HZ1      LYS 164  -1.010  14.051 -44.902
 1351    HZ2  LYS 164           HZ2      LYS 164   0.013  15.236 -44.372
 1352    HZ3  LYS 164           HZ3      LYS 164  -0.631  15.304 -45.871
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1  -0.702   0.942  -1.276
    2    H2   MET   1           H2       MET   1  -1.144   1.162  -2.832
    3    H3   MET   1           H3       MET   1  -1.047  -0.356  -2.207
    4    HA   MET   1           HA       MET   1   1.331  -0.125  -1.864
    5    HB2  MET   1           HB2      MET   1   2.066  -0.536  -4.070
    6    HB3  MET   1           HB3      MET   1   0.436  -1.172  -3.978
    7    HG2  MET   1           HG2      MET   1  -0.362   0.985  -5.112
    8    HG3  MET   1           HG3      MET   1   1.339   1.392  -5.357
    9    HE1  MET   1           HE1      MET   1   2.499  -1.705  -6.141
   10    HE2  MET   1           HE2      MET   1   2.468  -1.440  -7.896
   11    HE3  MET   1           HE3      MET   1   3.031  -0.145  -6.819
   12    H    ILE   2           H        ILE   2   3.160   1.237  -1.650
   13    HA   ILE   2           HA       ILE   2   3.146   3.834  -3.004
   14    HB   ILE   2           HB       ILE   2   3.908   3.669  -0.051
   15   HG12  ILE   2          HG12      ILE   2   1.951   5.459   0.100
   16   HG13  ILE   2          HG13      ILE   2   1.314   4.630  -1.310
   17   HG21  ILE   2          HG21      ILE   2   3.536   6.060  -1.922
   18   HG22  ILE   2          HG22      ILE   2   4.105   6.110  -0.241
   19   HG23  ILE   2          HG23      ILE   2   5.105   5.360  -1.485
   20   HD11  ILE   2          HD11      ILE   2   1.710   3.637   1.523
   21   HD12  ILE   2          HD12      ILE   2   0.225   3.671   0.565
   22   HD13  ILE   2          HD13      ILE   2   1.484   2.470   0.215
   23    H    ASP   3           H        ASP   3   5.168   4.260  -3.753
   24    HA   ASP   3           HA       ASP   3   7.212   2.261  -3.979
   25    HB2  ASP   3           HB2      ASP   3   6.864   4.005  -5.671
   26    HB3  ASP   3           HB3      ASP   3   7.091   5.252  -4.458
   27    H    ASP   4           H        ASP   4   9.326   2.331  -3.038
   28    HA   ASP   4           HA       ASP   4   9.300   2.555  -0.236
   29    HB2  ASP   4           HB2      ASP   4  10.775   1.045  -1.492
   30    HB3  ASP   4           HB3      ASP   4  11.653   2.427  -2.152
   31    H    ASP   5           H        ASP   5  10.191   5.005  -2.634
   32    HA   ASP   5           HA       ASP   5  11.568   6.650  -0.677
   33    HB2  ASP   5           HB2      ASP   5  12.341   6.365  -3.053
   34    HB3  ASP   5           HB3      ASP   5  10.914   7.273  -3.561
   35    H    GLY   6           H        GLY   6   8.373   6.028  -1.152
   36    HA2  GLY   6           HA2      GLY   6   6.662   7.023   0.024
   37    HA3  GLY   6           HA3      GLY   6   7.541   8.553   0.095
   38    H    TYR   7           H        TYR   7   7.019   6.687  -2.940
   39    HA   TYR   7           HA       TYR   7   5.413   9.009  -3.913
   40    HB2  TYR   7           HB2      TYR   7   7.466   7.252  -5.278
   41    HB3  TYR   7           HB3      TYR   7   6.225   8.119  -6.179
   42    HD1  TYR   7           HD1      TYR   7   8.959   8.660  -3.660
   43    HD2  TYR   7           HD2      TYR   7   6.454  10.389  -6.689
   44    HE1  TYR   7           HE1      TYR   7  10.205  10.774  -3.476
   45    HE2  TYR   7           HE2      TYR   7   7.645  12.520  -6.485
   46    HH   TYR   7           HH       TYR   7  10.436  12.993  -4.252
   47    H    ARG   8           H        ARG   8   3.463   8.672  -4.971
   48    HA   ARG   8           HA       ARG   8   2.471   5.844  -4.839
   49    HB2  ARG   8           HB2      ARG   8   0.978   7.467  -3.899
   50    HB3  ARG   8           HB3      ARG   8   1.070   8.465  -5.332
   51    HG2  ARG   8           HG2      ARG   8  -1.041   7.422  -5.458
   52    HG3  ARG   8           HG3      ARG   8  -0.057   6.526  -6.604
   53    HD2  ARG   8           HD2      ARG   8   0.396   4.906  -4.576
   54    HD3  ARG   8           HD3      ARG   8  -0.978   5.685  -3.830
   55    HE   ARG   8           HE       ARG   8  -0.911   3.856  -6.146
   56   HH11  ARG   8          HH11      ARG   8  -2.983   6.102  -4.314
   57   HH12  ARG   8          HH12      ARG   8  -4.459   5.363  -4.816
   58   HH21  ARG   8          HH21      ARG   8  -2.885   2.844  -6.790
   59   HH22  ARG   8          HH22      ARG   8  -4.396   3.489  -6.257
   60    HA   PRO   9           HA       PRO   9   3.590   5.721  -9.233
   61    HB2  PRO   9           HB2      PRO   9   2.616   3.231  -9.886
   62    HB3  PRO   9           HB3      PRO   9   4.141   3.512  -9.001
   63    HG2  PRO   9           HG2      PRO   9   1.415   2.847  -7.843
   64    HG3  PRO   9           HG3      PRO   9   3.004   2.106  -7.456
   65    HD2  PRO   9           HD2      PRO   9   1.915   4.043  -5.915
   66    HD3  PRO   9           HD3      PRO   9   3.678   3.982  -6.211
   67    H    ASN  10           H        ASN  10   2.513   6.514 -11.007
   68    HA   ASN  10           HA       ASN  10  -0.473   6.593 -11.070
   69    HB2  ASN  10           HB2      ASN  10   1.521   8.879 -10.904
   70    HB3  ASN  10           HB3      ASN  10   0.026   9.106 -11.786
   71   HD21  ASN  10          HD22      ASN  10   1.347   8.289  -8.557
   72   HD22  ASN  10          HD21      ASN  10  -0.003   8.989  -7.723
   73    H    VAL  11           H        VAL  11  -1.331   7.311 -13.108
   74    HA   VAL  11           HA       VAL  11   0.455   7.185 -15.486
   75    HB   VAL  11           HB       VAL  11  -1.535   5.945 -16.553
   76   HG11  VAL  11          HG11      VAL  11   0.267   4.497 -14.584
   77   HG12  VAL  11          HG12      VAL  11  -0.600   3.759 -15.949
   78   HG13  VAL  11          HG13      VAL  11   0.679   4.943 -16.250
   79   HG21  VAL  11          HG21      VAL  11  -2.003   4.979 -13.686
   80   HG22  VAL  11          HG22      VAL  11  -3.064   6.143 -14.521
   81   HG23  VAL  11          HG23      VAL  11  -2.864   4.514 -15.147
   82    H    GLY  12           H        GLY  12   0.234   9.636 -15.160
   83    HA2  GLY  12           HA2      GLY  12  -2.305  10.942 -15.462
   84    HA3  GLY  12           HA3      GLY  12  -0.720  11.621 -15.867
   85    H    ILE  13           H        ILE  13  -3.630  10.936 -17.252
   86    HA   ILE  13           HA       ILE  13  -2.646   9.648 -19.689
   87    HB   ILE  13           HB       ILE  13  -5.397  10.824 -19.144
   88   HG12  ILE  13          HG12      ILE  13  -5.012   9.111 -17.400
   89   HG13  ILE  13          HG13      ILE  13  -6.225   8.619 -18.559
   90   HG21  ILE  13          HG21      ILE  13  -4.875  10.418 -21.502
   91   HG22  ILE  13          HG22      ILE  13  -4.357   8.775 -21.133
   92   HG23  ILE  13          HG23      ILE  13  -6.074   9.238 -20.941
   93   HD11  ILE  13          HD11      ILE  13  -3.325   7.668 -18.605
   94   HD12  ILE  13          HD12      ILE  13  -4.697   6.774 -17.943
   95   HD13  ILE  13          HD13      ILE  13  -4.642   7.092 -19.664
   96    H    VAL  14           H        VAL  14  -1.620  10.900 -21.288
   97    HA   VAL  14           HA       VAL  14  -2.466  13.740 -21.529
   98    HB   VAL  14           HB       VAL  14  -0.190  12.357 -23.003
   99   HG11  VAL  14          HG11      VAL  14  -0.898  15.308 -22.669
  100   HG12  VAL  14          HG12      VAL  14   0.500  14.646 -23.548
  101   HG13  VAL  14          HG13      VAL  14  -1.122  14.344 -24.147
  102   HG21  VAL  14          HG21      VAL  14  -0.094  14.123 -20.540
  103   HG22  VAL  14          HG22      VAL  14   0.364  12.398 -20.688
  104   HG23  VAL  14          HG23      VAL  14   1.300  13.633 -21.528
  105    H    ILE  15           H        ILE  15  -4.643  13.130 -22.269
  106    HA   ILE  15           HA       ILE  15  -4.865  11.765 -24.871
  107    HB   ILE  15           HB       ILE  15  -6.741  13.734 -23.503
  108   HG12  ILE  15          HG12      ILE  15  -6.600  11.532 -22.346
  109   HG13  ILE  15          HG13      ILE  15  -8.192  11.945 -22.936
  110   HG21  ILE  15          HG21      ILE  15  -7.177  12.223 -26.074
  111   HG22  ILE  15          HG22      ILE  15  -8.475  12.998 -25.117
  112   HG23  ILE  15          HG23      ILE  15  -7.204  13.986 -25.807
  113   HD11  ILE  15          HD11      ILE  15  -8.079  10.385 -24.754
  114   HD12  ILE  15          HD12      ILE  15  -6.336  10.176 -24.575
  115   HD13  ILE  15          HD13      ILE  15  -7.445   9.526 -23.338
  116    H    CYS  16           H        CYS  16  -4.826  12.820 -26.907
  117    HA   CYS  16           HA       CYS  16  -4.475  15.759 -26.868
  118    HB2  CYS  16           HB2      CYS  16  -2.657  13.758 -28.258
  119    HB3  CYS  16           HB3      CYS  16  -2.920  15.405 -28.901
  120    HG   CYS  16           HG       CYS  16  -2.281  14.772 -25.726
  121    H    ASN  17           H        ASN  17  -5.769  16.642 -28.394
  122    HA   ASN  17           HA       ASN  17  -7.594  14.789 -29.794
  123    HB2  ASN  17           HB2      ASN  17  -8.641  16.753 -28.662
  124    HB3  ASN  17           HB3      ASN  17  -7.645  17.837 -29.654
  125   HD21  ASN  17          HD22      ASN  17 -10.647  16.158 -29.604
  126   HD22  ASN  17          HD21      ASN  17 -10.949  16.134 -31.324
  127    H    ARG  18           H        ARG  18  -7.053  14.320 -31.801
  128    HA   ARG  18           HA       ARG  18  -4.649  14.573 -32.988
  129    HB2  ARG  18           HB2      ARG  18  -5.945  14.135 -35.138
  130    HB3  ARG  18           HB3      ARG  18  -6.237  13.031 -33.753
  131    HG2  ARG  18           HG2      ARG  18  -8.357  14.108 -33.253
  132    HG3  ARG  18           HG3      ARG  18  -8.075  15.344 -34.494
  133    HD2  ARG  18           HD2      ARG  18  -8.057  13.550 -36.241
  134    HD3  ARG  18           HD3      ARG  18  -8.422  12.350 -34.980
  135    HE   ARG  18           HE       ARG  18 -10.368  14.397 -34.833
  136   HH11  ARG  18          HH21      ARG  18  -9.430  11.816 -37.111
  137   HH12  ARG  18          HH22      ARG  18 -11.009  11.660 -37.789
  138   HH21  ARG  18          HH11      ARG  18 -12.463  14.184 -35.746
  139   HH22  ARG  18          HH12      ARG  18 -12.767  13.033 -36.994
  140    H    GLN  19           H        GLN  19  -7.066  17.146 -33.019
  141    HA   GLN  19           HA       GLN  19  -5.869  18.534 -35.238
  142    HB2  GLN  19           HB2      GLN  19  -7.555  20.111 -35.048
  143    HB3  GLN  19           HB3      GLN  19  -8.305  18.602 -34.542
  144    HG2  GLN  19           HG2      GLN  19  -7.700  19.417 -32.109
  145    HG3  GLN  19           HG3      GLN  19  -7.502  20.997 -32.886
  146   HE21  GLN  19          HE22      GLN  19  -9.857  18.346 -32.354
  147   HE22  GLN  19          HE21      GLN  19 -11.245  19.428 -32.208
  148    H    GLY  20           H        GLY  20  -4.275  17.872 -32.621
  149    HA2  GLY  20           HA2      GLY  20  -2.145  18.668 -32.181
  150    HA3  GLY  20           HA3      GLY  20  -2.518  20.199 -32.993
  151    H    GLN  21           H        GLN  21  -4.379  18.682 -30.328
  152    HA   GLN  21           HA       GLN  21  -3.884  21.078 -28.622
  153    HB2  GLN  21           HB2      GLN  21  -6.611  19.845 -29.101
  154    HB3  GLN  21           HB3      GLN  21  -6.266  21.345 -28.268
  155    HG2  GLN  21           HG2      GLN  21  -6.032  20.766 -31.220
  156    HG3  GLN  21           HG3      GLN  21  -7.263  21.747 -30.444
  157   HE21  GLN  21          HE22      GLN  21  -4.873  22.187 -32.574
  158   HE22  GLN  21          HE21      GLN  21  -4.227  23.708 -32.013
  159    H    VAL  22           H        VAL  22  -4.418  20.609 -26.341
  160    HA   VAL  22           HA       VAL  22  -3.721  17.762 -25.764
  161    HB   VAL  22           HB       VAL  22  -2.700  18.625 -23.704
  162   HG11  VAL  22          HG11      VAL  22  -1.643  19.929 -26.236
  163   HG12  VAL  22          HG12      VAL  22  -0.711  19.553 -24.771
  164   HG13  VAL  22          HG13      VAL  22  -1.374  18.242 -25.756
  165   HG21  VAL  22          HG21      VAL  22  -3.154  21.406 -24.881
  166   HG22  VAL  22          HG22      VAL  22  -3.981  20.744 -23.453
  167   HG23  VAL  22          HG23      VAL  22  -2.226  21.000 -23.432
  168    H    MET  23           H        MET  23  -4.411  16.785 -23.781
  169    HA   MET  23           HA       MET  23  -7.134  16.811 -23.217
  170    HB2  MET  23           HB2      MET  23  -5.449  15.060 -22.510
  171    HB3  MET  23           HB3      MET  23  -4.854  16.141 -21.279
  172    HG2  MET  23           HG2      MET  23  -6.439  14.459 -20.378
  173    HG3  MET  23           HG3      MET  23  -7.027  16.105 -20.134
  174    HE1  MET  23           HE1      MET  23 -10.449  14.274 -20.688
  175    HE2  MET  23           HE2      MET  23  -9.057  13.621 -19.786
  176    HE3  MET  23           HE3      MET  23  -9.505  15.341 -19.620
  177    H    TRP  24           H        TRP  24  -8.419  18.256 -22.120
  178    HA   TRP  24           HA       TRP  24  -7.537  19.273 -19.618
  179    HB2  TRP  24           HB2      TRP  24  -6.800  20.978 -21.528
  180    HB3  TRP  24           HB3      TRP  24  -8.489  21.467 -21.448
  181    HD1  TRP  24           HD1      TRP  24  -8.374  23.674 -20.251
  182    HE1  TRP  24           HE1      TRP  24  -7.388  24.617 -18.072
  183    HE3  TRP  24           HE3      TRP  24  -5.661  19.593 -18.742
  184    HZ2  TRP  24           HZ2      TRP  24  -5.625  23.712 -15.958
  185    HZ3  TRP  24           HZ3      TRP  24  -4.447  19.631 -16.611
  186    HH2  TRP  24           HH2      TRP  24  -4.431  21.680 -15.193
  187    H    ALA  25           H        ALA  25  -9.275  19.387 -18.279
  188    HA   ALA  25           HA       ALA  25 -11.976  19.373 -19.368
  189    HB1  ALA  25           HB1      ALA  25 -11.470  17.046 -19.752
  190    HB2  ALA  25           HB2      ALA  25 -10.641  16.891 -18.196
  191    HB3  ALA  25           HB3      ALA  25 -12.401  17.098 -18.236
  192    H    ARG  26           H        ARG  26 -13.511  19.762 -17.745
  193    HA   ARG  26           HA       ARG  26 -12.506  21.196 -15.415
  194    HB2  ARG  26           HB2      ARG  26 -14.584  21.847 -16.619
  195    HB3  ARG  26           HB3      ARG  26 -15.348  20.315 -16.163
  196    HG2  ARG  26           HG2      ARG  26 -15.269  20.925 -13.784
  197    HG3  ARG  26           HG3      ARG  26 -14.265  22.333 -14.153
  198    HD2  ARG  26           HD2      ARG  26 -16.528  23.081 -13.740
  199    HD3  ARG  26           HD3      ARG  26 -16.094  23.365 -15.435
  200    HE   ARG  26           HE       ARG  26 -17.478  20.817 -15.026
  201   HH11  ARG  26          HH21      ARG  26 -18.066  24.319 -15.472
  202   HH12  ARG  26          HH22      ARG  26 -19.671  24.079 -16.064
  203   HH21  ARG  26          HH11      ARG  26 -19.485  20.527 -15.731
  204   HH22  ARG  26          HH12      ARG  26 -20.540  21.845 -16.222
  205    H    ARG  27           H        ARG  27 -12.009  20.250 -13.466
  206    HA   ARG  27           HA       ARG  27 -12.200  17.372 -13.209
  207    HB2  ARG  27           HB2      ARG  27 -10.378  19.145 -12.341
  208    HB3  ARG  27           HB3      ARG  27 -11.442  19.227 -10.956
  209    HG2  ARG  27           HG2      ARG  27  -9.726  17.670 -10.458
  210    HG3  ARG  27           HG3      ARG  27 -11.189  16.710 -10.697
  211    HD2  ARG  27           HD2      ARG  27 -10.477  15.987 -12.859
  212    HD3  ARG  27           HD3      ARG  27  -9.301  17.268 -13.012
  213    HE   ARG  27           HE       ARG  27  -8.417  15.756 -10.842
  214   HH11  ARG  27          HH11      ARG  27  -8.857  15.213 -14.379
  215   HH12  ARG  27          HH12      ARG  27  -7.857  13.773 -14.314
  216   HH21  ARG  27          HH21      ARG  27  -7.403  13.602 -10.963
  217   HH22  ARG  27          HH22      ARG  27  -6.979  12.988 -12.538
  218    H    PHE  28           H        PHE  28 -13.716  16.262 -12.164
  219    HA   PHE  28           HA       PHE  28 -16.197  17.392 -11.201
  220    HB2  PHE  28           HB2      PHE  28 -16.293  15.196 -12.101
  221    HB3  PHE  28           HB3      PHE  28 -14.794  14.706 -11.347
  222    HD1  PHE  28           HD1      PHE  28 -18.406  15.175 -10.736
  223    HD2  PHE  28           HD2      PHE  28 -14.614  13.864  -9.145
  224    HE1  PHE  28           HE1      PHE  28 -19.589  14.009  -8.896
  225    HE2  PHE  28           HE2      PHE  28 -15.813  12.671  -7.305
  226    HZ   PHE  28           HZ       PHE  28 -18.298  12.766  -7.165
  227    H    GLY  29           H        GLY  29 -16.760  17.652  -8.967
  228    HA2  GLY  29           HA2      GLY  29 -16.483  17.818  -6.701
  229    HA3  GLY  29           HA3      GLY  29 -14.908  17.029  -6.831
  230    H    GLN  30           H        GLN  30 -13.493  18.792  -8.531
  231    HA   GLN  30           HA       GLN  30 -13.064  21.113  -6.804
  232    HB2  GLN  30           HB2      GLN  30 -11.352  19.708  -8.310
  233    HB3  GLN  30           HB3      GLN  30 -11.871  20.848  -9.559
  234    HG2  GLN  30           HG2      GLN  30 -11.233  22.720  -7.931
  235    HG3  GLN  30           HG3      GLN  30 -10.533  21.474  -6.899
  236   HE21  GLN  30          HE22      GLN  30 -10.286  23.101 -10.053
  237   HE22  GLN  30          HE21      GLN  30  -8.701  22.499 -10.510
  238    H    HIS  31           H        HIS  31 -14.610  20.344  -9.884
  239    HA   HIS  31           HA       HIS  31 -15.733  21.399 -11.425
  240    HB2  HIS  31           HB2      HIS  31 -16.701  23.178  -9.175
  241    HB3  HIS  31           HB3      HIS  31 -17.399  23.104 -10.794
  242    HD1  HIS  31           HD1      HIS  31 -18.713  20.780 -11.443
  243    HD2  HIS  31           HD2      HIS  31 -17.252  21.136  -7.507
  244    HE1  HIS  31           HE1      HIS  31 -19.766  18.883 -10.114
  245    H    SER  32           H        SER  32 -13.032  21.910 -11.359
  246    HA   SER  32           HA       SER  32 -12.922  24.176 -13.098
  247    HB2  SER  32           HB2      SER  32 -11.049  25.330 -11.756
  248    HB3  SER  32           HB3      SER  32 -12.717  25.590 -11.245
  249    HG   SER  32           HG       SER  32 -11.625  25.138  -9.408
  250    H    TRP  33           H        TRP  33 -10.457  24.295 -13.861
  251    HA   TRP  33           HA       TRP  33 -10.006  21.643 -14.802
  252    HB2  TRP  33           HB2      TRP  33  -8.103  23.968 -15.147
  253    HB3  TRP  33           HB3      TRP  33  -8.425  22.594 -16.213
  254    HD1  TRP  33           HD1      TRP  33  -9.808  26.019 -15.223
  255    HE1  TRP  33           HE1      TRP  33 -11.727  26.698 -16.743
  256    HE3  TRP  33           HE3      TRP  33 -10.046  21.822 -18.118
  257    HZ2  TRP  33           HZ2      TRP  33 -13.315  25.498 -18.861
  258    HZ3  TRP  33           HZ3      TRP  33 -11.772  21.618 -19.915
  259    HH2  TRP  33           HH2      TRP  33 -13.448  23.434 -20.234
  260    H    GLN  34           H        GLN  34  -8.105  20.273 -14.597
  261    HA   GLN  34           HA       GLN  34  -6.077  20.867 -12.621
  262    HB2  GLN  34           HB2      GLN  34  -8.084  19.989 -11.253
  263    HB3  GLN  34           HB3      GLN  34  -7.888  18.483 -12.140
  264    HG2  GLN  34           HG2      GLN  34  -5.551  18.318 -11.225
  265    HG3  GLN  34           HG3      GLN  34  -5.904  19.727 -10.219
  266   HE21  GLN  34          HE22      GLN  34  -7.733  19.457  -8.571
  267   HE22  GLN  34          HE21      GLN  34  -8.017  17.847  -7.951
  268    H    PHE  35           H        PHE  35  -4.334  19.466 -12.861
  269    HA   PHE  35           HA       PHE  35  -3.626  18.238 -15.254
  270    HB2  PHE  35           HB2      PHE  35  -1.980  16.998 -13.621
  271    HB3  PHE  35           HB3      PHE  35  -1.863  18.725 -13.876
  272    HD1  PHE  35           HD1      PHE  35  -3.088  16.144 -11.453
  273    HD2  PHE  35           HD2      PHE  35  -2.281  20.331 -12.118
  274    HE1  PHE  35           HE1      PHE  35  -3.663  16.633  -9.093
  275    HE2  PHE  35           HE2      PHE  35  -2.881  20.818  -9.763
  276    HZ   PHE  35           HZ       PHE  35  -3.609  18.971  -8.253
  277    HA   PRO  36           HA       PRO  36  -5.804  14.253 -14.955
  278    HB2  PRO  36           HB2      PRO  36  -3.630  13.315 -16.794
  279    HB3  PRO  36           HB3      PRO  36  -5.399  13.112 -16.948
  280    HG2  PRO  36           HG2      PRO  36  -4.039  14.950 -18.467
  281    HG3  PRO  36           HG3      PRO  36  -5.662  15.307 -17.817
  282    HD2  PRO  36           HD2      PRO  36  -2.971  16.205 -16.777
  283    HD3  PRO  36           HD3      PRO  36  -4.503  17.113 -16.913
  284    H    GLN  37           H        GLN  37  -5.388  12.488 -13.654
  285    HA   GLN  37           HA       GLN  37  -2.877  11.308 -13.084
  286    HB2  GLN  37           HB2      GLN  37  -3.987  13.007 -10.814
  287    HB3  GLN  37           HB3      GLN  37  -2.977  11.589 -10.582
  288    HG2  GLN  37           HG2      GLN  37  -2.088  14.141 -11.943
  289    HG3  GLN  37           HG3      GLN  37  -1.680  13.599 -10.333
  290   HE21  GLN  37          HE21      GLN  37  -1.029  13.204 -13.751
  291   HE22  GLN  37          HE22      GLN  37   0.418  12.226 -13.559
  292    H    GLY  38           H        GLY  38  -3.389   9.224 -12.395
  293    HA2  GLY  38           HA2      GLY  38  -6.110   8.697 -11.248
  294    HA3  GLY  38           HA3      GLY  38  -5.350   7.628 -12.412
  295    H    GLY  39           H        GLY  39  -3.777   6.178 -11.698
  296    HA2  GLY  39           HA2      GLY  39  -2.093   6.161  -9.488
  297    HA3  GLY  39           HA3      GLY  39  -3.649   5.523  -8.932
  298    H    ILE  40           H        ILE  40  -1.384   3.830  -9.063
  299    HA   ILE  40           HA       ILE  40  -2.280   1.912 -11.170
  300    HB   ILE  40           HB       ILE  40   0.438   2.235  -9.844
  301   HG12  ILE  40          HG12      ILE  40  -0.617   2.813 -12.624
  302   HG13  ILE  40          HG13      ILE  40   0.215   3.888 -11.530
  303   HG21  ILE  40          HG21      ILE  40  -0.055  -0.133 -10.095
  304   HG22  ILE  40          HG22      ILE  40  -0.463   0.099 -11.807
  305   HG23  ILE  40          HG23      ILE  40   1.196   0.342 -11.211
  306   HD11  ILE  40          HD11      ILE  40   1.398   1.645 -13.189
  307   HD12  ILE  40          HD12      ILE  40   1.731   3.381 -13.279
  308   HD13  ILE  40          HD13      ILE  40   2.315   2.446 -11.896
  309    H    ASN  41           H        ASN  41  -2.664  -0.231 -10.427
  310    HA   ASN  41           HA       ASN  41  -3.305  -0.432  -7.522
  311    HB2  ASN  41           HB2      ASN  41  -4.363  -1.981  -9.931
  312    HB3  ASN  41           HB3      ASN  41  -4.772  -2.354  -8.272
  313   HD21  ASN  41          HD22      ASN  41  -5.272  -0.105 -10.928
  314   HD22  ASN  41          HD21      ASN  41  -6.554   0.831 -10.153
  315    HA   PRO  42           HA       PRO  42  -0.053  -3.143  -6.811
  316    HB2  PRO  42           HB2      PRO  42  -1.063  -5.146  -5.163
  317    HB3  PRO  42           HB3      PRO  42  -0.660  -3.483  -4.636
  318    HG2  PRO  42           HG2      PRO  42  -3.365  -4.578  -5.463
  319    HG3  PRO  42           HG3      PRO  42  -2.967  -3.578  -4.029
  320    HD2  PRO  42           HD2      PRO  42  -4.008  -2.457  -6.239
  321    HD3  PRO  42           HD3      PRO  42  -2.683  -1.629  -5.371
  322    H    GLY  43           H        GLY  43   0.785  -4.195  -8.370
  323    HA2  GLY  43           HA2      GLY  43   1.424  -6.082  -9.582
  324    HA3  GLY  43           HA3      GLY  43  -0.066  -6.910  -9.109
  325    H    GLU  44           H        GLU  44  -0.810  -3.777 -10.230
  326    HA   GLU  44           HA       GLU  44  -1.667  -4.755 -12.902
  327    HB2  GLU  44           HB2      GLU  44  -3.184  -3.467 -11.385
  328    HB3  GLU  44           HB3      GLU  44  -2.085  -2.080 -11.522
  329    HG2  GLU  44           HG2      GLU  44  -2.491  -1.961 -13.928
  330    HG3  GLU  44           HG3      GLU  44  -3.480  -3.424 -13.863
  331    H    SER  45           H        SER  45  -0.365  -4.414 -14.666
  332    HA   SER  45           HA       SER  45   2.109  -2.973 -14.407
  333    HB2  SER  45           HB2      SER  45   2.126  -3.726 -16.948
  334    HB3  SER  45           HB3      SER  45   2.457  -4.825 -15.605
  335    HG   SER  45           HG       SER  45   0.951  -5.949 -16.618
  336    H    ALA  46           H        ALA  46   2.804  -1.343 -15.990
  337    HA   ALA  46           HA       ALA  46   1.418   0.978 -15.473
  338    HB1  ALA  46           HB1      ALA  46   2.938   2.016 -17.114
  339    HB2  ALA  46           HB2      ALA  46   3.808   0.802 -16.148
  340    HB3  ALA  46           HB3      ALA  46   3.290   0.406 -17.811
  341    H    GLU  47           H        GLU  47   1.205  -0.986 -18.494
  342    HA   GLU  47           HA       GLU  47  -0.350   1.057 -19.850
  343    HB2  GLU  47           HB2      GLU  47   0.161  -1.874 -20.476
  344    HB3  GLU  47           HB3      GLU  47  -0.776  -0.795 -21.512
  345    HG2  GLU  47           HG2      GLU  47   1.144   0.672 -21.825
  346    HG3  GLU  47           HG3      GLU  47   2.117  -0.294 -20.713
  347    H    GLN  48           H        GLN  48  -1.061  -1.982 -18.119
  348    HA   GLN  48           HA       GLN  48  -3.859  -2.079 -18.572
  349    HB2  GLN  48           HB2      GLN  48  -2.059  -3.224 -16.386
  350    HB3  GLN  48           HB3      GLN  48  -3.778  -3.528 -16.445
  351    HG2  GLN  48           HG2      GLN  48  -2.356  -5.333 -17.473
  352    HG3  GLN  48           HG3      GLN  48  -3.657  -4.718 -18.487
  353   HE21  GLN  48          HE22      GLN  48  -0.078  -4.247 -17.933
  354   HE22  GLN  48          HE21      GLN  48   0.279  -3.876 -19.604
  355    H    ALA  49           H        ALA  49  -1.961  -0.558 -15.903
  356    HA   ALA  49           HA       ALA  49  -4.201   0.598 -14.566
  357    HB1  ALA  49           HB1      ALA  49  -2.528   2.057 -13.556
  358    HB2  ALA  49           HB2      ALA  49  -1.942   0.379 -13.562
  359    HB3  ALA  49           HB3      ALA  49  -1.314   1.545 -14.750
  360    H    MET  50           H        MET  50  -2.196   1.721 -17.355
  361    HA   MET  50           HA       MET  50  -3.215   4.373 -17.337
  362    HB2  MET  50           HB2      MET  50  -1.147   3.766 -18.435
  363    HB3  MET  50           HB3      MET  50  -1.990   2.739 -19.585
  364    HG2  MET  50           HG2      MET  50  -2.440   5.716 -19.313
  365    HG3  MET  50           HG3      MET  50  -1.309   4.987 -20.428
  366    HE1  MET  50           HE1      MET  50  -2.499   2.629 -21.882
  367    HE2  MET  50           HE2      MET  50  -3.358   3.413 -23.222
  368    HE3  MET  50           HE3      MET  50  -1.771   4.030 -22.710
  369    H    TYR  51           H        TYR  51  -4.452   1.406 -18.975
  370    HA   TYR  51           HA       TYR  51  -6.723   2.843 -19.973
  371    HB2  TYR  51           HB2      TYR  51  -6.555  -0.113 -19.376
  372    HB3  TYR  51           HB3      TYR  51  -7.800   0.696 -20.321
  373    HD1  TYR  51           HD2      TYR  51  -7.193   1.782 -22.568
  374    HD2  TYR  51           HD1      TYR  51  -4.451  -0.620 -20.299
  375    HE1  TYR  51           HE2      TYR  51  -5.865   1.419 -24.593
  376    HE2  TYR  51           HE1      TYR  51  -3.002  -0.892 -22.276
  377    HH   TYR  51           HH       TYR  51  -3.986   0.333 -25.545
  378    H    ARG  52           H        ARG  52  -6.000   1.571 -16.735
  379    HA   ARG  52           HA       ARG  52  -8.754   1.534 -15.852
  380    HB2  ARG  52           HB2      ARG  52  -6.710   0.414 -14.705
  381    HB3  ARG  52           HB3      ARG  52  -6.318   2.013 -14.087
  382    HG2  ARG  52           HG2      ARG  52  -7.514   1.088 -12.337
  383    HG3  ARG  52           HG3      ARG  52  -8.707   2.105 -13.131
  384    HD2  ARG  52           HD2      ARG  52  -9.727   0.002 -12.529
  385    HD3  ARG  52           HD3      ARG  52  -9.597   0.054 -14.301
  386    HE   ARG  52           HE       ARG  52  -7.244  -1.187 -13.350
  387   HH11  ARG  52          HH11      ARG  52 -10.730  -1.987 -13.262
  388   HH12  ARG  52          HH12      ARG  52 -10.441  -3.691 -13.231
  389   HH21  ARG  52          HH21      ARG  52  -6.884  -3.277 -13.330
  390   HH22  ARG  52          HH22      ARG  52  -8.155  -4.491 -13.249
  391    H    ALA  53           H        ALA  53  -6.053   3.967 -15.605
  392    HA   ALA  53           HA       ALA  53  -7.742   5.961 -14.442
  393    HB1  ALA  53           HB1      ALA  53  -5.089   6.173 -15.901
  394    HB2  ALA  53           HB2      ALA  53  -5.881   7.519 -15.047
  395    HB3  ALA  53           HB3      ALA  53  -5.365   6.069 -14.151
  396    H    LEU  54           H        LEU  54  -7.070   5.098 -17.823
  397    HA   LEU  54           HA       LEU  54  -8.203   7.328 -19.158
  398    HB2  LEU  54           HB2      LEU  54  -6.963   5.468 -20.180
  399    HB3  LEU  54           HB3      LEU  54  -8.245   4.368 -19.658
  400    HG   LEU  54           HG       LEU  54  -9.825   5.328 -21.227
  401   HD11  LEU  54          HD11      LEU  54  -9.004   6.912 -22.938
  402   HD12  LEU  54          HD12      LEU  54  -8.917   7.642 -21.333
  403   HD13  LEU  54          HD13      LEU  54  -7.433   7.027 -22.103
  404   HD21  LEU  54          HD21      LEU  54  -8.598   3.417 -21.715
  405   HD22  LEU  54          HD22      LEU  54  -8.763   4.395 -23.187
  406   HD23  LEU  54          HD23      LEU  54  -7.200   4.352 -22.316
  407    H    PHE  55           H        PHE  55  -9.648   4.432 -17.752
  408    HA   PHE  55           HA       PHE  55 -12.395   5.159 -18.284
  409    HB2  PHE  55           HB2      PHE  55 -12.454   2.960 -18.014
  410    HB3  PHE  55           HB3      PHE  55 -10.980   2.909 -17.082
  411    HD1  PHE  55           HD1      PHE  55 -14.622   3.813 -16.705
  412    HD2  PHE  55           HD2      PHE  55 -11.036   2.339 -14.818
  413    HE1  PHE  55           HE1      PHE  55 -15.887   3.371 -14.602
  414    HE2  PHE  55           HE2      PHE  55 -12.310   1.893 -12.734
  415    HZ   PHE  55           HZ       PHE  55 -14.743   2.406 -12.633
  416    H    GLU  56           H        GLU  56 -10.449   5.245 -15.212
  417    HA   GLU  56           HA       GLU  56 -12.502   6.285 -13.653
  418    HB2  GLU  56           HB2      GLU  56  -9.497   6.650 -13.355
  419    HB3  GLU  56           HB3      GLU  56 -10.669   7.108 -12.124
  420    HG2  GLU  56           HG2      GLU  56 -11.428   4.820 -11.864
  421    HG3  GLU  56           HG3      GLU  56 -10.387   4.264 -13.165
  422    H    GLU  57           H        GLU  57 -10.130   8.075 -15.656
  423    HA   GLU  57           HA       GLU  57 -11.160  10.642 -14.660
  424    HB2  GLU  57           HB2      GLU  57  -8.904  10.183 -16.661
  425    HB3  GLU  57           HB3      GLU  57  -9.315  11.659 -15.806
  426    HG2  GLU  57           HG2      GLU  57  -8.781  10.396 -13.645
  427    HG3  GLU  57           HG3      GLU  57  -8.089   9.137 -14.668
  428    H    VAL  58           H        VAL  58 -10.804   8.971 -17.867
  429    HA   VAL  58           HA       VAL  58 -12.305  11.206 -19.051
  430    HB   VAL  58           HB       VAL  58 -11.001   9.065 -20.707
  431   HG11  VAL  58          HG11      VAL  58 -11.212  12.096 -20.995
  432   HG12  VAL  58          HG12      VAL  58 -10.562  10.964 -22.203
  433   HG13  VAL  58          HG13      VAL  58 -12.274  10.903 -21.760
  434   HG21  VAL  58          HG21      VAL  58  -9.147   9.522 -19.153
  435   HG22  VAL  58          HG22      VAL  58  -8.832  10.376 -20.656
  436   HG23  VAL  58          HG23      VAL  58  -9.435  11.272 -19.252
  437    H    GLY  59           H        GLY  59 -12.931   7.934 -18.066
  438    HA2  GLY  59           HA2      GLY  59 -14.675   6.539 -18.405
  439    HA3  GLY  59           HA3      GLY  59 -15.614   7.913 -19.001
  440    H    LEU  60           H        LEU  60 -12.698   6.098 -19.979
  441    HA   LEU  60           HA       LEU  60 -13.826   5.384 -22.613
  442    HB2  LEU  60           HB2      LEU  60 -11.212   6.797 -22.001
  443    HB3  LEU  60           HB3      LEU  60 -11.462   5.891 -23.486
  444    HG   LEU  60           HG       LEU  60 -12.888   8.425 -22.576
  445   HD11  LEU  60          HD11      LEU  60 -10.604   8.742 -23.402
  446   HD12  LEU  60          HD12      LEU  60 -10.964   7.794 -24.861
  447   HD13  LEU  60          HD13      LEU  60 -11.741   9.357 -24.608
  448   HD21  LEU  60          HD21      LEU  60 -13.461   6.693 -25.013
  449   HD22  LEU  60          HD22      LEU  60 -14.582   7.228 -23.777
  450   HD23  LEU  60          HD23      LEU  60 -13.902   8.394 -24.916
  451    H    SER  61           H        SER  61 -12.634   3.441 -23.438
  452    HA   SER  61           HA       SER  61 -11.425   1.860 -21.199
  453    HB2  SER  61           HB2      SER  61 -13.861   1.465 -21.775
  454    HB3  SER  61           HB3      SER  61 -13.322   0.858 -23.353
  455    HG   SER  61           HG       SER  61 -13.610  -0.774 -21.655
  456    H    ARG  62           H        ARG  62 -10.810  -0.378 -22.459
  457    HA   ARG  62           HA       ARG  62  -8.224   0.070 -23.550
  458    HB2  ARG  62           HB2      ARG  62  -9.869  -2.488 -23.390
  459    HB3  ARG  62           HB3      ARG  62  -8.122  -2.396 -23.638
  460    HG2  ARG  62           HG2      ARG  62  -7.802  -1.431 -21.414
  461    HG3  ARG  62           HG3      ARG  62  -9.552  -1.502 -21.105
  462    HD2  ARG  62           HD2      ARG  62  -9.476  -3.966 -21.429
  463    HD3  ARG  62           HD3      ARG  62  -7.723  -3.862 -21.704
  464    HE   ARG  62           HE       ARG  62  -8.522  -2.652 -19.196
  465   HH11  ARG  62          HH11      ARG  62  -7.911  -5.818 -20.691
  466   HH12  ARG  62          HH12      ARG  62  -7.489  -6.600 -19.211
  467   HH21  ARG  62          HH21      ARG  62  -7.945  -3.688 -17.214
  468   HH22  ARG  62          HH22      ARG  62  -7.529  -5.364 -17.193
  469    H    LYS  63           H        LYS  63 -10.128   1.258 -25.323
  470    HA   LYS  63           HA       LYS  63  -9.489  -0.030 -27.889
  471    HB2  LYS  63           HB2      LYS  63 -11.774  -0.582 -28.493
  472    HB3  LYS  63           HB3      LYS  63 -11.316  -1.428 -27.013
  473    HG2  LYS  63           HG2      LYS  63 -12.613   0.198 -25.653
  474    HG3  LYS  63           HG3      LYS  63 -13.018   1.109 -27.105
  475    HD2  LYS  63           HD2      LYS  63 -14.904  -0.232 -26.460
  476    HD3  LYS  63           HD3      LYS  63 -14.272  -0.815 -28.004
  477    HE2  LYS  63           HE2      LYS  63 -13.083  -2.661 -26.829
  478    HE3  LYS  63           HE3      LYS  63 -13.669  -2.059 -25.272
  479    HZ1  LYS  63           HZ1      LYS  63 -15.940  -2.537 -26.019
  480    HZ2  LYS  63           HZ2      LYS  63 -15.394  -3.087 -27.465
  481    HZ3  LYS  63           HZ3      LYS  63 -15.025  -3.887 -26.094
  482    H    ASP  64           H        ASP  64 -10.575   2.633 -26.021
  483    HA   ASP  64           HA       ASP  64 -11.881   4.091 -28.189
  484    HB2  ASP  64           HB2      ASP  64 -11.354   4.441 -25.221
  485    HB3  ASP  64           HB3      ASP  64 -11.972   5.762 -26.163
  486    H    VAL  65           H        VAL  65  -8.657   3.660 -27.699
  487    HA   VAL  65           HA       VAL  65  -7.894   6.420 -28.348
  488    HB   VAL  65           HB       VAL  65  -6.316   6.520 -26.466
  489   HG11  VAL  65          HG11      VAL  65  -9.143   6.219 -25.397
  490   HG12  VAL  65          HG12      VAL  65  -7.878   7.326 -24.846
  491   HG13  VAL  65          HG13      VAL  65  -8.627   7.581 -26.419
  492   HG21  VAL  65          HG21      VAL  65  -6.113   4.103 -25.922
  493   HG22  VAL  65          HG22      VAL  65  -6.576   5.033 -24.499
  494   HG23  VAL  65          HG23      VAL  65  -7.796   4.083 -25.355
  495    H    ARG  66           H        ARG  66  -5.475   6.532 -28.624
  496    HA   ARG  66           HA       ARG  66  -4.329   4.033 -29.813
  497    HB2  ARG  66           HB2      ARG  66  -5.418   5.316 -31.581
  498    HB3  ARG  66           HB3      ARG  66  -4.806   6.835 -30.947
  499    HG2  ARG  66           HG2      ARG  66  -3.613   6.277 -32.940
  500    HG3  ARG  66           HG3      ARG  66  -2.521   6.229 -31.565
  501    HD2  ARG  66           HD2      ARG  66  -3.829   3.652 -32.439
  502    HD3  ARG  66           HD3      ARG  66  -2.583   4.334 -33.489
  503    HE   ARG  66           HE       ARG  66  -1.283   4.399 -31.119
  504   HH11  ARG  66          HH11      ARG  66  -2.974   1.740 -32.790
  505   HH12  ARG  66          HH12      ARG  66  -1.855   0.537 -32.257
  506   HH21  ARG  66          HH21      ARG  66   0.185   2.860 -30.473
  507   HH22  ARG  66          HH22      ARG  66  -0.021   1.181 -30.874
  508    H    ILE  67           H        ILE  67  -2.446   3.761 -28.470
  509    HA   ILE  67           HA       ILE  67  -1.188   6.051 -27.215
  510    HB   ILE  67           HB       ILE  67  -0.237   3.193 -27.637
  511   HG12  ILE  67          HG12      ILE  67  -1.314   4.335 -25.039
  512   HG13  ILE  67          HG13      ILE  67  -2.429   3.665 -26.224
  513   HG21  ILE  67          HG21      ILE  67   0.793   5.379 -25.772
  514   HG22  ILE  67          HG22      ILE  67   1.318   3.678 -25.740
  515   HG23  ILE  67          HG23      ILE  67   1.656   4.654 -27.158
  516   HD11  ILE  67          HD11      ILE  67  -1.224   1.512 -26.188
  517   HD12  ILE  67          HD12      ILE  67  -0.100   2.150 -24.958
  518   HD13  ILE  67          HD13      ILE  67  -1.814   1.966 -24.577
  519    H    LEU  68           H        LEU  68   0.275   7.406 -28.042
  520    HA   LEU  68           HA       LEU  68   1.571   6.650 -30.637
  521    HB2  LEU  68           HB2      LEU  68   0.433   9.192 -29.647
  522    HB3  LEU  68           HB3      LEU  68   2.083   9.375 -30.217
  523    HG   LEU  68           HG       LEU  68   0.380   9.847 -31.944
  524   HD11  LEU  68          HD11      LEU  68   2.188   7.486 -32.633
  525   HD12  LEU  68          HD12      LEU  68   1.457   8.632 -33.773
  526   HD13  LEU  68          HD13      LEU  68   2.665   9.196 -32.608
  527   HD21  LEU  68          HD21      LEU  68  -0.170   6.850 -32.006
  528   HD22  LEU  68          HD22      LEU  68  -1.222   8.041 -31.210
  529   HD23  LEU  68          HD23      LEU  68  -0.939   8.128 -32.967
  530    H    ALA  69           H        ALA  69   2.228   7.699 -27.290
  531    HA   ALA  69           HA       ALA  69   5.010   6.917 -27.474
  532    HB1  ALA  69           HB1      ALA  69   4.295   9.880 -27.085
  533    HB2  ALA  69           HB2      ALA  69   5.916   9.167 -26.957
  534    HB3  ALA  69           HB3      ALA  69   5.089   9.204 -28.519
  535    H    SER  70           H        SER  70   6.049   7.509 -25.216
  536    HA   SER  70           HA       SER  70   4.210   8.151 -23.075
  537    HB2  SER  70           HB2      SER  70   4.043   5.615 -23.437
  538    HB3  SER  70           HB3      SER  70   5.723   5.522 -22.864
  539    HG   SER  70           HG       SER  70   3.851   5.338 -21.288
  540    H    THR  71           H        THR  71   5.597   8.513 -20.994
  541    HA   THR  71           HA       THR  71   7.853  10.066 -21.786
  542    HB   THR  71           HB       THR  71   8.195  10.234 -19.233
  543    HG1  THR  71           HG1      THR  71   7.050   8.445 -18.527
  544   HG21  THR  71          HG21      THR  71   6.275  11.732 -18.986
  545   HG22  THR  71          HG22      THR  71   7.027  11.934 -20.579
  546   HG23  THR  71          HG23      THR  71   5.522  11.026 -20.437
  547    H    ARG  72           H        ARG  72  10.047   9.772 -21.507
  548    HA   ARG  72           HA       ARG  72  10.916   7.160 -22.172
  549    HB2  ARG  72           HB2      ARG  72  12.389   9.681 -21.329
  550    HB3  ARG  72           HB3      ARG  72  13.241   8.207 -21.822
  551    HG2  ARG  72           HG2      ARG  72  12.137   8.225 -24.008
  552    HG3  ARG  72           HG3      ARG  72  11.202   9.663 -23.580
  553    HD2  ARG  72           HD2      ARG  72  14.241   9.554 -23.679
  554    HD3  ARG  72           HD3      ARG  72  13.221  10.106 -25.015
  555    HE   ARG  72           HE       ARG  72  12.280  11.775 -23.228
  556   HH11  ARG  72          HH11      ARG  72  15.738  10.924 -23.572
  557   HH12  ARG  72          HH12      ARG  72  16.277  12.445 -22.961
  558   HH21  ARG  72          HH21      ARG  72  12.926  13.634 -22.499
  559   HH22  ARG  72          HH22      ARG  72  14.614  14.075 -22.272
  560    H    ASN  73           H        ASN  73  10.709   8.696 -19.012
  561    HA   ASN  73           HA       ASN  73  10.944   6.142 -17.759
  562    HB2  ASN  73           HB2      ASN  73  12.646   6.568 -16.166
  563    HB3  ASN  73           HB3      ASN  73  13.372   6.873 -17.731
  564   HD21  ASN  73          HD22      ASN  73  13.534   9.276 -18.410
  565   HD22  ASN  73          HD21      ASN  73  13.762  10.449 -17.139
  566    H    TRP  74           H        TRP  74  10.431   6.507 -15.284
  567    HA   TRP  74           HA       TRP  74   7.948   7.914 -15.213
  568    HB2  TRP  74           HB2      TRP  74   9.620   6.790 -12.927
  569    HB3  TRP  74           HB3      TRP  74   7.945   7.318 -12.833
  570    HD1  TRP  74           HD1      TRP  74  10.116   4.519 -14.328
  571    HE1  TRP  74           HE1      TRP  74   8.662   2.518 -14.925
  572    HE3  TRP  74           HE3      TRP  74   5.531   6.416 -13.057
  573    HZ2  TRP  74           HZ2      TRP  74   5.868   1.903 -15.123
  574    HZ3  TRP  74           HZ3      TRP  74   3.483   5.084 -13.462
  575    HH2  TRP  74           HH2      TRP  74   3.606   2.890 -14.606
  576    H    LEU  75           H        LEU  75   7.529   9.986 -14.750
  577    HA   LEU  75           HA       LEU  75   9.673  11.799 -13.839
  578    HB2  LEU  75           HB2      LEU  75   6.795  12.194 -14.759
  579    HB3  LEU  75           HB3      LEU  75   7.750  13.503 -14.059
  580    HG   LEU  75           HG       LEU  75   8.533  11.938 -16.560
  581   HD11  LEU  75          HD11      LEU  75   7.331  14.724 -16.264
  582   HD12  LEU  75          HD12      LEU  75   7.895  13.976 -17.784
  583   HD13  LEU  75          HD13      LEU  75   6.526  13.275 -16.909
  584   HD21  LEU  75          HD21      LEU  75  10.153  13.818 -16.890
  585   HD22  LEU  75          HD22      LEU  75   9.744  14.438 -15.273
  586   HD23  LEU  75          HD23      LEU  75  10.532  12.848 -15.475
  587    H    ARG  76           H        ARG  76   9.269  13.192 -11.968
  588    HA   ARG  76           HA       ARG  76   7.575  11.969  -9.832
  589    HB2  ARG  76           HB2      ARG  76  10.607  12.223  -9.884
  590    HB3  ARG  76           HB3      ARG  76   9.736  12.340  -8.356
  591    HG2  ARG  76           HG2      ARG  76   8.870  10.135  -8.508
  592    HG3  ARG  76           HG3      ARG  76   9.386   9.944 -10.195
  593    HD2  ARG  76           HD2      ARG  76  11.654   9.805  -9.652
  594    HD3  ARG  76           HD3      ARG  76  11.436  10.533  -8.062
  595    HE   ARG  76           HE       ARG  76  10.621   7.765  -8.877
  596   HH11  ARG  76          HH11      ARG  76  11.583   9.989  -6.306
  597   HH12  ARG  76          HH12      ARG  76  11.574   8.839  -5.036
  598   HH21  ARG  76          HH21      ARG  76  10.485   6.181  -7.221
  599   HH22  ARG  76          HH22      ARG  76  10.623   6.594  -5.567
  600    H    TYR  77           H        TYR  77   6.733  13.527  -8.489
  601    HA   TYR  77           HA       TYR  77   8.138  16.049  -8.109
  602    HB2  TYR  77           HB2      TYR  77   6.269  17.490  -8.603
  603    HB3  TYR  77           HB3      TYR  77   6.731  16.605 -10.036
  604    HD1  TYR  77           HD2      TYR  77   4.248  16.475  -7.185
  605    HD2  TYR  77           HD1      TYR  77   4.975  15.713 -11.374
  606    HE1  TYR  77           HE2      TYR  77   1.918  15.788  -7.449
  607    HE2  TYR  77           HE1      TYR  77   2.609  15.099 -11.669
  608    HH   TYR  77           HH       TYR  77   0.229  15.051  -8.965
  609    H    LYS  78           H        LYS  78   7.341  17.184  -6.321
  610    HA   LYS  78           HA       LYS  78   6.492  15.233  -4.250
  611    HB2  LYS  78           HB2      LYS  78   8.773  16.369  -4.221
  612    HB3  LYS  78           HB3      LYS  78   7.918  17.900  -3.992
  613    HG2  LYS  78           HG2      LYS  78   6.825  16.607  -1.926
  614    HG3  LYS  78           HG3      LYS  78   8.211  15.537  -2.104
  615    HD2  LYS  78           HD2      LYS  78   8.306  18.564  -1.882
  616    HD3  LYS  78           HD3      LYS  78   8.471  17.498  -0.490
  617    HE2  LYS  78           HE2      LYS  78  10.367  17.539  -2.900
  618    HE3  LYS  78           HE3      LYS  78  10.632  18.454  -1.421
  619    HZ1  LYS  78           HZ1      LYS  78  10.731  16.361  -0.186
  620    HZ2  LYS  78           HZ2      LYS  78  10.536  15.489  -1.573
  621    HZ3  LYS  78           HZ3      LYS  78  11.862  16.407  -1.357
  622    H    LEU  79           H        LEU  79   4.918  15.859  -2.769
  623    HA   LEU  79           HA       LEU  79   2.878  17.803  -3.641
  624    HB2  LEU  79           HB2      LEU  79   3.053  16.033  -1.164
  625    HB3  LEU  79           HB3      LEU  79   1.643  16.950  -1.675
  626    HG   LEU  79           HG       LEU  79   2.880  14.626  -3.201
  627   HD11  LEU  79          HD11      LEU  79   0.335  14.711  -1.546
  628   HD12  LEU  79          HD12      LEU  79   0.932  13.333  -2.505
  629   HD13  LEU  79          HD13      LEU  79   1.857  13.885  -1.105
  630   HD21  LEU  79          HD21      LEU  79   0.277  16.113  -3.718
  631   HD22  LEU  79          HD22      LEU  79   1.743  16.181  -4.734
  632   HD23  LEU  79          HD23      LEU  79   0.852  14.665  -4.576
  633    HA   PRO  80           HA       PRO  80   4.725  20.950  -0.918
  634    HB2  PRO  80           HB2      PRO  80   1.818  21.799  -0.674
  635    HB3  PRO  80           HB3      PRO  80   3.275  22.822  -0.899
  636    HG2  PRO  80           HG2      PRO  80   1.689  22.270  -3.011
  637    HG3  PRO  80           HG3      PRO  80   3.466  22.154  -3.207
  638    HD2  PRO  80           HD2      PRO  80   1.484  19.913  -2.712
  639    HD3  PRO  80           HD3      PRO  80   2.837  19.986  -3.881
  640    H    LYS  81           H        LYS  81   4.723  21.277   1.479
  641    HA   LYS  81           HA       LYS  81   4.408  18.879   2.725
  642    HB2  LYS  81           HB2      LYS  81   5.391  21.400   3.495
  643    HB3  LYS  81           HB3      LYS  81   4.136  21.088   4.694
  644    HG2  LYS  81           HG2      LYS  81   6.530  19.377   4.022
  645    HG3  LYS  81           HG3      LYS  81   6.226  20.300   5.500
  646    HD2  LYS  81           HD2      LYS  81   4.231  18.788   5.943
  647    HD3  LYS  81           HD3      LYS  81   4.717  17.773   4.597
  648    HE2  LYS  81           HE2      LYS  81   6.308  18.380   7.148
  649    HE3  LYS  81           HE3      LYS  81   5.522  16.854   6.746
  650    HZ1  LYS  81           HZ1      LYS  81   7.877  16.719   6.348
  651    HZ2  LYS  81           HZ2      LYS  81   7.129  16.596   4.905
  652    HZ3  LYS  81           HZ3      LYS  81   7.880  17.995   5.344
  653    H    ARG  82           H        ARG  82   2.122  21.563   2.979
  654    HA   ARG  82           HA       ARG  82   0.330  20.363   4.818
  655    HB2  ARG  82           HB2      ARG  82  -1.185  22.180   4.208
  656    HB3  ARG  82           HB3      ARG  82   0.462  22.748   4.406
  657    HG2  ARG  82           HG2      ARG  82   0.473  22.338   1.681
  658    HG3  ARG  82           HG3      ARG  82  -1.248  22.584   1.938
  659    HD2  ARG  82           HD2      ARG  82  -0.268  24.701   1.400
  660    HD3  ARG  82           HD3      ARG  82  -0.706  24.742   3.118
  661    HE   ARG  82           HE       ARG  82   2.033  23.883   2.799
  662   HH11  ARG  82          HH21      ARG  82   0.030  26.811   2.539
  663   HH12  ARG  82          HH22      ARG  82   1.316  27.902   2.921
  664   HH21  ARG  82          HH11      ARG  82   3.757  25.344   3.316
  665   HH22  ARG  82          HH12      ARG  82   3.474  27.043   3.359
  666    H    LEU  83           H        LEU  83   0.858  19.573   1.518
  667    HA   LEU  83           HA       LEU  83  -1.800  18.354   1.190
  668    HB2  LEU  83           HB2      LEU  83  -0.786  19.957  -0.512
  669    HB3  LEU  83           HB3      LEU  83   0.428  18.733  -0.839
  670    HG   LEU  83           HG       LEU  83  -1.399  17.177  -1.613
  671   HD11  LEU  83          HD11      LEU  83  -3.181  19.608  -1.125
  672   HD12  LEU  83          HD12      LEU  83  -3.655  18.171  -2.057
  673   HD13  LEU  83          HD13      LEU  83  -3.319  18.022  -0.334
  674   HD21  LEU  83          HD21      LEU  83  -1.903  18.417  -3.692
  675   HD22  LEU  83          HD22      LEU  83  -1.303  19.917  -2.934
  676   HD23  LEU  83          HD23      LEU  83  -0.204  18.552  -3.229
  677    H    VAL  84           H        VAL  84   1.302  17.389   2.415
  678    HA   VAL  84           HA       VAL  84   1.501  14.788   1.299
  679    HB   VAL  84           HB       VAL  84   2.370  16.015   3.945
  680   HG11  VAL  84          HG11      VAL  84   3.876  14.065   4.231
  681   HG12  VAL  84          HG12      VAL  84   2.183  13.631   4.401
  682   HG13  VAL  84          HG13      VAL  84   3.049  13.234   2.895
  683   HG21  VAL  84          HG21      VAL  84   3.887  15.210   1.413
  684   HG22  VAL  84          HG22      VAL  84   3.486  16.867   1.876
  685   HG23  VAL  84          HG23      VAL  84   4.609  15.929   2.867
  686    H    ARG  85           H        ARG  85   0.697  12.858   2.036
  687    HA   ARG  85           HA       ARG  85  -2.098  13.156   2.757
  688    HB2  ARG  85           HB2      ARG  85  -0.635  10.513   2.326
  689    HB3  ARG  85           HB3      ARG  85  -2.358  10.833   2.181
  690    HG2  ARG  85           HG2      ARG  85  -0.128  11.612   0.285
  691    HG3  ARG  85           HG3      ARG  85  -1.539  10.619  -0.026
  692    HD2  ARG  85           HD2      ARG  85  -1.437  13.630   0.336
  693    HD3  ARG  85           HD3      ARG  85  -1.792  12.745  -1.146
  694    HE   ARG  85           HE       ARG  85  -3.810  11.832   0.116
  695   HH11  ARG  85          HH21      ARG  85  -2.570  15.161   0.600
  696   HH12  ARG  85          HH22      ARG  85  -4.113  15.784   1.087
  697   HH21  ARG  85          HH11      ARG  85  -5.834  12.702   0.754
  698   HH22  ARG  85          HH12      ARG  85  -5.998  14.368   1.159
  699    H    TRP  86           H        TRP  86   0.633  11.679   4.385
  700    HA   TRP  86           HA       TRP  86   1.053  10.812   6.409
  701    HB2  TRP  86           HB2      TRP  86  -1.241  12.445   7.467
  702    HB3  TRP  86           HB3      TRP  86   0.122  11.798   8.369
  703    HD1  TRP  86           HD1      TRP  86  -0.775  14.550   5.911
  704    HE1  TRP  86           HE1      TRP  86   0.922  16.461   6.047
  705    HE3  TRP  86           HE3      TRP  86   2.625  12.325   9.008
  706    HZ2  TRP  86           HZ2      TRP  86   3.355  17.027   7.534
  707    HZ3  TRP  86           HZ3      TRP  86   4.616  13.576   9.789
  708    HH2  TRP  86           HH2      TRP  86   4.985  15.924   9.079
  709    H    ASP  87           H        ASP  87  -1.560   9.865   4.765
  710    HA   ASP  87           HA       ASP  87  -2.633   8.041   6.883
  711    HB2  ASP  87           HB2      ASP  87  -4.145   9.770   6.016
  712    HB3  ASP  87           HB3      ASP  87  -3.903   9.174   4.369
  713    H    THR  88           H        THR  88  -0.896   8.015   3.837
  714    HA   THR  88           HA       THR  88  -2.102   5.662   2.773
  715    HB   THR  88           HB       THR  88  -0.028   5.894   1.240
  716    HG1  THR  88           HG1      THR  88   1.390   7.063   2.275
  717   HG21  THR  88          HG21      THR  88  -0.881   7.905   0.132
  718   HG22  THR  88          HG22      THR  88  -2.228   6.861   0.621
  719   HG23  THR  88          HG23      THR  88  -1.842   8.314   1.566
  720    H    LYS  89           H        LYS  89   0.812   6.281   4.635
  721    HA   LYS  89           HA       LYS  89   2.397   4.987   5.688
  722    HB2  LYS  89           HB2      LYS  89  -0.151   3.493   6.322
  723    HB3  LYS  89           HB3      LYS  89   1.410   3.178   7.103
  724    HG2  LYS  89           HG2      LYS  89   1.561   5.505   7.858
  725    HG3  LYS  89           HG3      LYS  89   0.042   5.910   7.043
  726    HD2  LYS  89           HD2      LYS  89  -1.193   4.363   8.472
  727    HD3  LYS  89           HD3      LYS  89   0.289   3.882   9.312
  728    HE2  LYS  89           HE2      LYS  89  -0.675   6.777   9.171
  729    HE3  LYS  89           HE3      LYS  89  -1.243   5.660  10.419
  730    HZ1  LYS  89           HZ1      LYS  89   1.053   5.384  11.150
  731    HZ2  LYS  89           HZ2      LYS  89   1.596   6.443  10.019
  732    HZ3  LYS  89           HZ3      LYS  89   0.613   6.953  11.216
  733    HA   PRO  90           HA       PRO  90   4.583   4.594   4.867
  734    HB2  PRO  90           HB2      PRO  90   5.140   4.555   1.890
  735    HB3  PRO  90           HB3      PRO  90   6.302   4.655   3.253
  736    HG2  PRO  90           HG2      PRO  90   5.865   2.278   2.062
  737    HG3  PRO  90           HG3      PRO  90   5.902   2.363   3.851
  738    HD2  PRO  90           HD2      PRO  90   3.496   2.297   2.019
  739    HD3  PRO  90           HD3      PRO  90   3.790   1.382   3.523
  740    H    VAL  91           H        VAL  91   4.585   6.795   4.991
  741    HA   VAL  91           HA       VAL  91   2.404   8.367   4.137
  742    HB   VAL  91           HB       VAL  91   5.185   9.086   5.179
  743   HG11  VAL  91          HG11      VAL  91   4.174  11.294   5.803
  744   HG12  VAL  91          HG12      VAL  91   4.331  11.071   4.061
  745   HG13  VAL  91          HG13      VAL  91   2.744  10.883   4.835
  746   HG21  VAL  91          HG21      VAL  91   3.961   9.464   7.318
  747   HG22  VAL  91          HG22      VAL  91   2.473   8.853   6.567
  748   HG23  VAL  91          HG23      VAL  91   3.873   7.786   6.794
  749    H    CYS  92           H        CYS  92   1.970   9.140   2.176
  750    HA   CYS  92           HA       CYS  92   3.993   8.909   0.065
  751    HB2  CYS  92           HB2      CYS  92   1.767   7.921  -0.191
  752    HB3  CYS  92           HB3      CYS  92   1.018   9.520  -0.014
  753    HG   CYS  92           HG       CYS  92   0.922   9.003  -2.524
  754    H    ILE  93           H        ILE  93   5.074  10.567  -0.698
  755    HA   ILE  93           HA       ILE  93   4.296  13.351   0.021
  756    HB   ILE  93           HB       ILE  93   6.735  13.815   0.145
  757   HG12  ILE  93          HG12      ILE  93   8.270  11.876   0.619
  758   HG13  ILE  93          HG13      ILE  93   7.039  10.780  -0.003
  759   HG21  ILE  93          HG21      ILE  93   5.793  11.655   2.080
  760   HG22  ILE  93          HG22      ILE  93   7.036  12.881   2.371
  761   HG23  ILE  93          HG23      ILE  93   5.359  13.380   2.157
  762   HD11  ILE  93          HD11      ILE  93   7.321  11.596  -2.235
  763   HD12  ILE  93          HD12      ILE  93   8.270  13.003  -1.678
  764   HD13  ILE  93          HD13      ILE  93   8.931  11.361  -1.553
  765    H    GLY  94           H        GLY  94   4.544  11.296  -2.672
  766    HA2  GLY  94           HA2      GLY  94   4.428  13.630  -4.449
  767    HA3  GLY  94           HA3      GLY  94   5.897  12.678  -4.597
  768    H    GLN  95           H        GLN  95   4.241  12.924  -6.802
  769    HA   GLN  95           HA       GLN  95   2.899  10.242  -6.967
  770    HB2  GLN  95           HB2      GLN  95   2.639  12.512  -8.961
  771    HB3  GLN  95           HB3      GLN  95   1.792  10.980  -8.974
  772    HG2  GLN  95           HG2      GLN  95   1.338  13.340  -7.130
  773    HG3  GLN  95           HG3      GLN  95   0.269  12.700  -8.400
  774   HE21  GLN  95          HE22      GLN  95  -0.790  13.210  -5.821
  775   HE22  GLN  95          HE21      GLN  95  -1.146  11.661  -5.092
  776    H    LYS  96           H        LYS  96   4.093   8.735  -8.058
  777    HA   LYS  96           HA       LYS  96   6.471   9.517  -9.726
  778    HB2  LYS  96           HB2      LYS  96   7.066   7.724  -8.257
  779    HB3  LYS  96           HB3      LYS  96   5.486   6.947  -8.396
  780    HG2  LYS  96           HG2      LYS  96   6.037   6.337 -10.778
  781    HG3  LYS  96           HG3      LYS  96   7.645   7.033 -10.546
  782    HD2  LYS  96           HD2      LYS  96   8.160   5.340  -8.863
  783    HD3  LYS  96           HD3      LYS  96   6.481   4.758  -8.872
  784    HE2  LYS  96           HE2      LYS  96   6.693   4.063 -11.250
  785    HE3  LYS  96           HE3      LYS  96   8.344   4.692 -11.305
  786    HZ1  LYS  96           HZ1      LYS  96   8.337   2.304 -10.959
  787    HZ2  LYS  96           HZ2      LYS  96   8.985   3.019  -9.646
  788    HZ3  LYS  96           HZ3      LYS  96   7.459   2.424  -9.586
  789    H    GLN  97           H        GLN  97   5.728   9.989 -11.860
  790    HA   GLN  97           HA       GLN  97   3.295   8.493 -12.726
  791    HB2  GLN  97           HB2      GLN  97   3.118  10.984 -14.000
  792    HB3  GLN  97           HB3      GLN  97   2.050  10.245 -12.854
  793    HG2  GLN  97           HG2      GLN  97   2.429  12.379 -12.012
  794    HG3  GLN  97           HG3      GLN  97   3.375  11.338 -10.978
  795   HE21  GLN  97          HE22      GLN  97   5.247  12.474 -10.417
  796   HE22  GLN  97          HE21      GLN  97   6.149  13.468 -11.561
  797    H    LYS  98           H        LYS  98   3.372   7.482 -14.611
  798    HA   LYS  98           HA       LYS  98   5.448   8.344 -16.598
  799    HB2  LYS  98           HB2      LYS  98   5.717   5.992 -16.142
  800    HB3  LYS  98           HB3      LYS  98   3.970   5.694 -16.242
  801    HG2  LYS  98           HG2      LYS  98   3.960   6.201 -18.620
  802    HG3  LYS  98           HG3      LYS  98   5.664   6.655 -18.588
  803    HD2  LYS  98           HD2      LYS  98   4.655   3.873 -17.868
  804    HD3  LYS  98           HD3      LYS  98   5.123   4.363 -19.508
  805    HE2  LYS  98           HE2      LYS  98   7.396   4.989 -18.646
  806    HE3  LYS  98           HE3      LYS  98   6.950   4.350 -17.057
  807    HZ1  LYS  98           HZ1      LYS  98   8.164   2.706 -18.377
  808    HZ2  LYS  98           HZ2      LYS  98   6.648   2.155 -18.107
  809    HZ3  LYS  98           HZ3      LYS  98   7.064   2.758 -19.576
  810    H    TRP  99           H        TRP  99   4.576   9.484 -18.283
  811    HA   TRP  99           HA       TRP  99   1.603   9.731 -18.283
  812    HB2  TRP  99           HB2      TRP  99   3.761  11.607 -19.253
  813    HB3  TRP  99           HB3      TRP  99   2.066  11.791 -19.600
  814    HD1  TRP  99           HD1      TRP  99   4.442  11.771 -16.570
  815    HE1  TRP  99           HE1      TRP  99   3.574  13.402 -14.831
  816    HE3  TRP  99           HE3      TRP  99  -0.117  12.794 -18.648
  817    HZ2  TRP  99           HZ2      TRP  99   1.189  15.066 -14.440
  818    HZ3  TRP  99           HZ3      TRP  99  -1.664  14.380 -17.585
  819    HH2  TRP  99           HH2      TRP  99  -1.044  15.496 -15.455
  820    H    PHE 100           H        PHE 100   0.576   8.764 -19.940
  821    HA   PHE 100           HA       PHE 100   2.181   7.776 -22.255
  822    HB2  PHE 100           HB2      PHE 100  -0.537   6.982 -21.172
  823    HB3  PHE 100           HB3      PHE 100   0.014   6.544 -22.777
  824    HD1  PHE 100           HD2      PHE 100   0.867   6.124 -19.138
  825    HD2  PHE 100           HD1      PHE 100   1.439   4.693 -23.170
  826    HE1  PHE 100           HE2      PHE 100   1.952   4.075 -18.264
  827    HE2  PHE 100           HE1      PHE 100   2.561   2.668 -22.289
  828    HZ   PHE 100           HZ       PHE 100   2.804   2.342 -19.836
  829    H    LEU 101           H        LEU 101   1.762   8.553 -24.283
  830    HA   LEU 101           HA       LEU 101  -0.007  10.914 -24.508
  831    HB2  LEU 101           HB2      LEU 101   2.259  11.235 -25.345
  832    HB3  LEU 101           HB3      LEU 101   2.120   9.776 -26.333
  833    HG   LEU 101           HG       LEU 101   0.251  10.848 -27.620
  834   HD11  LEU 101          HD11      LEU 101  -0.520  12.512 -25.977
  835   HD12  LEU 101          HD12      LEU 101   1.050  13.345 -26.061
  836   HD13  LEU 101          HD13      LEU 101  -0.026  13.287 -27.474
  837   HD21  LEU 101          HD21      LEU 101   2.925  12.292 -27.605
  838   HD22  LEU 101          HD22      LEU 101   2.516  10.830 -28.501
  839   HD23  LEU 101          HD23      LEU 101   1.722  12.363 -28.911
  840    H    LEU 102           H        LEU 102  -2.002  10.454 -25.082
  841    HA   LEU 102           HA       LEU 102  -2.538   8.151 -26.882
  842    HB2  LEU 102           HB2      LEU 102  -4.166   9.609 -24.753
  843    HB3  LEU 102           HB3      LEU 102  -4.939   8.583 -25.963
  844    HG   LEU 102           HG       LEU 102  -2.883   7.690 -23.901
  845   HD11  LEU 102          HD11      LEU 102  -4.788   6.466 -22.967
  846   HD12  LEU 102          HD12      LEU 102  -5.165   8.197 -23.079
  847   HD13  LEU 102          HD13      LEU 102  -5.830   7.091 -24.250
  848   HD21  LEU 102          HD21      LEU 102  -2.423   6.257 -25.588
  849   HD22  LEU 102          HD22      LEU 102  -3.831   5.383 -24.977
  850   HD23  LEU 102          HD23      LEU 102  -3.963   6.439 -26.428
  851    H    GLN 103           H        GLN 103  -3.524   8.475 -28.766
  852    HA   GLN 103           HA       GLN 103  -4.338  11.284 -29.424
  853    HB2  GLN 103           HB2      GLN 103  -3.758   8.910 -31.223
  854    HB3  GLN 103           HB3      GLN 103  -4.563  10.373 -31.794
  855    HG2  GLN 103           HG2      GLN 103  -1.809  10.282 -30.485
  856    HG3  GLN 103           HG3      GLN 103  -2.103  10.371 -32.224
  857   HE21  GLN 103          HE22      GLN 103  -0.484  12.285 -30.905
  858   HE22  GLN 103          HE21      GLN 103  -1.350  13.816 -30.981
  859    H    LEU 104           H        LEU 104  -6.435  11.799 -29.710
  860    HA   LEU 104           HA       LEU 104  -8.301   9.988 -28.476
  861    HB2  LEU 104           HB2      LEU 104  -8.132  12.457 -28.072
  862    HB3  LEU 104           HB3      LEU 104  -8.675  12.747 -29.718
  863    HG   LEU 104           HG       LEU 104 -10.846  11.694 -29.210
  864   HD11  LEU 104          HD11      LEU 104  -9.839  11.508 -26.330
  865   HD12  LEU 104          HD12      LEU 104 -11.492  11.199 -26.879
  866   HD13  LEU 104          HD13      LEU 104 -10.196  10.122 -27.380
  867   HD21  LEU 104          HD21      LEU 104 -11.630  13.521 -27.661
  868   HD22  LEU 104          HD22      LEU 104  -9.939  13.914 -27.315
  869   HD23  LEU 104          HD23      LEU 104 -10.574  14.096 -28.968
  870    H    VAL 105           H        VAL 105  -9.051   8.292 -29.716
  871    HA   VAL 105           HA       VAL 105 -10.060   8.882 -32.454
  872    HB   VAL 105           HB       VAL 105 -10.176   6.232 -32.436
  873   HG11  VAL 105          HG11      VAL 105  -7.601   7.852 -32.839
  874   HG12  VAL 105          HG12      VAL 105  -7.940   6.258 -33.545
  875   HG13  VAL 105          HG13      VAL 105  -8.907   7.651 -34.035
  876   HG21  VAL 105          HG21      VAL 105  -8.299   5.156 -31.400
  877   HG22  VAL 105          HG22      VAL 105  -7.780   6.654 -30.609
  878   HG23  VAL 105          HG23      VAL 105  -9.345   5.867 -30.183
  879    H    SER 106           H        SER 106 -11.135   7.721 -29.256
  880    HA   SER 106           HA       SER 106 -13.820   7.157 -29.866
  881    HB2  SER 106           HB2      SER 106 -14.096   8.063 -27.417
  882    HB3  SER 106           HB3      SER 106 -13.109   6.626 -27.720
  883    HG   SER 106           HG       SER 106 -11.361   7.727 -27.138
  884    H    GLY 107           H        GLY 107 -12.552  10.175 -28.523
  885    HA2  GLY 107           HA2      GLY 107 -13.104  12.435 -28.967
  886    HA3  GLY 107           HA3      GLY 107 -14.264  11.914 -30.186
  887    H    ASP 108           H        ASP 108 -15.080  13.848 -28.538
  888    HA   ASP 108           HA       ASP 108 -16.514  13.501 -26.243
  889    HB2  ASP 108           HB2      ASP 108 -16.562  15.551 -27.468
  890    HB3  ASP 108           HB3      ASP 108 -17.316  14.786 -28.861
  891    H    ALA 109           H        ALA 109 -17.393  12.208 -29.459
  892    HA   ALA 109           HA       ALA 109 -20.039  11.461 -28.931
  893    HB1  ALA 109           HB1      ALA 109 -19.031  11.562 -31.188
  894    HB2  ALA 109           HB2      ALA 109 -18.010  10.149 -30.802
  895    HB3  ALA 109           HB3      ALA 109 -19.775   9.978 -30.893
  896    H    GLU 110           H        GLU 110 -17.119   9.931 -27.746
  897    HA   GLU 110           HA       GLU 110 -18.715   7.694 -26.700
  898    HB2  GLU 110           HB2      GLU 110 -16.000   7.511 -28.015
  899    HB3  GLU 110           HB3      GLU 110 -16.692   6.217 -27.047
  900    HG2  GLU 110           HG2      GLU 110 -17.794   7.347 -29.655
  901    HG3  GLU 110           HG3      GLU 110 -16.964   5.814 -29.446
  902    H    ILE 111           H        ILE 111 -16.478  10.245 -26.036
  903    HA   ILE 111           HA       ILE 111 -15.403   9.280 -23.561
  904    HB   ILE 111           HB       ILE 111 -15.782  11.939 -24.884
  905   HG12  ILE 111          HG12      ILE 111 -13.459  10.475 -23.632
  906   HG13  ILE 111          HG13      ILE 111 -13.807  10.645 -25.353
  907   HG21  ILE 111          HG21      ILE 111 -15.050  13.207 -22.928
  908   HG22  ILE 111          HG22      ILE 111 -16.542  12.391 -22.529
  909   HG23  ILE 111          HG23      ILE 111 -14.988  11.720 -21.952
  910   HD11  ILE 111          HD11      ILE 111 -12.879  12.832 -23.441
  911   HD12  ILE 111          HD12      ILE 111 -12.010  12.136 -24.801
  912   HD13  ILE 111          HD13      ILE 111 -13.449  13.128 -25.114
  913    H    ASN 112           H        ASN 112 -16.293   8.860 -21.712
  914    HA   ASN 112           HA       ASN 112 -19.113   9.675 -21.179
  915    HB2  ASN 112           HB2      ASN 112 -18.652   7.350 -22.330
  916    HB3  ASN 112           HB3      ASN 112 -18.070   6.865 -20.741
  917   HD21  ASN 112          HD22      ASN 112 -19.755   7.388 -18.880
  918   HD22  ASN 112          HD21      ASN 112 -21.457   7.162 -19.273
  919    H    MET 113           H        MET 113 -17.127  11.005 -19.956
  920    HA   MET 113           HA       MET 113 -15.568  10.088 -17.987
  921    HB2  MET 113           HB2      MET 113 -17.167  12.680 -17.962
  922    HB3  MET 113           HB3      MET 113 -15.780  12.345 -16.917
  923    HG2  MET 113           HG2      MET 113 -14.320  12.048 -18.817
  924    HG3  MET 113           HG3      MET 113 -15.664  12.331 -19.931
  925    HE1  MET 113           HE1      MET 113 -13.154  15.439 -20.142
  926    HE2  MET 113           HE2      MET 113 -12.678  13.816 -19.592
  927    HE3  MET 113           HE3      MET 113 -13.749  14.000 -21.004
  928    H    GLN 114           H        GLN 114 -18.964   9.679 -17.492
  929    HA   GLN 114           HA       GLN 114 -18.636   9.918 -14.545
  930    HB2  GLN 114           HB2      GLN 114 -21.198  10.005 -16.182
  931    HB3  GLN 114           HB3      GLN 114 -21.087  10.137 -14.421
  932    HG2  GLN 114           HG2      GLN 114 -19.713  12.209 -14.673
  933    HG3  GLN 114           HG3      GLN 114 -19.908  12.114 -16.425
  934   HE21  GLN 114          HE22      GLN 114 -21.732  12.527 -13.335
  935   HE22  GLN 114          HE21      GLN 114 -23.110  13.310 -14.072
  936    H    THR 115           H        THR 115 -17.773   7.682 -16.281
  937    HA   THR 115           HA       THR 115 -19.473   5.430 -15.853
  938    HB   THR 115           HB       THR 115 -17.115   4.273 -16.270
  939    HG1  THR 115           HG1      THR 115 -15.742   6.026 -15.949
  940   HG21  THR 115          HG21      THR 115 -18.595   6.044 -18.222
  941   HG22  THR 115          HG22      THR 115 -17.280   4.956 -18.718
  942   HG23  THR 115          HG23      THR 115 -18.764   4.295 -17.999
  943    H    SER 116           H        SER 116 -16.910   6.928 -13.891
  944    HA   SER 116           HA       SER 116 -16.553   4.675 -12.203
  945    HB2  SER 116           HB2      SER 116 -15.649   7.397 -11.399
  946    HB3  SER 116           HB3      SER 116 -14.743   5.879 -11.437
  947    HG   SER 116           HG       SER 116 -14.201   7.560 -13.105
  948    H    SER 117           H        SER 117 -19.147   6.769 -12.151
  949    HA   SER 117           HA       SER 117 -20.692   7.488 -10.742
  950    HB2  SER 117           HB2      SER 117 -19.583   5.624  -8.625
  951    HB3  SER 117           HB3      SER 117 -21.178   6.381  -8.666
  952    HG   SER 117           HG       SER 117 -21.219   4.212  -9.455
  953    H    THR 118           H        THR 118 -17.491   7.402  -9.129
  954    HA   THR 118           HA       THR 118 -17.768  10.307  -8.555
  955    HB   THR 118           HB       THR 118 -16.209   9.816  -6.595
  956    HG1  THR 118           HG1      THR 118 -15.675   7.661  -6.981
  957   HG21  THR 118          HG21      THR 118 -19.045   8.698  -6.443
  958   HG22  THR 118          HG22      THR 118 -18.063   9.287  -5.086
  959   HG23  THR 118          HG23      THR 118 -18.607  10.416  -6.337
  960    HA   PRO 119           HA       PRO 119 -14.424   9.150 -11.539
  961    HB2  PRO 119           HB2      PRO 119 -14.998  10.820 -13.570
  962    HB3  PRO 119           HB3      PRO 119 -16.110   9.484 -13.166
  963    HG2  PRO 119           HG2      PRO 119 -16.305  12.375 -12.229
  964    HG3  PRO 119           HG3      PRO 119 -17.556  11.427 -13.102
  965    HD2  PRO 119           HD2      PRO 119 -17.506  11.584 -10.375
  966    HD3  PRO 119           HD3      PRO 119 -17.992  10.082 -11.218
  967    H    GLU 120           H        GLU 120 -13.053  11.080 -12.954
  968    HA   GLU 120           HA       GLU 120 -12.280  13.125 -10.904
  969    HB2  GLU 120           HB2      GLU 120 -10.622  11.602 -12.885
  970    HB3  GLU 120           HB3      GLU 120 -10.155  13.219 -12.442
  971    HG2  GLU 120           HG2      GLU 120 -10.860  11.213 -10.271
  972    HG3  GLU 120           HG3      GLU 120  -9.269  11.155 -11.044
  973    H    PHE 121           H        PHE 121 -13.103  12.726 -14.435
  974    HA   PHE 121           HA       PHE 121 -13.142  15.713 -14.484
  975    HB2  PHE 121           HB2      PHE 121 -12.797  13.764 -16.748
  976    HB3  PHE 121           HB3      PHE 121 -13.104  15.467 -16.930
  977    HD1  PHE 121           HD2      PHE 121 -11.455  17.001 -15.299
  978    HD2  PHE 121           HD1      PHE 121 -10.516  13.250 -17.204
  979    HE1  PHE 121           HE2      PHE 121  -9.089  17.688 -15.469
  980    HE2  PHE 121           HE1      PHE 121  -8.131  13.936 -17.350
  981    HZ   PHE 121           HZ       PHE 121  -7.429  16.193 -16.538
  982    H    ASP 122           H        ASP 122 -14.790  16.712 -15.684
  983    HA   ASP 122           HA       ASP 122 -17.447  15.354 -15.468
  984    HB2  ASP 122           HB2      ASP 122 -17.208  16.757 -13.582
  985    HB3  ASP 122           HB3      ASP 122 -16.431  18.037 -14.519
  986    H    GLY 123           H        GLY 123 -15.410  17.636 -17.358
  987    HA2  GLY 123           HA2      GLY 123 -16.970  17.119 -19.717
  988    HA3  GLY 123           HA3      GLY 123 -17.169  18.794 -19.149
  989    H    TRP 124           H        TRP 124 -15.902  17.939 -21.611
  990    HA   TRP 124           HA       TRP 124 -13.006  18.357 -21.105
  991    HB2  TRP 124           HB2      TRP 124 -12.715  17.397 -23.320
  992    HB3  TRP 124           HB3      TRP 124 -13.606  16.299 -22.280
  993    HD1  TRP 124           HD1      TRP 124 -16.092  15.699 -22.962
  994    HE1  TRP 124           HE1      TRP 124 -17.554  16.157 -25.014
  995    HE3  TRP 124           HE3      TRP 124 -13.084  19.050 -25.412
  996    HZ2  TRP 124           HZ2      TRP 124 -17.578  17.984 -27.251
  997    HZ3  TRP 124           HZ3      TRP 124 -13.867  20.158 -27.492
  998    HH2  TRP 124           HH2      TRP 124 -16.116  19.642 -28.410
  999    H    ARG 125           H        ARG 125 -11.824  19.664 -22.493
 1000    HA   ARG 125           HA       ARG 125 -13.069  21.346 -24.549
 1001    HB2  ARG 125           HB2      ARG 125 -13.330  22.740 -22.496
 1002    HB3  ARG 125           HB3      ARG 125 -11.596  22.593 -22.175
 1003    HG2  ARG 125           HG2      ARG 125 -11.109  23.813 -24.287
 1004    HG3  ARG 125           HG3      ARG 125 -12.832  23.875 -24.654
 1005    HD2  ARG 125           HD2      ARG 125 -12.098  26.011 -23.782
 1006    HD3  ARG 125           HD3      ARG 125 -13.239  25.262 -22.668
 1007    HE   ARG 125           HE       ARG 125 -11.197  24.484 -21.361
 1008   HH11  ARG 125          HH11      ARG 125 -10.956  27.457 -23.302
 1009   HH12  ARG 125          HH12      ARG 125  -9.949  28.270 -22.158
 1010   HH21  ARG 125          HH21      ARG 125 -10.094  25.679 -19.742
 1011   HH22  ARG 125          HH22      ARG 125  -9.339  27.185 -20.165
 1012    H    TRP 126           H        TRP 126 -11.559  20.911 -26.327
 1013    HA   TRP 126           HA       TRP 126  -8.838  20.149 -25.566
 1014    HB2  TRP 126           HB2      TRP 126  -9.881  20.651 -28.353
 1015    HB3  TRP 126           HB3      TRP 126  -8.527  19.643 -27.848
 1016    HD1  TRP 126           HD1      TRP 126 -11.671  19.141 -29.291
 1017    HE1  TRP 126           HE1      TRP 126 -13.009  17.125 -28.499
 1018    HE3  TRP 126           HE3      TRP 126  -8.999  17.995 -25.070
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.023  15.304 -26.249
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.789  16.209 -23.565
 1021    HH2  TRP 126           HH2      TRP 126 -11.801  14.884 -24.115
 1022    H    VAL 127           H        VAL 127  -7.084  21.508 -25.522
 1023    HA   VAL 127           HA       VAL 127  -7.506  24.369 -26.260
 1024    HB   VAL 127           HB       VAL 127  -6.406  24.980 -24.137
 1025   HG11  VAL 127          HG11      VAL 127  -8.255  24.674 -22.660
 1026   HG12  VAL 127          HG12      VAL 127  -8.885  24.921 -24.294
 1027   HG13  VAL 127          HG13      VAL 127  -8.853  23.287 -23.588
 1028   HG21  VAL 127          HG21      VAL 127  -5.122  22.965 -23.648
 1029   HG22  VAL 127          HG22      VAL 127  -6.234  23.285 -22.306
 1030   HG23  VAL 127          HG23      VAL 127  -6.607  22.012 -23.473
 1031    H    SER 128           H        SER 128  -5.447  25.612 -26.422
 1032    HA   SER 128           HA       SER 128  -3.695  24.483 -28.197
 1033    HB2  SER 128           HB2      SER 128  -2.870  26.661 -26.259
 1034    HB3  SER 128           HB3      SER 128  -2.288  26.393 -27.898
 1035    HG   SER 128           HG       SER 128  -3.874  28.086 -27.826
 1036    H    TYR 129           H        TYR 129  -1.549  23.790 -28.156
 1037    HA   TYR 129           HA       TYR 129  -0.738  22.194 -25.902
 1038    HB2  TYR 129           HB2      TYR 129  -0.163  22.171 -28.521
 1039    HB3  TYR 129           HB3      TYR 129   1.168  23.210 -28.006
 1040    HD1  TYR 129           HD1      TYR 129   2.772  22.269 -26.221
 1041    HD2  TYR 129           HD2      TYR 129  -0.177  19.853 -28.223
 1042    HE1  TYR 129           HE1      TYR 129   4.005  20.234 -25.552
 1043    HE2  TYR 129           HE2      TYR 129   0.959  17.807 -27.395
 1044    HH   TYR 129           HH       TYR 129   3.979  17.906 -25.511
 1045    H    TRP 130           H        TRP 130   0.873  22.823 -24.343
 1046    HA   TRP 130           HA       TRP 130   1.751  24.129 -22.799
 1047    HB2  TRP 130           HB2      TRP 130   1.943  26.549 -24.541
 1048    HB3  TRP 130           HB3      TRP 130   2.990  26.024 -23.242
 1049    HD1  TRP 130           HD1      TRP 130   2.537  25.908 -26.907
 1050    HE1  TRP 130           HE1      TRP 130   4.146  24.373 -28.063
 1051    HE3  TRP 130           HE3      TRP 130   4.500  23.654 -22.764
 1052    HZ2  TRP 130           HZ2      TRP 130   6.320  22.498 -27.255
 1053    HZ3  TRP 130           HZ3      TRP 130   6.326  21.982 -22.973
 1054    HH2  TRP 130           HH2      TRP 130   7.222  21.392 -25.195
 1055    H    TYR 131           H        TYR 131  -1.401  24.865 -23.886
 1056    HA   TYR 131           HA       TYR 131  -1.748  27.245 -22.286
 1057    HB2  TYR 131           HB2      TYR 131  -3.295  26.913 -24.009
 1058    HB3  TYR 131           HB3      TYR 131  -3.764  25.328 -23.458
 1059    HD1  TYR 131           HD1      TYR 131  -5.134  25.020 -21.393
 1060    HD2  TYR 131           HD2      TYR 131  -4.275  28.926 -23.024
 1061    HE1  TYR 131           HE1      TYR 131  -7.018  25.964 -20.118
 1062    HE2  TYR 131           HE2      TYR 131  -6.153  29.880 -21.734
 1063    HH   TYR 131           HH       TYR 131  -7.903  29.444 -20.220
 1064    HA   PRO 132           HA       PRO 132  -3.448  24.369 -18.897
 1065    HB2  PRO 132           HB2      PRO 132  -1.955  21.795 -19.338
 1066    HB3  PRO 132           HB3      PRO 132  -3.570  22.074 -18.648
 1067    HG2  PRO 132           HG2      PRO 132  -3.322  21.251 -21.205
 1068    HG3  PRO 132           HG3      PRO 132  -4.500  22.542 -20.795
 1069    HD2  PRO 132           HD2      PRO 132  -1.715  22.863 -21.974
 1070    HD3  PRO 132           HD3      PRO 132  -3.237  23.632 -22.444
 1071    H    VAL 133           H        VAL 133   0.044  23.996 -19.784
 1072    HA   VAL 133           HA       VAL 133   0.912  23.568 -17.118
 1073    HB   VAL 133           HB       VAL 133   3.123  24.540 -18.038
 1074   HG11  VAL 133          HG11      VAL 133   2.962  22.253 -17.777
 1075   HG12  VAL 133          HG12      VAL 133   1.738  22.055 -19.035
 1076   HG13  VAL 133          HG13      VAL 133   3.422  22.426 -19.474
 1077   HG21  VAL 133          HG21      VAL 133   1.701  24.268 -20.682
 1078   HG22  VAL 133          HG22      VAL 133   2.210  25.814 -19.947
 1079   HG23  VAL 133          HG23      VAL 133   3.417  24.615 -20.432
 1080    H    ARG 134           H        ARG 134   0.032  26.646 -18.732
 1081    HA   ARG 134           HA       ARG 134   0.999  28.039 -16.320
 1082    HB2  ARG 134           HB2      ARG 134   1.360  28.944 -18.649
 1083    HB3  ARG 134           HB3      ARG 134  -0.374  29.231 -18.745
 1084    HG2  ARG 134           HG2      ARG 134   0.878  31.254 -18.212
 1085    HG3  ARG 134           HG3      ARG 134  -0.238  30.875 -16.920
 1086    HD2  ARG 134           HD2      ARG 134   2.700  30.054 -16.786
 1087    HD3  ARG 134           HD3      ARG 134   2.205  31.683 -16.377
 1088    HE   ARG 134           HE       ARG 134   1.826  29.285 -14.764
 1089   HH11  ARG 134          HH21      ARG 134   0.694  32.627 -15.261
 1090   HH12  ARG 134          HH22      ARG 134   0.017  32.771 -13.683
 1091   HH21  ARG 134          HH11      ARG 134   0.833  29.453 -12.705
 1092   HH22  ARG 134          HH12      ARG 134   0.132  30.937 -12.191
 1093    H    GLN 135           H        GLN 135  -1.925  26.481 -17.319
 1094    HA   GLN 135           HA       GLN 135  -3.593  28.115 -15.519
 1095    HB2  GLN 135           HB2      GLN 135  -4.141  25.343 -16.625
 1096    HB3  GLN 135           HB3      GLN 135  -5.286  26.431 -15.845
 1097    HG2  GLN 135           HG2      GLN 135  -4.270  26.410 -18.636
 1098    HG3  GLN 135           HG3      GLN 135  -5.872  26.746 -18.026
 1099   HE21  GLN 135          HE22      GLN 135  -3.137  28.117 -19.458
 1100   HE22  GLN 135          HE21      GLN 135  -3.477  29.804 -19.111
 1101    H    VAL 136           H        VAL 136  -1.618  25.186 -15.454
 1102    HA   VAL 136           HA       VAL 136  -2.327  24.317 -12.827
 1103    HB   VAL 136           HB       VAL 136  -0.182  23.705 -14.867
 1104   HG11  VAL 136          HG11      VAL 136   0.980  23.335 -12.746
 1105   HG12  VAL 136          HG12      VAL 136  -0.375  22.331 -12.154
 1106   HG13  VAL 136          HG13      VAL 136   0.611  21.802 -13.538
 1107   HG21  VAL 136          HG21      VAL 136  -1.385  21.462 -14.773
 1108   HG22  VAL 136          HG22      VAL 136  -2.550  22.195 -13.667
 1109   HG23  VAL 136          HG23      VAL 136  -2.379  22.819 -15.324
 1110    H    VAL 137           H        VAL 137  -1.021  24.320 -10.948
 1111    HA   VAL 137           HA       VAL 137  -0.134  26.920 -10.195
 1112    HB   VAL 137           HB       VAL 137   0.392  25.770  -8.014
 1113   HG11  VAL 137          HG11      VAL 137  -2.386  25.249  -9.175
 1114   HG12  VAL 137          HG12      VAL 137  -1.959  25.361  -7.457
 1115   HG13  VAL 137          HG13      VAL 137  -1.808  26.785  -8.494
 1116   HG21  VAL 137          HG21      VAL 137  -0.398  23.459  -7.674
 1117   HG22  VAL 137          HG22      VAL 137  -0.740  23.272  -9.391
 1118   HG23  VAL 137          HG23      VAL 137   0.937  23.485  -8.832
 1119    H    SER 138           H        SER 138   1.889  27.664  -9.491
 1120    HA   SER 138           HA       SER 138   3.842  27.361 -11.345
 1121    HB2  SER 138           HB2      SER 138   4.266  28.320  -8.491
 1122    HB3  SER 138           HB3      SER 138   5.126  28.849  -9.951
 1123    HG   SER 138           HG       SER 138   3.443  30.323  -9.337
 1124    H    PHE 139           H        PHE 139   3.726  25.539  -8.210
 1125    HA   PHE 139           HA       PHE 139   6.450  24.629  -8.510
 1126    HB2  PHE 139           HB2      PHE 139   6.063  23.194  -6.663
 1127    HB3  PHE 139           HB3      PHE 139   5.305  24.738  -6.336
 1128    HD1  PHE 139           HD2      PHE 139   4.719  21.139  -7.052
 1129    HD2  PHE 139           HD1      PHE 139   2.875  24.907  -6.022
 1130    HE1  PHE 139           HE2      PHE 139   2.624  19.961  -6.466
 1131    HE2  PHE 139           HE1      PHE 139   0.783  23.717  -5.437
 1132    HZ   PHE 139           HZ       PHE 139   0.640  21.246  -5.674
 1133    H    LYS 140           H        LYS 140   3.392  23.508  -9.819
 1134    HA   LYS 140           HA       LYS 140   4.571  20.922 -10.658
 1135    HB2  LYS 140           HB2      LYS 140   2.431  21.084  -9.431
 1136    HB3  LYS 140           HB3      LYS 140   1.695  21.890 -10.814
 1137    HG2  LYS 140           HG2      LYS 140   2.062  19.914 -12.226
 1138    HG3  LYS 140           HG3      LYS 140   2.989  19.119 -10.951
 1139    HD2  LYS 140           HD2      LYS 140   0.059  19.929 -10.709
 1140    HD3  LYS 140           HD3      LYS 140   0.612  18.313 -11.180
 1141    HE2  LYS 140           HE2      LYS 140   1.800  18.056  -9.029
 1142    HE3  LYS 140           HE3      LYS 140   1.327  19.679  -8.527
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.134  17.936  -7.587
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.974  19.011  -8.477
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.645  17.521  -9.098
 1146    H    ARG 141           H        ARG 141   3.621  24.029 -12.045
 1147    HA   ARG 141           HA       ARG 141   3.355  23.466 -14.736
 1148    HB2  ARG 141           HB2      ARG 141   3.147  25.713 -13.859
 1149    HB3  ARG 141           HB3      ARG 141   4.841  25.749 -13.348
 1150    HG2  ARG 141           HG2      ARG 141   5.633  25.810 -15.634
 1151    HG3  ARG 141           HG3      ARG 141   4.017  25.464 -16.255
 1152    HD2  ARG 141           HD2      ARG 141   3.193  27.604 -15.439
 1153    HD3  ARG 141           HD3      ARG 141   4.754  27.981 -14.707
 1154    HE   ARG 141           HE       ARG 141   4.102  27.804 -17.625
 1155   HH11  ARG 141          HH21      ARG 141   6.473  28.790 -15.134
 1156   HH12  ARG 141          HH22      ARG 141   7.423  29.720 -16.231
 1157   HH21  ARG 141          HH11      ARG 141   5.386  29.056 -19.062
 1158   HH22  ARG 141          HH12      ARG 141   6.804  29.856 -18.496
 1159    H    ASP 142           H        ASP 142   6.469  23.612 -12.935
 1160    HA   ASP 142           HA       ASP 142   8.132  23.434 -15.221
 1161    HB2  ASP 142           HB2      ASP 142   9.004  24.139 -13.083
 1162    HB3  ASP 142           HB3      ASP 142   8.586  22.591 -12.339
 1163    H    VAL 143           H        VAL 143   6.890  20.770 -13.092
 1164    HA   VAL 143           HA       VAL 143   8.235  18.787 -14.712
 1165    HB   VAL 143           HB       VAL 143   7.908  18.390 -12.372
 1166   HG11  VAL 143          HG11      VAL 143   5.861  19.617 -11.919
 1167   HG12  VAL 143          HG12      VAL 143   4.897  18.462 -12.875
 1168   HG13  VAL 143          HG13      VAL 143   5.681  17.975 -11.368
 1169   HG21  VAL 143          HG21      VAL 143   7.112  16.127 -12.403
 1170   HG22  VAL 143          HG22      VAL 143   6.174  16.400 -13.888
 1171   HG23  VAL 143          HG23      VAL 143   7.949  16.437 -13.922
 1172    H    TYR 144           H        TYR 144   4.944  20.216 -14.676
 1173    HA   TYR 144           HA       TYR 144   3.959  18.324 -16.570
 1174    HB2  TYR 144           HB2      TYR 144   2.631  19.691 -14.961
 1175    HB3  TYR 144           HB3      TYR 144   2.926  21.108 -15.911
 1176    HD1  TYR 144           HD1      TYR 144   2.205  17.743 -17.533
 1177    HD2  TYR 144           HD2      TYR 144   0.549  21.490 -16.152
 1178    HE1  TYR 144           HE1      TYR 144   0.023  17.101 -18.419
 1179    HE2  TYR 144           HE2      TYR 144  -1.639  20.884 -17.148
 1180    HH   TYR 144           HH       TYR 144  -2.843  19.273 -18.376
 1181    H    ARG 145           H        ARG 145   5.717  21.434 -16.961
 1182    HA   ARG 145           HA       ARG 145   5.513  21.545 -19.833
 1183    HB2  ARG 145           HB2      ARG 145   7.645  22.472 -17.854
 1184    HB3  ARG 145           HB3      ARG 145   7.882  22.591 -19.594
 1185    HG2  ARG 145           HG2      ARG 145   5.862  24.002 -19.819
 1186    HG3  ARG 145           HG3      ARG 145   5.595  23.897 -18.071
 1187    HD2  ARG 145           HD2      ARG 145   6.698  25.995 -18.555
 1188    HD3  ARG 145           HD3      ARG 145   7.824  24.941 -17.683
 1189    HE   ARG 145           HE       ARG 145   8.075  24.698 -20.572
 1190   HH11  ARG 145          HH11      ARG 145   9.080  26.780 -17.855
 1191   HH12  ARG 145          HH12      ARG 145  10.486  27.370 -18.663
 1192   HH21  ARG 145          HH21      ARG 145   9.947  25.488 -21.628
 1193   HH22  ARG 145          HH22      ARG 145  10.981  26.625 -20.848
 1194    H    ARG 146           H        ARG 146   7.634  19.587 -17.659
 1195    HA   ARG 146           HA       ARG 146   9.215  18.606 -19.876
 1196    HB2  ARG 146           HB2      ARG 146   8.834  17.593 -17.019
 1197    HB3  ARG 146           HB3      ARG 146   9.762  16.705 -18.217
 1198    HG2  ARG 146           HG2      ARG 146  11.222  18.621 -18.616
 1199    HG3  ARG 146           HG3      ARG 146  10.309  19.619 -17.482
 1200    HD2  ARG 146           HD2      ARG 146  11.558  17.002 -16.598
 1201    HD3  ARG 146           HD3      ARG 146  12.539  18.467 -16.735
 1202    HE   ARG 146           HE       ARG 146  10.723  19.530 -15.230
 1203   HH11  ARG 146          HH12      ARG 146  12.064  16.246 -14.823
 1204   HH12  ARG 146          HH11      ARG 146  11.948  16.281 -13.103
 1205   HH21  ARG 146          HH21      ARG 146  10.740  19.634 -12.996
 1206   HH22  ARG 146          HH22      ARG 146  11.125  18.241 -12.024
 1207    H    VAL 147           H        VAL 147   6.239  17.322 -18.273
 1208    HA   VAL 147           HA       VAL 147   5.899  15.057 -19.926
 1209    HB   VAL 147           HB       VAL 147   3.758  16.964 -18.910
 1210   HG11  VAL 147          HG11      VAL 147   2.806  15.489 -20.604
 1211   HG12  VAL 147          HG12      VAL 147   3.521  14.075 -19.803
 1212   HG13  VAL 147          HG13      VAL 147   2.235  15.012 -19.006
 1213   HG21  VAL 147          HG21      VAL 147   3.507  15.509 -16.993
 1214   HG22  VAL 147          HG22      VAL 147   4.745  14.405 -17.630
 1215   HG23  VAL 147          HG23      VAL 147   5.192  16.014 -17.055
 1216    H    MET 148           H        MET 148   4.916  18.504 -20.516
 1217    HA   MET 148           HA       MET 148   3.735  17.855 -23.016
 1218    HB2  MET 148           HB2      MET 148   4.664  20.472 -21.793
 1219    HB3  MET 148           HB3      MET 148   3.929  20.379 -23.395
 1220    HG2  MET 148           HG2      MET 148   2.001  19.097 -22.367
 1221    HG3  MET 148           HG3      MET 148   2.667  19.512 -20.785
 1222    HE1  MET 148           HE1      MET 148   0.474  20.376 -20.092
 1223    HE2  MET 148           HE2      MET 148  -0.346  21.798 -20.751
 1224    HE3  MET 148           HE3      MET 148  -0.387  20.252 -21.647
 1225    H    LYS 149           H        LYS 149   7.035  18.893 -22.156
 1226    HA   LYS 149           HA       LYS 149   7.948  19.346 -24.811
 1227    HB2  LYS 149           HB2      LYS 149   8.929  20.201 -22.686
 1228    HB3  LYS 149           HB3      LYS 149   9.532  18.593 -22.302
 1229    HG2  LYS 149           HG2      LYS 149  10.295  19.924 -24.921
 1230    HG3  LYS 149           HG3      LYS 149  11.029  20.472 -23.418
 1231    HD2  LYS 149           HD2      LYS 149  11.917  18.219 -22.958
 1232    HD3  LYS 149           HD3      LYS 149  11.177  17.593 -24.440
 1233    HE2  LYS 149           HE2      LYS 149  12.485  19.216 -25.794
 1234    HE3  LYS 149           HE3      LYS 149  13.219  19.862 -24.323
 1235    HZ1  LYS 149           HZ1      LYS 149  14.671  18.279 -25.428
 1236    HZ2  LYS 149           HZ2      LYS 149  14.257  17.687 -23.969
 1237    HZ3  LYS 149           HZ3      LYS 149  13.565  17.083 -25.333
 1238    H    GLU 150           H        GLU 150   7.790  16.406 -22.824
 1239    HA   GLU 150           HA       GLU 150   9.386  14.709 -24.453
 1240    HB2  GLU 150           HB2      GLU 150   7.012  14.188 -22.631
 1241    HB3  GLU 150           HB3      GLU 150   7.843  12.884 -23.450
 1242    HG2  GLU 150           HG2      GLU 150   9.444  14.825 -21.768
 1243    HG3  GLU 150           HG3      GLU 150   8.506  13.562 -20.990
 1244    H    PHE 151           H        PHE 151   6.114  15.962 -24.996
 1245    HA   PHE 151           HA       PHE 151   5.740  14.035 -27.252
 1246    HB2  PHE 151           HB2      PHE 151   3.701  15.355 -25.432
 1247    HB3  PHE 151           HB3      PHE 151   3.316  14.269 -26.744
 1248    HD1  PHE 151           HD2      PHE 151   5.418  12.108 -26.361
 1249    HD2  PHE 151           HD1      PHE 151   3.020  14.270 -23.479
 1250    HE1  PHE 151           HE2      PHE 151   5.715  10.284 -24.737
 1251    HE2  PHE 151           HE1      PHE 151   3.290  12.390 -21.880
 1252    HZ   PHE 151           HZ       PHE 151   4.644  10.419 -22.506
 1253    H    ALA 152           H        ALA 152   6.305  17.329 -26.785
 1254    HA   ALA 152           HA       ALA 152   4.392  18.640 -28.207
 1255    HB1  ALA 152           HB1      ALA 152   6.132  20.351 -28.687
 1256    HB2  ALA 152           HB2      ALA 152   6.177  19.779 -27.009
 1257    HB3  ALA 152           HB3      ALA 152   7.391  19.205 -28.181
 1258    H    SER 153           H        SER 153   7.465  17.529 -29.807
 1259    HA   SER 153           HA       SER 153   6.561  18.135 -32.382
 1260    HB2  SER 153           HB2      SER 153   8.523  15.914 -31.714
 1261    HB3  SER 153           HB3      SER 153   8.476  16.946 -33.158
 1262    HG   SER 153           HG       SER 153  10.082  17.640 -31.650
 1263    H    VAL 154           H        VAL 154   5.665  15.349 -30.400
 1264    HA   VAL 154           HA       VAL 154   5.147  13.579 -32.670
 1265    HB   VAL 154           HB       VAL 154   4.203  13.292 -29.781
 1266   HG11  VAL 154          HG11      VAL 154   4.208  10.869 -30.332
 1267   HG12  VAL 154          HG12      VAL 154   3.101  11.760 -31.387
 1268   HG13  VAL 154          HG13      VAL 154   4.690  11.245 -31.995
 1269   HG21  VAL 154          HG21      VAL 154   6.201  11.846 -29.430
 1270   HG22  VAL 154          HG22      VAL 154   6.824  12.342 -31.019
 1271   HG23  VAL 154          HG23      VAL 154   6.647  13.527 -29.703
 1272    H    VAL 155           H        VAL 155   3.313  15.741 -30.498
 1273    HA   VAL 155           HA       VAL 155   0.757  15.162 -31.778
 1274    HB   VAL 155           HB       VAL 155   1.704  17.275 -29.790
 1275   HG11  VAL 155          HG11      VAL 155  -0.733  17.487 -29.203
 1276   HG12  VAL 155          HG12      VAL 155  -0.357  18.065 -30.825
 1277   HG13  VAL 155          HG13      VAL 155  -1.132  16.474 -30.615
 1278   HG21  VAL 155          HG21      VAL 155   1.936  14.974 -28.903
 1279   HG22  VAL 155          HG22      VAL 155   0.609  15.786 -28.109
 1280   HG23  VAL 155          HG23      VAL 155   0.268  14.610 -29.388
 1281    H    MET 156           H        MET 156   3.230  17.768 -31.971
 1282    HA   MET 156           HA       MET 156   1.579  19.395 -33.680
 1283    HB2  MET 156           HB2      MET 156   4.572  19.410 -33.091
 1284    HB3  MET 156           HB3      MET 156   3.749  20.654 -34.044
 1285    HG2  MET 156           HG2      MET 156   2.386  21.334 -32.196
 1286    HG3  MET 156           HG3      MET 156   2.844  19.934 -31.236
 1287    HE1  MET 156           HE1      MET 156   2.891  22.484 -29.678
 1288    HE2  MET 156           HE2      MET 156   3.511  20.908 -29.124
 1289    HE3  MET 156           HE3      MET 156   4.498  22.370 -28.917
 1290    H    SER 157           H        SER 157   3.840  16.724 -34.392
 1291    HA   SER 157           HA       SER 157   4.312  17.071 -37.110
 1292    HB2  SER 157           HB2      SER 157   3.473  14.570 -35.582
 1293    HB3  SER 157           HB3      SER 157   4.030  14.543 -37.254
 1294    HG   SER 157           HG       SER 157   5.538  15.429 -34.986
 1295    H    LEU 158           H        LEU 158   1.300  15.971 -35.557
 1296    HA   LEU 158           HA       LEU 158   0.028  15.075 -37.963
 1297    HB2  LEU 158           HB2      LEU 158  -1.252  16.097 -35.382
 1298    HB3  LEU 158           HB3      LEU 158  -2.059  15.160 -36.647
 1299    HG   LEU 158           HG       LEU 158   0.206  14.178 -34.858
 1300   HD11  LEU 158          HD11      LEU 158  -1.500  12.731 -33.873
 1301   HD12  LEU 158          HD12      LEU 158  -1.952  14.440 -33.690
 1302   HD13  LEU 158          HD13      LEU 158  -2.749  13.438 -34.930
 1303   HD21  LEU 158          HD21      LEU 158  -1.382  12.683 -36.989
 1304   HD22  LEU 158          HD22      LEU 158   0.364  13.039 -37.023
 1305   HD23  LEU 158          HD23      LEU 158  -0.277  11.932 -35.812
 1306    H    GLN 159           H        GLN 159   0.222  18.255 -36.370
 1307    HA   GLN 159           HA       GLN 159  -1.421  19.421 -38.555
 1308    HB2  GLN 159           HB2      GLN 159  -0.743  20.676 -35.868
 1309    HB3  GLN 159           HB3      GLN 159  -1.847  21.303 -37.086
 1310    HG2  GLN 159           HG2      GLN 159  -2.173  18.858 -35.334
 1311    HG3  GLN 159           HG3      GLN 159  -3.193  20.286 -35.442
 1312   HE21  GLN 159          HE22      GLN 159  -3.413  17.076 -36.105
 1313   HE22  GLN 159          HE21      GLN 159  -4.227  17.086 -37.643
 1314    H    GLU 160           H        GLU 160   1.482  18.555 -38.619
 1315    HA   GLU 160           HA       GLU 160   2.398  20.974 -40.083
 1316    HB2  GLU 160           HB2      GLU 160   3.574  20.421 -37.859
 1317    HB3  GLU 160           HB3      GLU 160   4.178  18.963 -38.651
 1318    HG2  GLU 160           HG2      GLU 160   5.389  20.386 -40.297
 1319    HG3  GLU 160           HG3      GLU 160   4.640  21.830 -39.618
 1320    H    ASN 161           H        ASN 161   0.950  18.223 -40.544
 1321    HA   ASN 161           HA       ASN 161   2.788  16.771 -42.326
 1322    HB2  ASN 161           HB2      ASN 161   1.302  15.070 -42.417
 1323    HB3  ASN 161           HB3      ASN 161   0.820  15.744 -40.874
 1324   HD21  ASN 161          HD22      ASN 161  -1.306  16.883 -40.782
 1325   HD22  ASN 161          HD21      ASN 161  -2.411  16.815 -42.140
 1326    H    THR 162           H        THR 162   0.414  19.213 -42.482
 1327    HA   THR 162           HA       THR 162   1.031  20.016 -45.154
 1328    HB   THR 162           HB       THR 162  -1.493  20.627 -45.385
 1329    HG1  THR 162           HG1      THR 162  -2.944  19.360 -44.291
 1330   HG21  THR 162          HG21      THR 162  -0.376  18.942 -46.824
 1331   HG22  THR 162          HG22      THR 162  -0.765  17.676 -45.639
 1332   HG23  THR 162          HG23      THR 162  -2.066  18.531 -46.498
 1333    HA   PRO 163           HA       PRO 163   1.269  23.538 -42.502
 1334    HB2  PRO 163           HB2      PRO 163   0.912  25.713 -44.071
 1335    HB3  PRO 163           HB3      PRO 163   2.256  24.558 -44.303
 1336    HG2  PRO 163           HG2      PRO 163  -0.390  24.618 -45.799
 1337    HG3  PRO 163           HG3      PRO 163   1.264  24.551 -46.482
 1338    HD2  PRO 163           HD2      PRO 163  -0.259  22.308 -46.088
 1339    HD3  PRO 163           HD3      PRO 163   1.519  22.293 -45.881
 1340    H    LYS 164           H        LYS 164  -0.688  22.553 -41.381
 1341    HA   LYS 164           HA       LYS 164  -3.277  23.684 -41.706
 1342    HB2  LYS 164           HB2      LYS 164  -2.820  21.649 -40.325
 1343    HB3  LYS 164           HB3      LYS 164  -1.894  22.643 -39.205
 1344    HG2  LYS 164           HG2      LYS 164  -3.905  22.279 -38.125
 1345    HG3  LYS 164           HG3      LYS 164  -4.024  23.927 -38.673
 1346    HD2  LYS 164           HD2      LYS 164  -5.322  21.485 -39.965
 1347    HD3  LYS 164           HD3      LYS 164  -6.126  22.603 -38.881
 1348    HE2  LYS 164           HE2      LYS 164  -5.161  23.179 -41.712
 1349    HE3  LYS 164           HE3      LYS 164  -6.819  23.008 -41.153
 1350    HZ1  LYS 164           HZ1      LYS 164  -6.470  25.019 -39.773
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.969  25.228 -40.440
 1352    HZ3  LYS 164           HZ3      LYS 164  -6.309  25.317 -41.370
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  -1.559   1.793  -2.587
    2    H2   MET   1           H2       MET   1  -1.646   0.201  -2.184
    3    H3   MET   1           H3       MET   1  -0.812   1.244  -1.240
    4    HA   MET   1           HA       MET   1   0.733  -0.078  -2.520
    5    HB2  MET   1           HB2      MET   1  -0.861  -0.505  -4.417
    6    HB3  MET   1           HB3      MET   1  -0.623   1.157  -4.966
    7    HG2  MET   1           HG2      MET   1   1.843   0.628  -5.240
    8    HG3  MET   1           HG3      MET   1   1.471  -1.050  -4.824
    9    HE1  MET   1           HE1      MET   1   3.053  -0.358  -7.433
   10    HE2  MET   1           HE2      MET   1   2.527  -2.013  -7.040
   11    HE3  MET   1           HE3      MET   1   2.202  -1.338  -8.652
   12    H    ILE   2           H        ILE   2   2.592   1.051  -1.959
   13    HA   ILE   2           HA       ILE   2   3.024   3.714  -3.195
   14    HB   ILE   2           HB       ILE   2   4.127   2.953  -0.487
   15   HG12  ILE   2          HG12      ILE   2   1.709   3.174  -0.121
   16   HG13  ILE   2          HG13      ILE   2   2.640   4.410   0.690
   17   HG21  ILE   2          HG21      ILE   2   5.418   4.632  -1.693
   18   HG22  ILE   2          HG22      ILE   2   3.980   5.607  -1.992
   19   HG23  ILE   2          HG23      ILE   2   4.595   5.411  -0.336
   20   HD11  ILE   2          HD11      ILE   2   0.521   5.252  -0.320
   21   HD12  ILE   2          HD12      ILE   2   1.951   6.114  -0.893
   22   HD13  ILE   2          HD13      ILE   2   1.174   4.911  -1.934
   23    H    ASP   3           H        ASP   3   5.019   3.809  -4.153
   24    HA   ASP   3           HA       ASP   3   6.540   1.401  -4.731
   25    HB2  ASP   3           HB2      ASP   3   6.054   3.319  -6.303
   26    HB3  ASP   3           HB3      ASP   3   7.106   4.324  -5.313
   27    H    ASP   4           H        ASP   4   8.756   1.119  -4.039
   28    HA   ASP   4           HA       ASP   4   9.066   1.185  -1.334
   29    HB2  ASP   4           HB2      ASP   4  10.288  -0.288  -2.859
   30    HB3  ASP   4           HB3      ASP   4  11.245   1.079  -3.444
   31    H    ASP   5           H        ASP   5  10.143   3.817  -3.475
   32    HA   ASP   5           HA       ASP   5  11.831   4.951  -1.421
   33    HB2  ASP   5           HB2      ASP   5  12.353   5.015  -3.887
   34    HB3  ASP   5           HB3      ASP   5  11.073   6.222  -4.054
   35    H    GLY   6           H        GLY   6   8.564   4.894  -1.650
   36    HA2  GLY   6           HA2      GLY   6   7.073   5.981  -0.224
   37    HA3  GLY   6           HA3      GLY   6   8.181   7.342  -0.039
   38    H    TYR   7           H        TYR   7   7.069   5.796  -3.117
   39    HA   TYR   7           HA       TYR   7   5.987   8.459  -3.937
   40    HB2  TYR   7           HB2      TYR   7   7.761   6.489  -5.389
   41    HB3  TYR   7           HB3      TYR   7   6.620   7.481  -6.290
   42    HD1  TYR   7           HD1      TYR   7   9.245   7.842  -3.600
   43    HD2  TYR   7           HD2      TYR   7   7.273   9.593  -7.001
   44    HE1  TYR   7           HE1      TYR   7  10.691   9.797  -3.396
   45    HE2  TYR   7           HE2      TYR   7   8.709  11.575  -6.809
   46    HH   TYR   7           HH       TYR   7  11.282  11.908  -4.306
   47    H    ARG   8           H        ARG   8   3.974   8.479  -4.957
   48    HA   ARG   8           HA       ARG   8   2.545   5.865  -4.727
   49    HB2  ARG   8           HB2      ARG   8   1.447   7.732  -3.704
   50    HB3  ARG   8           HB3      ARG   8   1.443   8.642  -5.211
   51    HG2  ARG   8           HG2      ARG   8  -0.138   7.038  -6.186
   52    HG3  ARG   8           HG3      ARG   8   0.126   5.915  -4.845
   53    HD2  ARG   8           HD2      ARG   8  -1.992   6.882  -4.504
   54    HD3  ARG   8           HD3      ARG   8  -0.911   7.594  -3.287
   55    HE   ARG   8           HE       ARG   8  -0.795   9.387  -5.380
   56   HH11  ARG   8          HH11      ARG   8  -3.453   8.104  -3.382
   57   HH12  ARG   8          HH12      ARG   8  -4.512   9.428  -3.706
   58   HH21  ARG   8          HH22      ARG   8  -2.257  11.076  -5.902
   59   HH22  ARG   8          HH21      ARG   8  -3.787  11.185  -5.112
   60    HA   PRO   9           HA       PRO   9   3.352   5.557  -9.145
   61    HB2  PRO   9           HB2      PRO   9   2.405   3.052  -9.663
   62    HB3  PRO   9           HB3      PRO   9   3.904   3.348  -8.738
   63    HG2  PRO   9           HG2      PRO   9   1.125   2.760  -7.654
   64    HG3  PRO   9           HG3      PRO   9   2.691   2.026  -7.177
   65    HD2  PRO   9           HD2      PRO   9   1.522   4.090  -5.806
   66    HD3  PRO   9           HD3      PRO   9   3.300   3.898  -5.924
   67    H    ASN  10           H        ASN  10   2.185   6.431 -10.802
   68    HA   ASN  10           HA       ASN  10  -0.775   6.163 -10.890
   69    HB2  ASN  10           HB2      ASN  10   0.879   8.724 -11.030
   70    HB3  ASN  10           HB3      ASN  10  -0.784   8.636 -11.577
   71   HD21  ASN  10          HD22      ASN  10   1.334   8.298  -8.724
   72   HD22  ASN  10          HD21      ASN  10   0.139   8.946  -7.625
   73    H    VAL  11           H        VAL  11  -1.606   6.919 -12.994
   74    HA   VAL  11           HA       VAL  11   0.322   6.839 -15.277
   75    HB   VAL  11           HB       VAL  11  -1.771   6.044 -16.554
   76   HG11  VAL  11          HG11      VAL  11  -0.489   4.138 -14.556
   77   HG12  VAL  11          HG12      VAL  11  -1.283   3.694 -16.076
   78   HG13  VAL  11          HG13      VAL  11   0.216   4.635 -16.104
   79   HG21  VAL  11          HG21      VAL  11  -3.426   6.414 -14.656
   80   HG22  VAL  11          HG22      VAL  11  -3.454   4.788 -15.334
   81   HG23  VAL  11          HG23      VAL  11  -2.673   5.056 -13.789
   82    H    GLY  12           H        GLY  12   0.164   8.680 -16.586
   83    HA2  GLY  12           HA2      GLY  12  -2.027  10.647 -15.982
   84    HA3  GLY  12           HA3      GLY  12  -0.430  11.054 -16.607
   85    H    ILE  13           H        ILE  13  -3.589  10.771 -17.596
   86    HA   ILE  13           HA       ILE  13  -2.994   9.586 -20.251
   87    HB   ILE  13           HB       ILE  13  -5.632  10.840 -19.470
   88   HG12  ILE  13          HG12      ILE  13  -5.360   9.282 -17.666
   89   HG13  ILE  13          HG13      ILE  13  -6.564   8.702 -18.799
   90   HG21  ILE  13          HG21      ILE  13  -4.977   8.558 -21.376
   91   HG22  ILE  13          HG22      ILE  13  -6.544   9.353 -21.148
   92   HG23  ILE  13          HG23      ILE  13  -5.191  10.254 -21.843
   93   HD11  ILE  13          HD11      ILE  13  -5.087   6.901 -17.937
   94   HD12  ILE  13          HD12      ILE  13  -5.002   7.040 -19.696
   95   HD13  ILE  13          HD13      ILE  13  -3.691   7.692 -18.683
   96    H    VAL  14           H        VAL  14  -1.937  11.026 -21.629
   97    HA   VAL  14           HA       VAL  14  -2.693  13.906 -21.534
   98    HB   VAL  14           HB       VAL  14  -0.518  12.546 -23.183
   99   HG11  VAL  14          HG11      VAL  14  -1.452  14.659 -24.151
  100   HG12  VAL  14          HG12      VAL  14  -1.038  15.505 -22.643
  101   HG13  VAL  14          HG13      VAL  14   0.230  14.807 -23.680
  102   HG21  VAL  14          HG21      VAL  14  -0.314  14.091 -20.583
  103   HG22  VAL  14          HG22      VAL  14   0.166  12.396 -20.915
  104   HG23  VAL  14          HG23      VAL  14   1.055  13.737 -21.653
  105    H    ILE  15           H        ILE  15  -4.925  13.413 -22.247
  106    HA   ILE  15           HA       ILE  15  -5.313  12.183 -24.861
  107    HB   ILE  15           HB       ILE  15  -7.070  14.161 -23.361
  108   HG12  ILE  15          HG12      ILE  15  -6.920  11.955 -22.251
  109   HG13  ILE  15          HG13      ILE  15  -8.530  12.360 -22.817
  110   HG21  ILE  15          HG21      ILE  15  -8.874  13.506 -24.957
  111   HG22  ILE  15          HG22      ILE  15  -7.593  14.471 -25.673
  112   HG23  ILE  15          HG23      ILE  15  -7.631  12.716 -25.970
  113   HD11  ILE  15          HD11      ILE  15  -8.372  10.822 -24.686
  114   HD12  ILE  15          HD12      ILE  15  -6.644  10.561 -24.405
  115   HD13  ILE  15          HD13      ILE  15  -7.846   9.962 -23.234
  116    H    CYS  16           H        CYS  16  -4.895  13.026 -26.761
  117    HA   CYS  16           HA       CYS  16  -4.372  15.963 -26.997
  118    HB2  CYS  16           HB2      CYS  16  -3.137  13.659 -28.576
  119    HB3  CYS  16           HB3      CYS  16  -2.902  15.399 -28.899
  120    HG   CYS  16           HG       CYS  16  -2.310  13.750 -26.072
  121    H    ASN  17           H        ASN  17  -5.937  16.898 -28.121
  122    HA   ASN  17           HA       ASN  17  -7.892  15.245 -29.603
  123    HB2  ASN  17           HB2      ASN  17  -8.748  17.106 -28.157
  124    HB3  ASN  17           HB3      ASN  17  -7.838  18.270 -29.139
  125   HD21  ASN  17          HD22      ASN  17 -10.769  16.373 -28.976
  126   HD22  ASN  17          HD21      ASN  17 -11.310  16.665 -30.613
  127    H    ARG  18           H        ARG  18  -7.921  15.248 -31.830
  128    HA   ARG  18           HA       ARG  18  -5.480  15.612 -33.176
  129    HB2  ARG  18           HB2      ARG  18  -8.256  15.310 -34.402
  130    HB3  ARG  18           HB3      ARG  18  -6.696  14.936 -35.160
  131    HG2  ARG  18           HG2      ARG  18  -6.262  13.287 -33.286
  132    HG3  ARG  18           HG3      ARG  18  -7.947  13.552 -32.748
  133    HD2  ARG  18           HD2      ARG  18  -8.682  13.032 -35.090
  134    HD3  ARG  18           HD3      ARG  18  -6.982  12.573 -35.432
  135    HE   ARG  18           HE       ARG  18  -8.202  11.252 -33.098
  136   HH11  ARG  18          HH21      ARG  18  -7.876  10.972 -36.642
  137   HH12  ARG  18          HH22      ARG  18  -8.086   9.261 -36.654
  138   HH21  ARG  18          HH11      ARG  18  -8.452   9.066 -33.110
  139   HH22  ARG  18          HH12      ARG  18  -8.438   8.119 -34.583
  140    H    GLN  19           H        GLN  19  -7.746  18.104 -32.496
  141    HA   GLN  19           HA       GLN  19  -7.042  19.775 -34.783
  142    HB2  GLN  19           HB2      GLN  19  -8.242  20.322 -32.042
  143    HB3  GLN  19           HB3      GLN  19  -7.987  21.588 -33.247
  144    HG2  GLN  19           HG2      GLN  19  -9.549  20.677 -34.766
  145    HG3  GLN  19           HG3      GLN  19  -9.578  19.102 -33.975
  146   HE21  GLN  19          HE22      GLN  19 -10.600  18.880 -31.879
  147   HE22  GLN  19          HE21      GLN  19 -11.841  20.023 -31.355
  148    H    GLY  20           H        GLY  20  -5.077  18.530 -32.323
  149    HA2  GLY  20           HA2      GLY  20  -2.795  19.007 -32.072
  150    HA3  GLY  20           HA3      GLY  20  -3.044  20.633 -32.742
  151    H    GLN  21           H        GLN  21  -4.987  19.211 -30.160
  152    HA   GLN  21           HA       GLN  21  -4.142  21.429 -28.351
  153    HB2  GLN  21           HB2      GLN  21  -7.038  20.686 -28.872
  154    HB3  GLN  21           HB3      GLN  21  -6.438  22.058 -27.967
  155    HG2  GLN  21           HG2      GLN  21  -6.459  21.631 -30.965
  156    HG3  GLN  21           HG3      GLN  21  -7.275  22.873 -30.044
  157   HE21  GLN  21          HE22      GLN  21  -4.969  22.762 -32.369
  158   HE22  GLN  21          HE21      GLN  21  -3.868  23.960 -31.770
  159    H    VAL  22           H        VAL  22  -4.911  20.950 -26.041
  160    HA   VAL  22           HA       VAL  22  -4.564  17.996 -25.623
  161    HB   VAL  22           HB       VAL  22  -3.184  18.558 -23.675
  162   HG11  VAL  22          HG11      VAL  22  -2.175  17.981 -25.829
  163   HG12  VAL  22          HG12      VAL  22  -2.198  19.691 -26.312
  164   HG13  VAL  22          HG13      VAL  22  -1.189  19.164 -24.952
  165   HG21  VAL  22          HG21      VAL  22  -3.970  20.823 -23.172
  166   HG22  VAL  22          HG22      VAL  22  -2.218  20.804 -23.434
  167   HG23  VAL  22          HG23      VAL  22  -3.291  21.432 -24.693
  168    H    MET  23           H        MET  23  -5.095  17.132 -23.593
  169    HA   MET  23           HA       MET  23  -7.709  17.285 -22.790
  170    HB2  MET  23           HB2      MET  23  -5.920  15.525 -22.264
  171    HB3  MET  23           HB3      MET  23  -5.339  16.575 -20.998
  172    HG2  MET  23           HG2      MET  23  -6.803  14.869 -20.063
  173    HG3  MET  23           HG3      MET  23  -7.522  16.463 -19.850
  174    HE1  MET  23           HE1      MET  23  -9.372  13.972 -19.338
  175    HE2  MET  23           HE2      MET  23  -9.927  15.663 -19.331
  176    HE3  MET  23           HE3      MET  23 -10.808  14.443 -20.279
  177    H    TRP  24           H        TRP  24  -8.896  18.606 -21.424
  178    HA   TRP  24           HA       TRP  24  -7.828  19.593 -19.001
  179    HB2  TRP  24           HB2      TRP  24  -7.236  21.416 -20.855
  180    HB3  TRP  24           HB3      TRP  24  -8.929  21.839 -20.690
  181    HD1  TRP  24           HD1      TRP  24  -9.103  23.863 -19.233
  182    HE1  TRP  24           HE1      TRP  24  -8.060  24.759 -17.084
  183    HE3  TRP  24           HE3      TRP  24  -5.675  20.144 -18.380
  184    HZ2  TRP  24           HZ2      TRP  24  -5.967  23.989 -15.236
  185    HZ3  TRP  24           HZ3      TRP  24  -4.214  20.229 -16.384
  186    HH2  TRP  24           HH2      TRP  24  -4.333  22.154 -14.815
  187    H    ALA  25           H        ALA  25  -9.625  19.779 -17.554
  188    HA   ALA  25           HA       ALA  25 -12.317  19.810 -18.672
  189    HB1  ALA  25           HB1      ALA  25 -12.943  17.638 -17.572
  190    HB2  ALA  25           HB2      ALA  25 -11.878  17.449 -18.973
  191    HB3  ALA  25           HB3      ALA  25 -11.211  17.312 -17.328
  192    H    ARG  26           H        ARG  26 -13.872  20.312 -17.216
  193    HA   ARG  26           HA       ARG  26 -12.942  21.927 -14.981
  194    HB2  ARG  26           HB2      ARG  26 -14.675  22.672 -16.588
  195    HB3  ARG  26           HB3      ARG  26 -15.749  21.366 -16.054
  196    HG2  ARG  26           HG2      ARG  26 -15.888  22.346 -13.815
  197    HG3  ARG  26           HG3      ARG  26 -14.636  23.539 -14.223
  198    HD2  ARG  26           HD2      ARG  26 -16.765  24.660 -14.339
  199    HD3  ARG  26           HD3      ARG  26 -16.114  24.495 -15.972
  200    HE   ARG  26           HE       ARG  26 -17.937  22.318 -15.202
  201   HH11  ARG  26          HH11      ARG  26 -17.864  25.616 -16.595
  202   HH12  ARG  26          HH12      ARG  26 -19.415  25.445 -17.336
  203   HH21  ARG  26          HH21      ARG  26 -19.885  22.137 -16.073
  204   HH22  ARG  26          HH22      ARG  26 -20.628  23.390 -17.059
  205    H    ARG  27           H        ARG  27 -13.187  21.367 -12.741
  206    HA   ARG  27           HA       ARG  27 -13.399  18.519 -12.405
  207    HB2  ARG  27           HB2      ARG  27 -11.686  20.112 -11.413
  208    HB3  ARG  27           HB3      ARG  27 -12.882  20.539 -10.217
  209    HG2  ARG  27           HG2      ARG  27 -11.696  17.768 -10.670
  210    HG3  ARG  27           HG3      ARG  27 -11.207  18.930  -9.432
  211    HD2  ARG  27           HD2      ARG  27 -13.402  18.756  -8.355
  212    HD3  ARG  27           HD3      ARG  27 -13.866  17.516  -9.553
  213    HE   ARG  27           HE       ARG  27 -11.432  16.712  -8.415
  214   HH11  ARG  27          HH11      ARG  27 -14.809  17.245  -7.356
  215   HH12  ARG  27          HH12      ARG  27 -14.746  16.038  -6.114
  216   HH21  ARG  27          HH21      ARG  27 -11.470  14.903  -6.981
  217   HH22  ARG  27          HH22      ARG  27 -12.780  14.710  -5.859
  218    H    PHE  28           H        PHE  28 -15.004  17.403 -11.549
  219    HA   PHE  28           HA       PHE  28 -17.684  18.166 -11.179
  220    HB2  PHE  28           HB2      PHE  28 -16.927  15.895 -11.567
  221    HB3  PHE  28           HB3      PHE  28 -15.913  15.929 -10.130
  222    HD1  PHE  28           HD1      PHE  28 -19.469  15.937 -11.279
  223    HD2  PHE  28           HD2      PHE  28 -16.674  15.093  -8.110
  224    HE1  PHE  28           HE1      PHE  28 -21.268  14.764 -10.003
  225    HE2  PHE  28           HE2      PHE  28 -18.463  13.857  -6.866
  226    HZ   PHE  28           HZ       PHE  28 -20.760  13.728  -7.804
  227    H    GLY  29           H        GLY  29 -18.759  19.171  -9.530
  228    HA2  GLY  29           HA2      GLY  29 -19.361  19.758  -7.407
  229    HA3  GLY  29           HA3      GLY  29 -17.951  18.909  -6.767
  230    H    GLN  30           H        GLN  30 -15.937  20.379  -8.298
  231    HA   GLN  30           HA       GLN  30 -15.769  22.764  -6.610
  232    HB2  GLN  30           HB2      GLN  30 -13.888  21.213  -6.926
  233    HB3  GLN  30           HB3      GLN  30 -13.916  21.517  -8.665
  234    HG2  GLN  30           HG2      GLN  30 -13.285  23.875  -8.273
  235    HG3  GLN  30           HG3      GLN  30 -13.292  23.587  -6.532
  236   HE21  GLN  30          HE22      GLN  30 -11.645  22.495  -9.637
  237   HE22  GLN  30          HE21      GLN  30 -10.141  22.145  -8.841
  238    H    HIS  31           H        HIS  31 -16.283  21.962 -10.039
  239    HA   HIS  31           HA       HIS  31 -16.618  23.084 -11.875
  240    HB2  HIS  31           HB2      HIS  31 -18.090  25.062 -10.142
  241    HB3  HIS  31           HB3      HIS  31 -18.211  24.937 -11.895
  242    HD1  HIS  31           HD1      HIS  31 -19.376  22.599 -12.864
  243    HD2  HIS  31           HD2      HIS  31 -19.402  23.217  -8.694
  244    HE1  HIS  31           HE1      HIS  31 -20.970  20.879 -11.899
  245    H    SER  32           H        SER  32 -14.107  23.394 -10.770
  246    HA   SER  32           HA       SER  32 -13.138  25.585 -12.451
  247    HB2  SER  32           HB2      SER  32 -11.953  25.108  -9.679
  248    HB3  SER  32           HB3      SER  32 -11.470  26.330 -10.855
  249    HG   SER  32           HG       SER  32 -12.807  27.217  -9.211
  250    H    TRP  33           H        TRP  33 -10.865  24.993 -13.160
  251    HA   TRP  33           HA       TRP  33 -10.902  22.320 -14.044
  252    HB2  TRP  33           HB2      TRP  33  -8.528  24.199 -14.119
  253    HB3  TRP  33           HB3      TRP  33  -8.928  22.910 -15.245
  254    HD1  TRP  33           HD1      TRP  33  -9.599  26.552 -14.504
  255    HE1  TRP  33           HE1      TRP  33 -11.188  27.584 -16.206
  256    HE3  TRP  33           HE3      TRP  33 -10.802  22.340 -17.124
  257    HZ2  TRP  33           HZ2      TRP  33 -12.886  26.677 -18.382
  258    HZ3  TRP  33           HZ3      TRP  33 -12.439  22.437 -19.002
  259    HH2  TRP  33           HH2      TRP  33 -13.507  24.600 -19.613
  260    H    GLN  34           H        GLN  34  -9.215  20.654 -13.903
  261    HA   GLN  34           HA       GLN  34  -7.406  20.716 -11.597
  262    HB2  GLN  34           HB2      GLN  34  -9.582  19.701 -10.807
  263    HB3  GLN  34           HB3      GLN  34  -9.366  18.410 -11.992
  264    HG2  GLN  34           HG2      GLN  34  -7.041  18.100 -10.666
  265    HG3  GLN  34           HG3      GLN  34  -7.894  18.974  -9.413
  266   HE21  GLN  34          HE22      GLN  34  -7.698  15.985 -11.302
  267   HE22  GLN  34          HE21      GLN  34  -8.744  15.029 -10.251
  268    H    PHE  35           H        PHE  35  -5.671  19.300 -11.864
  269    HA   PHE  35           HA       PHE  35  -4.893  18.425 -14.488
  270    HB2  PHE  35           HB2      PHE  35  -3.036  17.311 -12.977
  271    HB3  PHE  35           HB3      PHE  35  -3.111  19.050 -13.141
  272    HD1  PHE  35           HD1      PHE  35  -4.391  16.288 -10.872
  273    HD2  PHE  35           HD2      PHE  35  -3.145  20.413 -11.203
  274    HE1  PHE  35           HE1      PHE  35  -4.692  16.577  -8.437
  275    HE2  PHE  35           HE2      PHE  35  -3.424  20.679  -8.754
  276    HZ   PHE  35           HZ       PHE  35  -4.208  18.775  -7.368
  277    HA   PRO  36           HA       PRO  36  -6.381  14.143 -14.102
  278    HB2  PRO  36           HB2      PRO  36  -4.922  12.862 -15.974
  279    HB3  PRO  36           HB3      PRO  36  -5.979  14.222 -16.412
  280    HG2  PRO  36           HG2      PRO  36  -2.993  14.339 -15.849
  281    HG3  PRO  36           HG3      PRO  36  -3.863  14.941 -17.301
  282    HD2  PRO  36           HD2      PRO  36  -3.252  16.554 -15.164
  283    HD3  PRO  36           HD3      PRO  36  -4.732  16.775 -16.136
  284    H    GLN  37           H        GLN  37  -4.087  12.055 -14.566
  285    HA   GLN  37           HA       GLN  37  -2.448  10.886 -13.456
  286    HB2  GLN  37           HB2      GLN  37  -2.361  12.729 -11.123
  287    HB3  GLN  37           HB3      GLN  37  -1.221  11.488 -11.643
  288    HG2  GLN  37           HG2      GLN  37  -0.337  12.827 -13.381
  289    HG3  GLN  37           HG3      GLN  37  -1.702  13.933 -13.387
  290   HE21  GLN  37          HE22      GLN  37   1.151  12.949 -11.342
  291   HE22  GLN  37          HE21      GLN  37   1.284  14.498 -10.577
  292    H    GLY  38           H        GLY  38  -3.282   8.967 -12.817
  293    HA2  GLY  38           HA2      GLY  38  -5.105   8.867 -10.455
  294    HA3  GLY  38           HA3      GLY  38  -5.543   8.053 -11.967
  295    H    GLY  39           H        GLY  39  -4.905   6.898  -9.253
  296    HA2  GLY  39           HA2      GLY  39  -2.241   5.982  -9.136
  297    HA3  GLY  39           HA3      GLY  39  -3.589   5.444  -8.146
  298    H    ILE  40           H        ILE  40  -1.462   3.896  -9.191
  299    HA   ILE  40           HA       ILE  40  -2.689   1.979 -11.096
  300    HB   ILE  40           HB       ILE  40   0.077   2.172  -9.831
  301   HG12  ILE  40          HG12      ILE  40  -1.000   2.827 -12.596
  302   HG13  ILE  40          HG13      ILE  40  -0.236   3.907 -11.458
  303   HG21  ILE  40          HG21      ILE  40  -0.909   0.154 -11.875
  304   HG22  ILE  40          HG22      ILE  40   0.763   0.327 -11.291
  305   HG23  ILE  40          HG23      ILE  40  -0.485  -0.177 -10.185
  306   HD11  ILE  40          HD11      ILE  40   1.111   1.745 -13.112
  307   HD12  ILE  40          HD12      ILE  40   1.323   3.498 -13.208
  308   HD13  ILE  40          HD13      ILE  40   1.931   2.623 -11.796
  309    H    ASN  41           H        ASN  41  -3.421  -0.061 -10.425
  310    HA   ASN  41           HA       ASN  41  -3.895  -0.374  -7.536
  311    HB2  ASN  41           HB2      ASN  41  -4.818  -1.991  -9.945
  312    HB3  ASN  41           HB3      ASN  41  -5.199  -2.418  -8.295
  313   HD21  ASN  41          HD22      ASN  41  -5.802  -0.085 -10.883
  314   HD22  ASN  41          HD21      ASN  41  -7.168   0.713 -10.096
  315    HA   PRO  42           HA       PRO  42  -0.547  -2.961  -6.673
  316    HB2  PRO  42           HB2      PRO  42  -1.534  -4.968  -5.026
  317    HB3  PRO  42           HB3      PRO  42  -1.194  -3.292  -4.515
  318    HG2  PRO  42           HG2      PRO  42  -3.845  -4.477  -5.389
  319    HG3  PRO  42           HG3      PRO  42  -3.513  -3.445  -3.959
  320    HD2  PRO  42           HD2      PRO  42  -4.527  -2.378  -6.213
  321    HD3  PRO  42           HD3      PRO  42  -3.254  -1.500  -5.321
  322    H    GLY  43           H        GLY  43   0.358  -3.997  -8.213
  323    HA2  GLY  43           HA2      GLY  43   1.073  -5.860  -9.413
  324    HA3  GLY  43           HA3      GLY  43  -0.376  -6.752  -8.924
  325    H    GLU  44           H        GLU  44  -1.228  -3.663 -10.104
  326    HA   GLU  44           HA       GLU  44  -2.126  -4.699 -12.728
  327    HB2  GLU  44           HB2      GLU  44  -3.546  -3.328 -11.225
  328    HB3  GLU  44           HB3      GLU  44  -2.417  -1.974 -11.419
  329    HG2  GLU  44           HG2      GLU  44  -2.900  -1.853 -13.791
  330    HG3  GLU  44           HG3      GLU  44  -3.904  -3.307 -13.701
  331    H    SER  45           H        SER  45  -0.942  -4.402 -14.553
  332    HA   SER  45           HA       SER  45   1.610  -3.066 -14.466
  333    HB2  SER  45           HB2      SER  45   1.437  -3.868 -16.989
  334    HB3  SER  45           HB3      SER  45   1.801  -4.959 -15.649
  335    HG   SER  45           HG       SER  45   0.175  -6.037 -16.491
  336    H    ALA  46           H        ALA  46   2.272  -1.516 -16.105
  337    HA   ALA  46           HA       ALA  46   1.061   0.888 -15.591
  338    HB1  ALA  46           HB1      ALA  46   3.376   0.548 -16.404
  339    HB2  ALA  46           HB2      ALA  46   2.743   0.083 -18.007
  340    HB3  ALA  46           HB3      ALA  46   2.525   1.749 -17.403
  341    H    GLU  47           H        GLU  47   0.625  -1.099 -18.570
  342    HA   GLU  47           HA       GLU  47  -0.973   0.943 -19.851
  343    HB2  GLU  47           HB2      GLU  47  -0.484  -1.993 -20.482
  344    HB3  GLU  47           HB3      GLU  47  -1.476  -0.928 -21.483
  345    HG2  GLU  47           HG2      GLU  47   0.416   0.574 -21.857
  346    HG3  GLU  47           HG3      GLU  47   1.453  -0.419 -20.827
  347    H    GLN  48           H        GLN  48  -1.661  -2.039 -18.005
  348    HA   GLN  48           HA       GLN  48  -4.476  -2.122 -18.392
  349    HB2  GLN  48           HB2      GLN  48  -2.614  -3.256 -16.245
  350    HB3  GLN  48           HB3      GLN  48  -4.344  -3.503 -16.209
  351    HG2  GLN  48           HG2      GLN  48  -3.028  -5.379 -17.258
  352    HG3  GLN  48           HG3      GLN  48  -4.377  -4.761 -18.206
  353   HE21  GLN  48          HE22      GLN  48  -0.765  -4.400 -17.916
  354   HE22  GLN  48          HE21      GLN  48  -0.514  -4.070 -19.618
  355    H    ALA  49           H        ALA  49  -2.467  -0.530 -15.841
  356    HA   ALA  49           HA       ALA  49  -4.658   0.700 -14.472
  357    HB1  ALA  49           HB1      ALA  49  -2.391   0.516 -13.518
  358    HB2  ALA  49           HB2      ALA  49  -1.770   1.613 -14.777
  359    HB3  ALA  49           HB3      ALA  49  -2.954   2.204 -13.583
  360    H    MET  50           H        MET  50  -2.728   1.730 -17.344
  361    HA   MET  50           HA       MET  50  -3.696   4.384 -17.394
  362    HB2  MET  50           HB2      MET  50  -1.662   3.594 -18.501
  363    HB3  MET  50           HB3      MET  50  -2.611   2.672 -19.656
  364    HG2  MET  50           HG2      MET  50  -2.898   5.659 -19.282
  365    HG3  MET  50           HG3      MET  50  -1.749   4.938 -20.395
  366    HE1  MET  50           HE1      MET  50  -3.704   3.593 -23.339
  367    HE2  MET  50           HE2      MET  50  -2.155   4.229 -22.748
  368    HE3  MET  50           HE3      MET  50  -2.842   2.744 -22.033
  369    H    TYR  51           H        TYR  51  -5.043   1.425 -18.947
  370    HA   TYR  51           HA       TYR  51  -7.318   2.903 -19.933
  371    HB2  TYR  51           HB2      TYR  51  -7.159  -0.071 -19.420
  372    HB3  TYR  51           HB3      TYR  51  -8.390   0.790 -20.344
  373    HD1  TYR  51           HD2      TYR  51  -7.765   1.953 -22.545
  374    HD2  TYR  51           HD1      TYR  51  -5.060  -0.581 -20.363
  375    HE1  TYR  51           HE2      TYR  51  -6.387   1.699 -24.570
  376    HE2  TYR  51           HE1      TYR  51  -3.584  -0.757 -22.326
  377    HH   TYR  51           HH       TYR  51  -3.365  -0.279 -24.647
  378    H    ARG  52           H        ARG  52  -6.636   1.361 -16.764
  379    HA   ARG  52           HA       ARG  52  -9.333   1.433 -15.811
  380    HB2  ARG  52           HB2      ARG  52  -7.250   0.293 -14.732
  381    HB3  ARG  52           HB3      ARG  52  -6.852   1.884 -14.097
  382    HG2  ARG  52           HG2      ARG  52  -8.041   0.972 -12.328
  383    HG3  ARG  52           HG3      ARG  52  -9.278   1.927 -13.134
  384    HD2  ARG  52           HD2      ARG  52 -10.229  -0.210 -12.565
  385    HD3  ARG  52           HD3      ARG  52 -10.013  -0.214 -14.329
  386    HE   ARG  52           HE       ARG  52  -7.653  -1.287 -13.186
  387   HH11  ARG  52          HH11      ARG  52 -11.081  -2.285 -13.366
  388   HH12  ARG  52          HH12      ARG  52 -10.705  -3.966 -13.236
  389   HH21  ARG  52          HH21      ARG  52  -7.179  -3.327 -13.060
  390   HH22  ARG  52          HH22      ARG  52  -8.372  -4.623 -13.047
  391    H    ALA  53           H        ALA  53  -6.657   3.848 -15.620
  392    HA   ALA  53           HA       ALA  53  -8.245   5.804 -14.252
  393    HB1  ALA  53           HB1      ALA  53  -6.364   7.317 -14.820
  394    HB2  ALA  53           HB2      ALA  53  -5.807   5.776 -14.131
  395    HB3  ALA  53           HB3      ALA  53  -5.685   6.066 -15.880
  396    H    LEU  54           H        LEU  54  -7.703   5.079 -17.682
  397    HA   LEU  54           HA       LEU  54  -8.732   7.449 -18.906
  398    HB2  LEU  54           HB2      LEU  54  -7.454   5.641 -20.000
  399    HB3  LEU  54           HB3      LEU  54  -8.754   4.518 -19.598
  400    HG   LEU  54           HG       LEU  54 -10.251   5.623 -21.194
  401   HD11  LEU  54          HD11      LEU  54  -9.295   7.200 -22.816
  402   HD12  LEU  54          HD12      LEU  54  -9.167   7.885 -21.192
  403   HD13  LEU  54          HD13      LEU  54  -7.729   7.169 -21.969
  404   HD21  LEU  54          HD21      LEU  54  -9.060   3.651 -21.649
  405   HD22  LEU  54          HD22      LEU  54  -9.211   4.651 -23.095
  406   HD23  LEU  54          HD23      LEU  54  -7.641   4.572 -22.236
  407    H    PHE  55           H        PHE  55 -10.176   4.451 -17.771
  408    HA   PHE  55           HA       PHE  55 -12.917   5.126 -18.349
  409    HB2  PHE  55           HB2      PHE  55 -12.570   2.859 -18.351
  410    HB3  PHE  55           HB3      PHE  55 -11.447   2.896 -17.007
  411    HD1  PHE  55           HD1      PHE  55 -15.090   3.265 -17.805
  412    HD2  PHE  55           HD2      PHE  55 -12.072   2.468 -14.841
  413    HE1  PHE  55           HE1      PHE  55 -16.872   2.658 -16.171
  414    HE2  PHE  55           HE2      PHE  55 -13.854   1.832 -13.198
  415    HZ   PHE  55           HZ       PHE  55 -16.248   1.933 -13.867
  416    H    GLU  56           H        GLU  56 -11.101   5.067 -15.184
  417    HA   GLU  56           HA       GLU  56 -13.289   5.962 -13.654
  418    HB2  GLU  56           HB2      GLU  56 -10.278   6.079 -13.276
  419    HB3  GLU  56           HB3      GLU  56 -11.366   6.746 -12.068
  420    HG2  GLU  56           HG2      GLU  56 -11.640   3.867 -12.996
  421    HG3  GLU  56           HG3      GLU  56 -10.508   4.343 -11.740
  422    H    GLU  57           H        GLU  57 -10.828   7.896 -15.421
  423    HA   GLU  57           HA       GLU  57 -11.846  10.388 -14.252
  424    HB2  GLU  57           HB2      GLU  57  -9.594   9.943 -16.254
  425    HB3  GLU  57           HB3      GLU  57  -9.976  11.431 -15.399
  426    HG2  GLU  57           HG2      GLU  57  -9.541  10.203 -13.227
  427    HG3  GLU  57           HG3      GLU  57  -8.941   8.845 -14.174
  428    H    VAL  58           H        VAL  58 -11.496   8.977 -17.572
  429    HA   VAL  58           HA       VAL  58 -13.018  11.282 -18.615
  430    HB   VAL  58           HB       VAL  58 -11.545   9.365 -20.395
  431   HG11  VAL  58          HG11      VAL  58 -11.136  11.429 -21.684
  432   HG12  VAL  58          HG12      VAL  58 -12.858  11.244 -21.333
  433   HG13  VAL  58          HG13      VAL  58 -11.897  12.394 -20.397
  434   HG21  VAL  58          HG21      VAL  58  -9.785   9.747 -18.737
  435   HG22  VAL  58          HG22      VAL  58  -9.441  10.736 -20.149
  436   HG23  VAL  58          HG23      VAL  58 -10.138  11.490 -18.700
  437    H    GLY  59           H        GLY  59 -13.491   7.940 -17.910
  438    HA2  GLY  59           HA2      GLY  59 -15.271   6.558 -18.293
  439    HA3  GLY  59           HA3      GLY  59 -16.176   7.936 -18.931
  440    H    LEU  60           H        LEU  60 -13.077   6.523 -19.968
  441    HA   LEU  60           HA       LEU  60 -14.193   5.826 -22.637
  442    HB2  LEU  60           HB2      LEU  60 -11.577   7.165 -21.857
  443    HB3  LEU  60           HB3      LEU  60 -11.847   6.413 -23.426
  444    HG   LEU  60           HG       LEU  60 -13.224   8.852 -22.227
  445   HD11  LEU  60          HD11      LEU  60 -10.977   9.238 -23.100
  446   HD12  LEU  60          HD12      LEU  60 -11.391   8.431 -24.625
  447   HD13  LEU  60          HD13      LEU  60 -12.155   9.968 -24.200
  448   HD21  LEU  60          HD21      LEU  60 -14.339   9.035 -24.525
  449   HD22  LEU  60          HD22      LEU  60 -13.963   7.329 -24.741
  450   HD23  LEU  60          HD23      LEU  60 -14.998   7.831 -23.415
  451    H    SER  61           H        SER  61 -13.327   3.891 -23.502
  452    HA   SER  61           HA       SER  61 -12.224   2.068 -21.414
  453    HB2  SER  61           HB2      SER  61 -14.027   1.567 -23.808
  454    HB3  SER  61           HB3      SER  61 -13.564   0.376 -22.577
  455    HG   SER  61           HG       SER  61 -15.634   1.329 -22.159
  456    H    ARG  62           H        ARG  62 -11.444  -0.078 -22.738
  457    HA   ARG  62           HA       ARG  62  -8.857   0.498 -23.751
  458    HB2  ARG  62           HB2      ARG  62 -10.423  -2.116 -23.766
  459    HB3  ARG  62           HB3      ARG  62  -8.679  -1.954 -23.963
  460    HG2  ARG  62           HG2      ARG  62  -8.450  -1.112 -21.684
  461    HG3  ARG  62           HG3      ARG  62 -10.200  -1.237 -21.425
  462    HD2  ARG  62           HD2      ARG  62 -10.038  -3.697 -21.876
  463    HD3  ARG  62           HD3      ARG  62  -8.277  -3.514 -22.038
  464    HE   ARG  62           HE       ARG  62  -9.257  -2.442 -19.529
  465   HH11  ARG  62          HH11      ARG  62  -8.465  -5.539 -21.109
  466   HH12  ARG  62          HH12      ARG  62  -8.146  -6.364 -19.627
  467   HH21  ARG  62          HH21      ARG  62  -8.829  -3.555 -17.562
  468   HH22  ARG  62          HH22      ARG  62  -8.366  -5.219 -17.575
  469    H    LYS  63           H        LYS  63 -10.627   1.795 -25.475
  470    HA   LYS  63           HA       LYS  63  -9.992   0.707 -28.110
  471    HB2  LYS  63           HB2      LYS  63 -12.267   0.211 -28.806
  472    HB3  LYS  63           HB3      LYS  63 -11.820  -0.773 -27.405
  473    HG2  LYS  63           HG2      LYS  63 -13.163   0.657 -25.912
  474    HG3  LYS  63           HG3      LYS  63 -13.528   1.752 -27.245
  475    HD2  LYS  63           HD2      LYS  63 -15.434   0.347 -26.824
  476    HD3  LYS  63           HD3      LYS  63 -14.761  -0.028 -28.418
  477    HE2  LYS  63           HE2      LYS  63 -13.633  -2.037 -27.469
  478    HE3  LYS  63           HE3      LYS  63 -14.266  -1.636 -25.864
  479    HZ1  LYS  63           HZ1      LYS  63 -15.925  -2.326 -28.233
  480    HZ2  LYS  63           HZ2      LYS  63 -15.618  -3.313 -26.973
  481    HZ3  LYS  63           HZ3      LYS  63 -16.517  -1.970 -26.747
  482    H    ASP  64           H        ASP  64 -11.183   3.197 -26.028
  483    HA   ASP  64           HA       ASP  64 -12.372   4.847 -28.122
  484    HB2  ASP  64           HB2      ASP  64 -12.000   4.946 -25.118
  485    HB3  ASP  64           HB3      ASP  64 -12.540   6.362 -25.984
  486    H    VAL  65           H        VAL  65  -9.210   4.309 -27.393
  487    HA   VAL  65           HA       VAL  65  -8.337   6.965 -28.251
  488    HB   VAL  65           HB       VAL  65  -6.744   7.170 -26.404
  489   HG11  VAL  65          HG11      VAL  65  -8.953   8.345 -26.306
  490   HG12  VAL  65          HG12      VAL  65  -9.548   7.036 -25.264
  491   HG13  VAL  65          HG13      VAL  65  -8.192   8.049 -24.729
  492   HG21  VAL  65          HG21      VAL  65  -8.259   4.864 -25.099
  493   HG22  VAL  65          HG22      VAL  65  -6.579   4.811 -25.656
  494   HG23  VAL  65          HG23      VAL  65  -7.031   5.867 -24.309
  495    H    ARG  66           H        ARG  66  -5.874   6.852 -28.577
  496    HA   ARG  66           HA       ARG  66  -4.961   4.173 -29.539
  497    HB2  ARG  66           HB2      ARG  66  -5.994   5.219 -31.440
  498    HB3  ARG  66           HB3      ARG  66  -5.454   6.822 -30.968
  499    HG2  ARG  66           HG2      ARG  66  -4.275   6.223 -32.881
  500    HG3  ARG  66           HG3      ARG  66  -3.137   6.257 -31.543
  501    HD2  ARG  66           HD2      ARG  66  -4.413   3.609 -32.273
  502    HD3  ARG  66           HD3      ARG  66  -3.260   4.282 -33.425
  503    HE   ARG  66           HE       ARG  66  -1.796   4.460 -31.167
  504   HH11  ARG  66          HH11      ARG  66  -3.548   1.721 -32.631
  505   HH12  ARG  66          HH12      ARG  66  -2.395   0.549 -32.108
  506   HH21  ARG  66          HH21      ARG  66  -0.288   2.950 -30.516
  507   HH22  ARG  66          HH22      ARG  66  -0.491   1.258 -30.858
  508    H    ILE  67           H        ILE  67  -2.911   3.918 -28.472
  509    HA   ILE  67           HA       ILE  67  -1.633   6.250 -27.319
  510    HB   ILE  67           HB       ILE  67  -0.656   3.388 -27.689
  511   HG12  ILE  67          HG12      ILE  67  -1.751   4.574 -25.111
  512   HG13  ILE  67          HG13      ILE  67  -2.843   3.823 -26.270
  513   HG21  ILE  67          HG21      ILE  67   1.212   4.911 -27.268
  514   HG22  ILE  67          HG22      ILE  67   0.348   5.639 -25.886
  515   HG23  ILE  67          HG23      ILE  67   0.911   3.954 -25.827
  516   HD11  ILE  67          HD11      ILE  67  -2.193   2.187 -24.602
  517   HD12  ILE  67          HD12      ILE  67  -1.516   1.723 -26.175
  518   HD13  ILE  67          HD13      ILE  67  -0.476   2.442 -24.921
  519    H    LEU  68           H        LEU  68  -0.199   7.590 -28.230
  520    HA   LEU  68           HA       LEU  68   1.043   6.753 -30.846
  521    HB2  LEU  68           HB2      LEU  68  -0.227   9.259 -30.010
  522    HB3  LEU  68           HB3      LEU  68   1.432   9.548 -30.494
  523    HG   LEU  68           HG       LEU  68  -0.176   9.869 -32.310
  524   HD11  LEU  68          HD11      LEU  68   1.714   7.535 -32.868
  525   HD12  LEU  68          HD12      LEU  68   1.027   8.653 -34.056
  526   HD13  LEU  68          HD13      LEU  68   2.166   9.252 -32.841
  527   HD21  LEU  68          HD21      LEU  68  -1.766   8.050 -31.614
  528   HD22  LEU  68          HD22      LEU  68  -1.387   8.077 -33.349
  529   HD23  LEU  68          HD23      LEU  68  -0.647   6.853 -32.300
  530    H    ALA  69           H        ALA  69   1.716   7.893 -27.552
  531    HA   ALA  69           HA       ALA  69   4.528   7.189 -27.834
  532    HB1  ALA  69           HB1      ALA  69   4.437   9.533 -28.777
  533    HB2  ALA  69           HB2      ALA  69   3.714  10.087 -27.266
  534    HB3  ALA  69           HB3      ALA  69   5.364   9.444 -27.265
  535    H    SER  70           H        SER  70   5.607   7.481 -25.629
  536    HA   SER  70           HA       SER  70   3.912   8.115 -23.364
  537    HB2  SER  70           HB2      SER  70   4.636   5.966 -22.180
  538    HB3  SER  70           HB3      SER  70   3.347   5.828 -23.384
  539    HG   SER  70           HG       SER  70   4.906   4.168 -23.662
  540    H    THR  71           H        THR  71   5.333   8.394 -21.365
  541    HA   THR  71           HA       THR  71   7.733   9.738 -22.114
  542    HB   THR  71           HB       THR  71   8.054   9.663 -19.500
  543    HG1  THR  71           HG1      THR  71   6.628   8.042 -18.979
  544   HG21  THR  71          HG21      THR  71   5.673  10.974 -20.876
  545   HG22  THR  71          HG22      THR  71   6.264  11.393 -19.246
  546   HG23  THR  71          HG23      THR  71   7.295  11.655 -20.663
  547    H    ARG  72           H        ARG  72   9.947   9.240 -21.702
  548    HA   ARG  72           HA       ARG  72  10.605   6.635 -22.583
  549    HB2  ARG  72           HB2      ARG  72  12.524   8.603 -21.258
  550    HB3  ARG  72           HB3      ARG  72  12.934   7.295 -22.367
  551    HG2  ARG  72           HG2      ARG  72  11.646   8.492 -24.182
  552    HG3  ARG  72           HG3      ARG  72  11.362   9.817 -23.036
  553    HD2  ARG  72           HD2      ARG  72  13.935   9.921 -22.768
  554    HD3  ARG  72           HD3      ARG  72  13.992   8.899 -24.216
  555    HE   ARG  72           HE       ARG  72  12.326  11.345 -24.364
  556   HH11  ARG  72          HH11      ARG  72  15.505   9.945 -25.211
  557   HH12  ARG  72          HH12      ARG  72  15.909  11.229 -26.289
  558   HH21  ARG  72          HH21      ARG  72  12.906  13.057 -25.602
  559   HH22  ARG  72          HH22      ARG  72  14.349  13.034 -26.587
  560    H    ASN  73           H        ASN  73  10.562   8.015 -19.340
  561    HA   ASN  73           HA       ASN  73  10.393   5.435 -18.140
  562    HB2  ASN  73           HB2      ASN  73  12.213   5.523 -16.613
  563    HB3  ASN  73           HB3      ASN  73  12.915   5.787 -18.195
  564   HD21  ASN  73          HD22      ASN  73  13.311   8.236 -18.772
  565   HD22  ASN  73          HD21      ASN  73  13.808   9.259 -17.447
  566    H    TRP  74           H        TRP  74  10.055   5.946 -15.574
  567    HA   TRP  74           HA       TRP  74   7.712   7.490 -15.563
  568    HB2  TRP  74           HB2      TRP  74   9.380   6.458 -13.235
  569    HB3  TRP  74           HB3      TRP  74   7.713   7.009 -13.151
  570    HD1  TRP  74           HD1      TRP  74   9.817   4.071 -14.499
  571    HE1  TRP  74           HE1      TRP  74   8.305   2.084 -15.014
  572    HE3  TRP  74           HE3      TRP  74   5.311   6.103 -13.260
  573    HZ2  TRP  74           HZ2      TRP  74   5.489   1.563 -15.265
  574    HZ3  TRP  74           HZ3      TRP  74   3.205   4.854 -13.703
  575    HH2  TRP  74           HH2      TRP  74   3.248   2.653 -14.803
  576    H    LEU  75           H        LEU  75   7.338   9.596 -15.216
  577    HA   LEU  75           HA       LEU  75   9.508  11.473 -14.454
  578    HB2  LEU  75           HB2      LEU  75   6.673  11.726 -15.502
  579    HB3  LEU  75           HB3      LEU  75   7.323  13.046 -14.560
  580    HG   LEU  75           HG       LEU  75   7.501  13.317 -17.038
  581   HD11  LEU  75          HD11      LEU  75   8.848  14.673 -15.532
  582   HD12  LEU  75          HD12      LEU  75  10.119  13.428 -15.475
  583   HD13  LEU  75          HD13      LEU  75   9.768  14.287 -16.987
  584   HD21  LEU  75          HD21      LEU  75   9.768  11.293 -16.890
  585   HD22  LEU  75          HD22      LEU  75   8.166  10.971 -17.568
  586   HD23  LEU  75          HD23      LEU  75   9.207  12.204 -18.309
  587    H    ARG  76           H        ARG  76   9.646  12.297 -12.314
  588    HA   ARG  76           HA       ARG  76   7.430  11.825 -10.472
  589    HB2  ARG  76           HB2      ARG  76   8.570  10.485  -8.874
  590    HB3  ARG  76           HB3      ARG  76   8.540   9.623 -10.390
  591    HG2  ARG  76           HG2      ARG  76  10.994  11.108  -9.341
  592    HG3  ARG  76           HG3      ARG  76  10.632   9.410  -9.033
  593    HD2  ARG  76           HD2      ARG  76  10.604   8.969 -11.480
  594    HD3  ARG  76           HD3      ARG  76  11.118  10.648 -11.771
  595    HE   ARG  76           HE       ARG  76  12.978   9.584  -9.984
  596   HH11  ARG  76          HH11      ARG  76  11.860   8.912 -13.298
  597   HH12  ARG  76          HH12      ARG  76  13.359   8.298 -13.856
  598   HH21  ARG  76          HH21      ARG  76  15.024   8.757 -10.709
  599   HH22  ARG  76          HH22      ARG  76  15.225   8.221 -12.337
  600    H    TYR  77           H        TYR  77   7.599  13.003  -8.523
  601    HA   TYR  77           HA       TYR  77   9.851  14.855  -8.143
  602    HB2  TYR  77           HB2      TYR  77   8.339  16.839  -8.204
  603    HB3  TYR  77           HB3      TYR  77   8.542  16.085  -9.769
  604    HD1  TYR  77           HD1      TYR  77   6.199  16.491  -6.896
  605    HD2  TYR  77           HD2      TYR  77   6.679  15.113 -10.944
  606    HE1  TYR  77           HE1      TYR  77   3.794  16.063  -7.022
  607    HE2  TYR  77           HE2      TYR  77   4.237  14.773 -11.139
  608    HH   TYR  77           HH       TYR  77   2.034  15.256  -8.295
  609    H    LYS  78           H        LYS  78   9.515  16.124  -6.203
  610    HA   LYS  78           HA       LYS  78   8.491  14.345  -4.080
  611    HB2  LYS  78           HB2      LYS  78  10.915  15.237  -4.347
  612    HB3  LYS  78           HB3      LYS  78  10.302  16.786  -3.800
  613    HG2  LYS  78           HG2      LYS  78  10.146  14.156  -2.242
  614    HG3  LYS  78           HG3      LYS  78  11.423  15.357  -2.085
  615    HD2  LYS  78           HD2      LYS  78   9.586  17.057  -1.466
  616    HD3  LYS  78           HD3      LYS  78   8.507  15.662  -1.362
  617    HE2  LYS  78           HE2      LYS  78   9.222  16.086   0.861
  618    HE3  LYS  78           HE3      LYS  78  10.053  14.617   0.335
  619    HZ1  LYS  78           HZ1      LYS  78  11.267  17.341   0.417
  620    HZ2  LYS  78           HZ2      LYS  78  11.533  16.156   1.504
  621    HZ3  LYS  78           HZ3      LYS  78  12.061  15.976  -0.025
  622    H    LEU  79           H        LEU  79   6.744  14.964  -2.891
  623    HA   LEU  79           HA       LEU  79   5.067  17.117  -3.870
  624    HB2  LEU  79           HB2      LEU  79   4.839  15.108  -1.587
  625    HB3  LEU  79           HB3      LEU  79   3.595  16.319  -1.871
  626    HG   LEU  79           HG       LEU  79   4.448  14.407  -4.070
  627   HD11  LEU  79          HD11      LEU  79   2.213  13.914  -2.049
  628   HD12  LEU  79          HD12      LEU  79   2.586  12.919  -3.478
  629   HD13  LEU  79          HD13      LEU  79   3.741  13.014  -2.146
  630   HD21  LEU  79          HD21      LEU  79   2.283  14.887  -5.022
  631   HD22  LEU  79          HD22      LEU  79   1.806  15.828  -3.595
  632   HD23  LEU  79          HD23      LEU  79   3.080  16.430  -4.679
  633    HA   PRO  80           HA       PRO  80   6.414  20.235  -0.883
  634    HB2  PRO  80           HB2      PRO  80   4.186  21.811  -0.661
  635    HB3  PRO  80           HB3      PRO  80   5.169  21.756  -2.160
  636    HG2  PRO  80           HG2      PRO  80   2.695  20.108  -1.509
  637    HG3  PRO  80           HG3      PRO  80   2.946  21.175  -2.949
  638    HD2  PRO  80           HD2      PRO  80   3.420  18.535  -3.116
  639    HD3  PRO  80           HD3      PRO  80   4.584  19.682  -3.844
  640    H    LYS  81           H        LYS  81   6.053  20.722   1.423
  641    HA   LYS  81           HA       LYS  81   5.542  18.446   2.893
  642    HB2  LYS  81           HB2      LYS  81   5.440  21.352   3.815
  643    HB3  LYS  81           HB3      LYS  81   5.517  19.995   4.927
  644    HG2  LYS  81           HG2      LYS  81   7.626  20.620   2.811
  645    HG3  LYS  81           HG3      LYS  81   7.718  21.145   4.477
  646    HD2  LYS  81           HD2      LYS  81   7.665  18.234   3.560
  647    HD3  LYS  81           HD3      LYS  81   9.114  19.132   3.969
  648    HE2  LYS  81           HE2      LYS  81   6.835  18.554   5.932
  649    HE3  LYS  81           HE3      LYS  81   8.307  17.597   5.771
  650    HZ1  LYS  81           HZ1      LYS  81   9.597  19.566   6.404
  651    HZ2  LYS  81           HZ2      LYS  81   8.226  20.442   6.617
  652    HZ3  LYS  81           HZ3      LYS  81   8.537  19.154   7.567
  653    H    ARG  82           H        ARG  82   3.195  20.957   2.222
  654    HA   ARG  82           HA       ARG  82   1.196  19.936   4.007
  655    HB2  ARG  82           HB2      ARG  82  -0.235  21.651   3.075
  656    HB3  ARG  82           HB3      ARG  82   1.364  22.286   3.388
  657    HG2  ARG  82           HG2      ARG  82   1.698  21.659   0.746
  658    HG3  ARG  82           HG3      ARG  82  -0.052  21.800   0.774
  659    HD2  ARG  82           HD2      ARG  82   0.863  23.935   0.157
  660    HD3  ARG  82           HD3      ARG  82   0.207  24.084   1.798
  661    HE   ARG  82           HE       ARG  82   3.005  23.378   1.883
  662   HH11  ARG  82          HH11      ARG  82   0.898  26.155   1.171
  663   HH12  ARG  82          HH12      ARG  82   2.062  27.344   1.637
  664   HH21  ARG  82          HH21      ARG  82   4.569  24.977   2.498
  665   HH22  ARG  82          HH22      ARG  82   4.192  26.655   2.390
  666    H    LEU  83           H        LEU  83   2.095  19.036   0.744
  667    HA   LEU  83           HA       LEU  83  -0.493  17.648   0.373
  668    HB2  LEU  83           HB2      LEU  83   0.387  19.312  -1.366
  669    HB3  LEU  83           HB3      LEU  83   1.608  18.091  -1.742
  670    HG   LEU  83           HG       LEU  83  -0.193  16.490  -2.374
  671   HD11  LEU  83          HD11      LEU  83  -2.070  18.815  -1.748
  672   HD12  LEU  83          HD12      LEU  83  -2.525  17.375  -2.684
  673   HD13  LEU  83          HD13      LEU  83  -2.075  17.201  -0.994
  674   HD21  LEU  83          HD21      LEU  83   0.822  17.995  -4.044
  675   HD22  LEU  83          HD22      LEU  83  -0.870  17.649  -4.430
  676   HD23  LEU  83          HD23      LEU  83  -0.424  19.216  -3.716
  677    H    VAL  84           H        VAL  84   2.895  17.065   1.049
  678    HA   VAL  84           HA       VAL  84   3.181  14.351   0.391
  679    HB   VAL  84           HB       VAL  84   3.954  15.856   2.928
  680   HG11  VAL  84          HG11      VAL  84   5.472  13.984   3.515
  681   HG12  VAL  84          HG12      VAL  84   3.790  13.473   3.590
  682   HG13  VAL  84          HG13      VAL  84   4.794  13.007   2.212
  683   HG21  VAL  84          HG21      VAL  84   5.653  14.835   0.616
  684   HG22  VAL  84          HG22      VAL  84   5.148  16.513   0.858
  685   HG23  VAL  84          HG23      VAL  84   6.231  15.751   2.023
  686    H    ARG  85           H        ARG  85   2.200  12.534   1.021
  687    HA   ARG  85           HA       ARG  85  -0.316  12.838   2.552
  688    HB2  ARG  85           HB2      ARG  85   0.842  10.462   1.068
  689    HB3  ARG  85           HB3      ARG  85  -0.708  10.460   1.876
  690    HG2  ARG  85           HG2      ARG  85  -0.111  12.632  -0.161
  691    HG3  ARG  85           HG3      ARG  85  -0.530  11.015  -0.723
  692    HD2  ARG  85           HD2      ARG  85  -2.236  12.703   1.148
  693    HD3  ARG  85           HD3      ARG  85  -2.475  12.581  -0.601
  694    HE   ARG  85           HE       ARG  85  -2.621  10.076  -0.213
  695   HH11  ARG  85          HH11      ARG  85  -4.062  12.491   1.966
  696   HH12  ARG  85          HH12      ARG  85  -5.046  11.353   2.816
  697   HH21  ARG  85          HH21      ARG  85  -3.958   8.546   0.960
  698   HH22  ARG  85          HH22      ARG  85  -4.787   9.049   2.397
  699    H    TRP  86           H        TRP  86   0.031  12.983   4.629
  700    HA   TRP  86           HA       TRP  86   1.950  11.217   6.018
  701    HB2  TRP  86           HB2      TRP  86   0.101  13.358   7.111
  702    HB3  TRP  86           HB3      TRP  86   1.358  12.517   8.010
  703    HD1  TRP  86           HD1      TRP  86   0.839  15.334   5.554
  704    HE1  TRP  86           HE1      TRP  86   3.024  16.506   4.994
  705    HE3  TRP  86           HE3      TRP  86   4.072  12.181   7.967
  706    HZ2  TRP  86           HZ2      TRP  86   5.851  16.167   5.572
  707    HZ3  TRP  86           HZ3      TRP  86   6.512  12.612   7.919
  708    HH2  TRP  86           HH2      TRP  86   7.415  14.603   6.730
  709    H    ASP  87           H        ASP  87  -1.045  10.749   4.769
  710    HA   ASP  87           HA       ASP  87  -2.339   9.362   7.033
  711    HB2  ASP  87           HB2      ASP  87  -3.697  10.878   5.729
  712    HB3  ASP  87           HB3      ASP  87  -3.131  10.166   4.221
  713    H    THR  88           H        THR  88  -0.281   8.743   4.239
  714    HA   THR  88           HA       THR  88  -1.171   5.974   3.942
  715    HB   THR  88           HB       THR  88   0.542   6.088   2.102
  716    HG1  THR  88           HG1      THR  88   1.881   7.611   2.500
  717   HG21  THR  88          HG21      THR  88  -1.588   8.249   1.984
  718   HG22  THR  88          HG22      THR  88  -0.726   7.549   0.599
  719   HG23  THR  88          HG23      THR  88  -1.815   6.535   1.567
  720    H    LYS  89           H        LYS  89   0.544   4.288   4.015
  721    HA   LYS  89           HA       LYS  89   2.958   4.932   5.597
  722    HB2  LYS  89           HB2      LYS  89   1.093   2.630   6.277
  723    HB3  LYS  89           HB3      LYS  89   2.720   2.832   6.919
  724    HG2  LYS  89           HG2      LYS  89   0.426   4.783   7.309
  725    HG3  LYS  89           HG3      LYS  89   0.917   3.575   8.482
  726    HD2  LYS  89           HD2      LYS  89   3.017   4.630   8.902
  727    HD3  LYS  89           HD3      LYS  89   2.856   5.744   7.552
  728    HE2  LYS  89           HE2      LYS  89   1.122   5.743  10.058
  729    HE3  LYS  89           HE3      LYS  89   2.441   6.854   9.690
  730    HZ1  LYS  89           HZ1      LYS  89  -0.185   6.700   8.350
  731    HZ2  LYS  89           HZ2      LYS  89   0.507   7.989   9.074
  732    HZ3  LYS  89           HZ3      LYS  89   1.082   7.453   7.626
  733    HA   PRO  90           HA       PRO  90   5.224   4.714   4.991
  734    HB2  PRO  90           HB2      PRO  90   5.922   5.130   2.079
  735    HB3  PRO  90           HB3      PRO  90   7.015   5.028   3.495
  736    HG2  PRO  90           HG2      PRO  90   6.734   2.902   1.853
  737    HG3  PRO  90           HG3      PRO  90   6.734   2.656   3.628
  738    HD2  PRO  90           HD2      PRO  90   4.356   2.823   1.760
  739    HD3  PRO  90           HD3      PRO  90   4.676   1.647   3.065
  740    H    VAL  91           H        VAL  91   5.355   7.050   4.999
  741    HA   VAL  91           HA       VAL  91   3.011   8.477   4.089
  742    HB   VAL  91           HB       VAL  91   4.165  10.482   4.862
  743   HG11  VAL  91          HG11      VAL  91   4.226   8.229   6.911
  744   HG12  VAL  91          HG12      VAL  91   4.036   9.968   7.235
  745   HG13  VAL  91          HG13      VAL  91   2.774   9.088   6.365
  746   HG21  VAL  91          HG21      VAL  91   6.229  10.428   6.143
  747   HG22  VAL  91          HG22      VAL  91   6.475   8.710   5.745
  748   HG23  VAL  91          HG23      VAL  91   6.523   9.954   4.469
  749    H    CYS  92           H        CYS  92   2.808   9.573   2.185
  750    HA   CYS  92           HA       CYS  92   4.756   8.619   0.180
  751    HB2  CYS  92           HB2      CYS  92   2.250   8.221   0.081
  752    HB3  CYS  92           HB3      CYS  92   2.125   9.927  -0.473
  753    HG   CYS  92           HG       CYS  92   3.564   9.799  -2.541
  754    H    ILE  93           H        ILE  93   6.362   9.853  -0.266
  755    HA   ILE  93           HA       ILE  93   6.210  12.761   0.202
  756    HB   ILE  93           HB       ILE  93   8.652  12.681   0.149
  757   HG12  ILE  93          HG12      ILE  93   8.356   9.654  -0.134
  758   HG13  ILE  93          HG13      ILE  93   8.983  10.746  -1.370
  759   HG21  ILE  93          HG21      ILE  93   7.487  10.640   2.090
  760   HG22  ILE  93          HG22      ILE  93   8.901  11.678   2.341
  761   HG23  ILE  93          HG23      ILE  93   7.301  12.403   2.243
  762   HD11  ILE  93          HD11      ILE  93  10.851   9.727  -0.317
  763   HD12  ILE  93          HD12      ILE  93  10.810  11.394   0.287
  764   HD13  ILE  93          HD13      ILE  93  10.226  10.048   1.309
  765    H    GLY  94           H        GLY  94   5.855  10.674  -2.496
  766    HA2  GLY  94           HA2      GLY  94   6.107  13.032  -4.243
  767    HA3  GLY  94           HA3      GLY  94   7.216  11.718  -4.552
  768    H    GLN  95           H        GLN  95   5.596  12.400  -6.563
  769    HA   GLN  95           HA       GLN  95   3.433  10.330  -6.649
  770    HB2  GLN  95           HB2      GLN  95   3.004  13.032  -6.826
  771    HB3  GLN  95           HB3      GLN  95   3.433  12.715  -8.487
  772    HG2  GLN  95           HG2      GLN  95   1.072  12.677  -8.417
  773    HG3  GLN  95           HG3      GLN  95   1.535  11.008  -8.581
  774   HE21  GLN  95          HE22      GLN  95   0.735  13.432  -5.911
  775   HE22  GLN  95          HE21      GLN  95  -0.040  12.240  -4.897
  776    H    LYS  96           H        LYS  96   4.031   8.724  -8.120
  777    HA   LYS  96           HA       LYS  96   6.286   9.245 -10.036
  778    HB2  LYS  96           HB2      LYS  96   6.951   7.465  -8.620
  779    HB3  LYS  96           HB3      LYS  96   5.327   6.811  -8.474
  780    HG2  LYS  96           HG2      LYS  96   5.407   5.897 -10.748
  781    HG3  LYS  96           HG3      LYS  96   6.980   6.667 -11.039
  782    HD2  LYS  96           HD2      LYS  96   8.051   5.284  -9.396
  783    HD3  LYS  96           HD3      LYS  96   6.496   4.634  -8.834
  784    HE2  LYS  96           HE2      LYS  96   6.139   3.458 -10.960
  785    HE3  LYS  96           HE3      LYS  96   7.555   4.225 -11.671
  786    HZ1  LYS  96           HZ1      LYS  96   7.779   2.445  -9.290
  787    HZ2  LYS  96           HZ2      LYS  96   7.935   1.909 -10.841
  788    HZ3  LYS  96           HZ3      LYS  96   8.989   3.001 -10.239
  789    H    GLN  97           H        GLN  97   5.727   9.133 -12.270
  790    HA   GLN  97           HA       GLN  97   3.338   7.642 -12.930
  791    HB2  GLN  97           HB2      GLN  97   2.263   9.535 -14.250
  792    HB3  GLN  97           HB3      GLN  97   2.058   9.579 -12.522
  793    HG2  GLN  97           HG2      GLN  97   4.240  11.201 -13.856
  794    HG3  GLN  97           HG3      GLN  97   2.573  11.766 -13.763
  795   HE21  GLN  97          HE22      GLN  97   5.530  11.734 -12.056
  796   HE22  GLN  97          HE21      GLN  97   4.897  12.190 -10.487
  797    H    LYS  98           H        LYS  98   3.044   7.070 -14.996
  798    HA   LYS  98           HA       LYS  98   5.178   7.834 -16.954
  799    HB2  LYS  98           HB2      LYS  98   5.151   5.427 -16.532
  800    HB3  LYS  98           HB3      LYS  98   3.399   5.344 -16.785
  801    HG2  LYS  98           HG2      LYS  98   3.670   5.993 -19.140
  802    HG3  LYS  98           HG3      LYS  98   5.413   6.180 -18.931
  803    HD2  LYS  98           HD2      LYS  98   3.947   3.558 -18.436
  804    HD3  LYS  98           HD3      LYS  98   4.595   4.029 -20.022
  805    HE2  LYS  98           HE2      LYS  98   6.874   4.285 -18.977
  806    HE3  LYS  98           HE3      LYS  98   6.222   3.672 -17.451
  807    HZ1  LYS  98           HZ1      LYS  98   5.694   1.575 -18.623
  808    HZ2  LYS  98           HZ2      LYS  98   6.329   2.162 -20.019
  809    HZ3  LYS  98           HZ3      LYS  98   7.290   1.914 -18.728
  810    H    TRP  99           H        TRP  99   4.388   9.098 -18.617
  811    HA   TRP  99           HA       TRP  99   1.461   9.665 -18.577
  812    HB2  TRP  99           HB2      TRP  99   3.775  11.270 -19.683
  813    HB3  TRP  99           HB3      TRP  99   2.084  11.660 -19.892
  814    HD1  TRP  99           HD1      TRP  99   4.768  11.523 -17.159
  815    HE1  TRP  99           HE1      TRP  99   4.205  13.279 -15.385
  816    HE3  TRP  99           HE3      TRP  99   0.029  12.719 -18.675
  817    HZ2  TRP  99           HZ2      TRP  99   2.001  15.078 -14.773
  818    HZ3  TRP  99           HZ3      TRP  99  -1.250  14.495 -17.527
  819    HH2  TRP  99           HH2      TRP  99  -0.272  15.682 -15.572
  820    H    PHE 100           H        PHE 100   0.283   9.105 -20.373
  821    HA   PHE 100           HA       PHE 100   1.761   7.884 -22.680
  822    HB2  PHE 100           HB2      PHE 100  -0.961   7.204 -21.519
  823    HB3  PHE 100           HB3      PHE 100  -0.376   6.669 -23.089
  824    HD1  PHE 100           HD1      PHE 100   0.363   6.450 -19.407
  825    HD2  PHE 100           HD2      PHE 100   0.888   4.697 -23.322
  826    HE1  PHE 100           HE1      PHE 100   1.215   4.366 -18.366
  827    HE2  PHE 100           HE2      PHE 100   1.763   2.633 -22.272
  828    HZ   PHE 100           HZ       PHE 100   1.909   2.449 -19.801
  829    H    LEU 101           H        LEU 101   1.454   8.872 -24.579
  830    HA   LEU 101           HA       LEU 101  -0.314  11.235 -24.794
  831    HB2  LEU 101           HB2      LEU 101   2.083  11.106 -25.696
  832    HB3  LEU 101           HB3      LEU 101   1.474   9.938 -26.860
  833    HG   LEU 101           HG       LEU 101   0.769  12.875 -26.610
  834   HD11  LEU 101          HD11      LEU 101   1.944  11.189 -28.873
  835   HD12  LEU 101          HD12      LEU 101   1.694  12.948 -28.902
  836   HD13  LEU 101          HD13      LEU 101   2.876  12.242 -27.792
  837   HD21  LEU 101          HD21      LEU 101  -0.575  10.798 -28.397
  838   HD22  LEU 101          HD22      LEU 101  -1.351  11.879 -27.210
  839   HD23  LEU 101          HD23      LEU 101  -0.646  12.560 -28.663
  840    H    LEU 102           H        LEU 102  -2.384  10.671 -25.079
  841    HA   LEU 102           HA       LEU 102  -3.015   8.331 -26.805
  842    HB2  LEU 102           HB2      LEU 102  -4.498   9.753 -24.553
  843    HB3  LEU 102           HB3      LEU 102  -5.395   8.897 -25.791
  844    HG   LEU 102           HG       LEU 102  -5.176   7.430 -23.956
  845   HD11  LEU 102          HD11      LEU 102  -3.000   6.382 -25.757
  846   HD12  LEU 102          HD12      LEU 102  -4.357   5.507 -25.038
  847   HD13  LEU 102          HD13      LEU 102  -4.598   6.618 -26.432
  848   HD21  LEU 102          HD21      LEU 102  -3.196   8.514 -22.875
  849   HD22  LEU 102          HD22      LEU 102  -3.071   6.749 -22.954
  850   HD23  LEU 102          HD23      LEU 102  -2.152   7.748 -24.085
  851    H    GLN 103           H        GLN 103  -3.856   8.638 -28.718
  852    HA   GLN 103           HA       GLN 103  -4.689  11.402 -29.489
  853    HB2  GLN 103           HB2      GLN 103  -4.180   8.842 -31.055
  854    HB3  GLN 103           HB3      GLN 103  -5.108  10.169 -31.760
  855    HG2  GLN 103           HG2      GLN 103  -2.274  10.399 -30.660
  856    HG3  GLN 103           HG3      GLN 103  -2.698  10.282 -32.372
  857   HE21  GLN 103          HE22      GLN 103  -1.275  12.520 -30.884
  858   HE22  GLN 103          HE21      GLN 103  -2.299  13.927 -31.204
  859    H    LEU 104           H        LEU 104  -6.814  11.942 -29.518
  860    HA   LEU 104           HA       LEU 104  -8.644  10.199 -28.188
  861    HB2  LEU 104           HB2      LEU 104  -8.542  12.725 -28.174
  862    HB3  LEU 104           HB3      LEU 104  -9.199  12.716 -29.811
  863    HG   LEU 104           HG       LEU 104 -11.296  11.732 -28.987
  864   HD11  LEU 104          HD11      LEU 104 -10.529  10.390 -27.051
  865   HD12  LEU 104          HD12      LEU 104 -10.043  11.878 -26.203
  866   HD13  LEU 104          HD13      LEU 104 -11.746  11.555 -26.541
  867   HD21  LEU 104          HD21      LEU 104 -11.969  13.723 -27.525
  868   HD22  LEU 104          HD22      LEU 104 -10.267  14.185 -27.472
  869   HD23  LEU 104          HD23      LEU 104 -11.129  14.145 -29.037
  870    H    VAL 105           H        VAL 105 -10.194   8.772 -29.032
  871    HA   VAL 105           HA       VAL 105 -10.591   8.728 -32.001
  872    HB   VAL 105           HB       VAL 105 -10.577   6.343 -30.117
  873   HG11  VAL 105          HG11      VAL 105 -12.040   5.974 -32.024
  874   HG12  VAL 105          HG12      VAL 105 -10.741   6.452 -33.148
  875   HG13  VAL 105          HG13      VAL 105 -10.591   4.978 -32.161
  876   HG21  VAL 105          HG21      VAL 105  -8.444   6.989 -32.195
  877   HG22  VAL 105          HG22      VAL 105  -8.224   7.216 -30.452
  878   HG23  VAL 105          HG23      VAL 105  -8.498   5.604 -31.102
  879    H    SER 106           H        SER 106 -11.967   8.194 -28.746
  880    HA   SER 106           HA       SER 106 -14.662   7.808 -29.373
  881    HB2  SER 106           HB2      SER 106 -14.842   8.926 -26.990
  882    HB3  SER 106           HB3      SER 106 -14.015   7.381 -27.175
  883    HG   SER 106           HG       SER 106 -12.143   8.339 -26.664
  884    H    GLY 107           H        GLY 107 -13.197  10.797 -28.176
  885    HA2  GLY 107           HA2      GLY 107 -13.635  13.078 -28.752
  886    HA3  GLY 107           HA3      GLY 107 -14.887  12.560 -29.874
  887    H    ASP 108           H        ASP 108 -15.454  14.586 -28.087
  888    HA   ASP 108           HA       ASP 108 -16.818  14.220 -25.777
  889    HB2  ASP 108           HB2      ASP 108 -16.860  16.323 -26.891
  890    HB3  ASP 108           HB3      ASP 108 -17.623  15.639 -28.322
  891    H    ALA 109           H        ALA 109 -17.910  13.097 -28.993
  892    HA   ALA 109           HA       ALA 109 -20.550  12.462 -28.364
  893    HB1  ALA 109           HB1      ALA 109 -19.650  12.601 -30.663
  894    HB2  ALA 109           HB2      ALA 109 -18.694  11.119 -30.381
  895    HB3  ALA 109           HB3      ALA 109 -20.465  11.047 -30.388
  896    H    GLU 110           H        GLU 110 -17.664  10.723 -27.402
  897    HA   GLU 110           HA       GLU 110 -19.338   8.532 -26.374
  898    HB2  GLU 110           HB2      GLU 110 -16.690   8.248 -27.802
  899    HB3  GLU 110           HB3      GLU 110 -17.422   6.958 -26.869
  900    HG2  GLU 110           HG2      GLU 110 -18.558   8.272 -29.373
  901    HG3  GLU 110           HG3      GLU 110 -17.800   6.687 -29.270
  902    H    ILE 111           H        ILE 111 -17.061  10.980 -25.638
  903    HA   ILE 111           HA       ILE 111 -15.908   9.826 -23.267
  904    HB   ILE 111           HB       ILE 111 -16.237  12.566 -24.418
  905   HG12  ILE 111          HG12      ILE 111 -13.922  11.012 -23.293
  906   HG13  ILE 111          HG13      ILE 111 -14.326  11.225 -25.000
  907   HG21  ILE 111          HG21      ILE 111 -15.458  12.165 -21.492
  908   HG22  ILE 111          HG22      ILE 111 -15.415  13.694 -22.398
  909   HG23  ILE 111          HG23      ILE 111 -16.957  12.950 -22.061
  910   HD11  ILE 111          HD11      ILE 111 -13.278  13.333 -23.081
  911   HD12  ILE 111          HD12      ILE 111 -12.503  12.679 -24.520
  912   HD13  ILE 111          HD13      ILE 111 -13.941  13.709 -24.698
  913    H    ASN 112           H        ASN 112 -16.728   9.433 -21.333
  914    HA   ASN 112           HA       ASN 112 -19.535  10.225 -20.729
  915    HB2  ASN 112           HB2      ASN 112 -19.319   7.974 -21.994
  916    HB3  ASN 112           HB3      ASN 112 -18.578   7.350 -20.521
  917   HD21  ASN 112          HD22      ASN 112 -19.970   7.567 -18.467
  918   HD22  ASN 112          HD21      ASN 112 -21.713   7.437 -18.653
  919    H    MET 113           H        MET 113 -17.466  11.436 -19.595
  920    HA   MET 113           HA       MET 113 -16.115  10.230 -17.494
  921    HB2  MET 113           HB2      MET 113 -15.424  12.576 -16.915
  922    HB3  MET 113           HB3      MET 113 -15.187  12.114 -18.590
  923    HG2  MET 113           HG2      MET 113 -17.032  13.411 -19.349
  924    HG3  MET 113           HG3      MET 113 -17.648  13.638 -17.708
  925    HE1  MET 113           HE1      MET 113 -13.796  14.119 -18.821
  926    HE2  MET 113           HE2      MET 113 -14.747  14.603 -20.253
  927    HE3  MET 113           HE3      MET 113 -13.851  15.821 -19.320
  928    H    GLN 114           H        GLN 114 -19.005   9.782 -17.006
  929    HA   GLN 114           HA       GLN 114 -18.897  10.480 -14.147
  930    HB2  GLN 114           HB2      GLN 114 -21.461  10.355 -15.800
  931    HB3  GLN 114           HB3      GLN 114 -21.346  10.670 -14.063
  932    HG2  GLN 114           HG2      GLN 114 -20.069  12.775 -14.560
  933    HG3  GLN 114           HG3      GLN 114 -20.291  12.478 -16.286
  934   HE21  GLN 114          HE22      GLN 114 -22.160  12.953 -13.219
  935   HE22  GLN 114          HE21      GLN 114 -23.547  13.676 -14.002
  936    H    THR 115           H        THR 115 -17.938   8.199 -15.767
  937    HA   THR 115           HA       THR 115 -19.472   5.847 -15.401
  938    HB   THR 115           HB       THR 115 -16.863   5.038 -15.391
  939    HG1  THR 115           HG1      THR 115 -15.516   6.588 -16.062
  940   HG21  THR 115          HG21      THR 115 -16.937   5.024 -17.840
  941   HG22  THR 115          HG22      THR 115 -18.533   4.613 -17.197
  942   HG23  THR 115          HG23      THR 115 -18.229   6.240 -17.839
  943    H    SER 116           H        SER 116 -17.197   7.620 -13.327
  944    HA   SER 116           HA       SER 116 -16.792   5.541 -11.447
  945    HB2  SER 116           HB2      SER 116 -15.930   7.962 -10.363
  946    HB3  SER 116           HB3      SER 116 -14.972   6.830 -11.347
  947    HG   SER 116           HG       SER 116 -14.798   8.475 -12.653
  948    H    SER 117           H        SER 117 -19.435   7.499 -11.795
  949    HA   SER 117           HA       SER 117 -21.281   8.002 -10.657
  950    HB2  SER 117           HB2      SER 117 -20.291   6.290  -8.360
  951    HB3  SER 117           HB3      SER 117 -21.940   6.866  -8.638
  952    HG   SER 117           HG       SER 117 -21.618   4.698  -9.384
  953    H    THR 118           H        THR 118 -18.337   8.348  -8.666
  954    HA   THR 118           HA       THR 118 -19.113  11.162  -8.112
  955    HB   THR 118           HB       THR 118 -17.646  10.872  -6.038
  956    HG1  THR 118           HG1      THR 118 -16.771   8.824  -6.389
  957   HG21  THR 118          HG21      THR 118 -19.515  10.029  -4.688
  958   HG22  THR 118          HG22      THR 118 -20.102  11.123  -5.945
  959   HG23  THR 118          HG23      THR 118 -20.299   9.369  -6.140
  960    HA   PRO 119           HA       PRO 119 -15.461  10.472 -10.907
  961    HB2  PRO 119           HB2      PRO 119 -16.079  12.233 -12.895
  962    HB3  PRO 119           HB3      PRO 119 -16.958  10.689 -12.738
  963    HG2  PRO 119           HG2      PRO 119 -17.796  13.391 -11.631
  964    HG3  PRO 119           HG3      PRO 119 -18.743  12.303 -12.691
  965    HD2  PRO 119           HD2      PRO 119 -19.052  12.230 -10.009
  966    HD3  PRO 119           HD3      PRO 119 -19.050  10.717 -10.964
  967    H    GLU 120           H        GLU 120 -13.926  12.312 -11.904
  968    HA   GLU 120           HA       GLU 120 -13.777  14.548  -9.925
  969    HB2  GLU 120           HB2      GLU 120 -11.605  13.415 -11.714
  970    HB3  GLU 120           HB3      GLU 120 -11.481  14.878 -10.728
  971    HG2  GLU 120           HG2      GLU 120 -12.383  13.209  -8.808
  972    HG3  GLU 120           HG3      GLU 120 -11.581  12.017  -9.834
  973    H    PHE 121           H        PHE 121 -15.010  13.982 -13.076
  974    HA   PHE 121           HA       PHE 121 -14.456  16.823 -13.755
  975    HB2  PHE 121           HB2      PHE 121 -14.196  14.433 -15.567
  976    HB3  PHE 121           HB3      PHE 121 -14.127  16.123 -16.078
  977    HD1  PHE 121           HD2      PHE 121 -12.403  17.676 -14.847
  978    HD2  PHE 121           HD1      PHE 121 -12.143  13.374 -14.899
  979    HE1  PHE 121           HE2      PHE 121 -10.004  17.819 -14.264
  980    HE2  PHE 121           HE1      PHE 121  -9.739  13.521 -14.286
  981    HZ   PHE 121           HZ       PHE 121  -8.667  15.736 -13.969
  982    H    ASP 122           H        ASP 122 -15.839  17.888 -15.059
  983    HA   ASP 122           HA       ASP 122 -18.682  16.954 -15.010
  984    HB2  ASP 122           HB2      ASP 122 -18.312  18.434 -13.212
  985    HB3  ASP 122           HB3      ASP 122 -17.312  19.522 -14.169
  986    H    GLY 123           H        GLY 123 -16.150  18.628 -16.898
  987    HA2  GLY 123           HA2      GLY 123 -17.620  18.312 -19.327
  988    HA3  GLY 123           HA3      GLY 123 -17.591  20.024 -18.831
  989    H    TRP 124           H        TRP 124 -16.330  19.022 -21.166
  990    HA   TRP 124           HA       TRP 124 -13.435  19.086 -20.482
  991    HB2  TRP 124           HB2      TRP 124 -13.115  18.085 -22.675
  992    HB3  TRP 124           HB3      TRP 124 -14.117  17.076 -21.639
  993    HD1  TRP 124           HD1      TRP 124 -16.570  16.585 -22.437
  994    HE1  TRP 124           HE1      TRP 124 -17.916  17.058 -24.559
  995    HE3  TRP 124           HE3      TRP 124 -13.329  19.788 -24.787
  996    HZ2  TRP 124           HZ2      TRP 124 -17.761  18.841 -26.835
  997    HZ3  TRP 124           HZ3      TRP 124 -13.966  20.875 -26.924
  998    HH2  TRP 124           HH2      TRP 124 -16.186  20.417 -27.951
  999    H    ARG 125           H        ARG 125 -12.067  20.264 -21.824
 1000    HA   ARG 125           HA       ARG 125 -13.093  22.125 -23.864
 1001    HB2  ARG 125           HB2      ARG 125 -13.191  23.475 -21.780
 1002    HB3  ARG 125           HB3      ARG 125 -11.514  23.059 -21.420
 1003    HG2  ARG 125           HG2      ARG 125 -10.841  24.237 -23.565
 1004    HG3  ARG 125           HG3      ARG 125 -12.531  24.737 -23.762
 1005    HD2  ARG 125           HD2      ARG 125 -12.437  25.943 -21.610
 1006    HD3  ARG 125           HD3      ARG 125 -10.786  25.340 -21.338
 1007    HE   ARG 125           HE       ARG 125 -11.187  26.845 -23.824
 1008   HH11  ARG 125          HH11      ARG 125 -10.359  27.159 -20.383
 1009   HH12  ARG 125          HH12      ARG 125  -9.390  28.574 -20.597
 1010   HH21  ARG 125          HH21      ARG 125  -9.967  28.773 -24.104
 1011   HH22  ARG 125          HH22      ARG 125  -9.227  29.550 -22.755
 1012    H    TRP 126           H        TRP 126 -11.631  21.634 -25.641
 1013    HA   TRP 126           HA       TRP 126  -8.987  20.565 -24.907
 1014    HB2  TRP 126           HB2      TRP 126 -10.003  21.152 -27.683
 1015    HB3  TRP 126           HB3      TRP 126  -8.692  20.085 -27.197
 1016    HD1  TRP 126           HD1      TRP 126 -11.736  19.643 -28.728
 1017    HE1  TRP 126           HE1      TRP 126 -13.172  17.676 -28.003
 1018    HE3  TRP 126           HE3      TRP 126  -9.436  18.555 -24.276
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.402  15.903 -25.715
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.392  16.830 -22.788
 1021    HH2  TRP 126           HH2      TRP 126 -12.386  15.537 -23.469
 1022    H    VAL 127           H        VAL 127  -7.238  21.818 -24.638
 1023    HA   VAL 127           HA       VAL 127  -7.528  24.736 -25.220
 1024    HB   VAL 127           HB       VAL 127  -6.110  25.064 -23.239
 1025   HG11  VAL 127          HG11      VAL 127  -7.791  24.602 -21.555
 1026   HG12  VAL 127          HG12      VAL 127  -8.566  25.143 -23.048
 1027   HG13  VAL 127          HG13      VAL 127  -8.584  23.417 -22.609
 1028   HG21  VAL 127          HG21      VAL 127  -6.364  22.053 -22.828
 1029   HG22  VAL 127          HG22      VAL 127  -4.882  22.966 -23.156
 1030   HG23  VAL 127          HG23      VAL 127  -5.760  23.202 -21.630
 1031    H    SER 128           H        SER 128  -5.476  25.957 -25.526
 1032    HA   SER 128           HA       SER 128  -3.831  25.018 -27.534
 1033    HB2  SER 128           HB2      SER 128  -2.895  26.944 -25.390
 1034    HB3  SER 128           HB3      SER 128  -2.415  26.877 -27.091
 1035    HG   SER 128           HG       SER 128  -3.966  28.548 -26.721
 1036    H    TYR 129           H        TYR 129  -1.801  24.066 -27.641
 1037    HA   TYR 129           HA       TYR 129  -1.484  21.881 -26.037
 1038    HB2  TYR 129           HB2      TYR 129  -0.553  22.400 -28.346
 1039    HB3  TYR 129           HB3      TYR 129   0.807  23.197 -27.540
 1040    HD1  TYR 129           HD2      TYR 129   2.412  21.781 -26.160
 1041    HD2  TYR 129           HD1      TYR 129  -0.865  20.062 -28.386
 1042    HE1  TYR 129           HE2      TYR 129   3.320  19.510 -25.751
 1043    HE2  TYR 129           HE1      TYR 129   0.003  17.803 -27.905
 1044    HH   TYR 129           HH       TYR 129   1.571  16.539 -26.765
 1045    H    TRP 130           H        TRP 130   0.078  25.045 -25.561
 1046    HA   TRP 130           HA       TRP 130   1.537  24.033 -23.204
 1047    HB2  TRP 130           HB2      TRP 130   1.749  26.727 -24.580
 1048    HB3  TRP 130           HB3      TRP 130   2.862  26.040 -23.401
 1049    HD1  TRP 130           HD1      TRP 130   2.099  26.098 -27.069
 1050    HE1  TRP 130           HE1      TRP 130   3.707  24.653 -28.382
 1051    HE3  TRP 130           HE3      TRP 130   4.390  23.755 -23.138
 1052    HZ2  TRP 130           HZ2      TRP 130   5.830  22.703 -27.790
 1053    HZ3  TRP 130           HZ3      TRP 130   6.238  22.148 -23.537
 1054    HH2  TRP 130           HH2      TRP 130   6.948  21.612 -25.845
 1055    H    TYR 131           H        TYR 131  -1.540  24.872 -23.382
 1056    HA   TYR 131           HA       TYR 131  -1.636  27.129 -21.552
 1057    HB2  TYR 131           HB2      TYR 131  -3.367  26.797 -23.185
 1058    HB3  TYR 131           HB3      TYR 131  -3.786  25.236 -22.544
 1059    HD1  TYR 131           HD1      TYR 131  -4.084  28.868 -22.077
 1060    HD2  TYR 131           HD2      TYR 131  -5.037  24.990 -20.431
 1061    HE1  TYR 131           HE1      TYR 131  -5.861  29.890 -20.691
 1062    HE2  TYR 131           HE2      TYR 131  -6.836  25.994 -19.087
 1063    HH   TYR 131           HH       TYR 131  -7.937  27.977 -18.447
 1064    HA   PRO 132           HA       PRO 132  -2.952  23.846 -18.360
 1065    HB2  PRO 132           HB2      PRO 132  -1.381  21.406 -19.152
 1066    HB3  PRO 132           HB3      PRO 132  -2.966  21.520 -18.351
 1067    HG2  PRO 132           HG2      PRO 132  -2.828  20.957 -20.982
 1068    HG3  PRO 132           HG3      PRO 132  -4.052  22.121 -20.383
 1069    HD2  PRO 132           HD2      PRO 132  -1.373  22.725 -21.682
 1070    HD3  PRO 132           HD3      PRO 132  -2.960  23.445 -21.998
 1071    H    VAL 133           H        VAL 133   0.460  23.725 -19.590
 1072    HA   VAL 133           HA       VAL 133   1.630  23.257 -17.041
 1073    HB   VAL 133           HB       VAL 133   3.620  24.547 -18.139
 1074   HG11  VAL 133          HG11      VAL 133   2.550  21.849 -18.939
 1075   HG12  VAL 133          HG12      VAL 133   4.107  22.466 -19.553
 1076   HG13  VAL 133          HG13      VAL 133   3.851  22.297 -17.813
 1077   HG21  VAL 133          HG21      VAL 133   3.695  24.577 -20.560
 1078   HG22  VAL 133          HG22      VAL 133   2.004  24.071 -20.668
 1079   HG23  VAL 133          HG23      VAL 133   2.432  25.651 -19.955
 1080    H    ARG 134           H        ARG 134   0.255  26.245 -18.445
 1081    HA   ARG 134           HA       ARG 134   1.584  27.758 -16.269
 1082    HB2  ARG 134           HB2      ARG 134  -0.400  28.763 -18.350
 1083    HB3  ARG 134           HB3      ARG 134   0.594  29.736 -17.273
 1084    HG2  ARG 134           HG2      ARG 134   1.451  28.121 -19.684
 1085    HG3  ARG 134           HG3      ARG 134   1.597  29.846 -19.415
 1086    HD2  ARG 134           HD2      ARG 134   3.244  27.612 -18.170
 1087    HD3  ARG 134           HD3      ARG 134   3.805  28.858 -19.262
 1088    HE   ARG 134           HE       ARG 134   3.576  28.990 -16.399
 1089   HH11  ARG 134          HH11      ARG 134   3.549  31.067 -19.298
 1090   HH12  ARG 134          HH12      ARG 134   3.933  32.508 -18.429
 1091   HH21  ARG 134          HH21      ARG 134   4.042  30.932 -15.250
 1092   HH22  ARG 134          HH22      ARG 134   4.260  32.416 -16.097
 1093    H    GLN 135           H        GLN 135  -1.462  26.131 -16.856
 1094    HA   GLN 135           HA       GLN 135  -2.819  27.613 -14.720
 1095    HB2  GLN 135           HB2      GLN 135  -3.613  25.047 -16.153
 1096    HB3  GLN 135           HB3      GLN 135  -4.623  25.993 -15.059
 1097    HG2  GLN 135           HG2      GLN 135  -3.640  26.806 -17.817
 1098    HG3  GLN 135           HG3      GLN 135  -5.284  26.470 -17.289
 1099   HE21  GLN 135          HE22      GLN 135  -6.234  28.022 -15.581
 1100   HE22  GLN 135          HE21      GLN 135  -5.726  29.690 -15.653
 1101    H    VAL 136           H        VAL 136  -0.954  24.595 -15.017
 1102    HA   VAL 136           HA       VAL 136  -1.900  23.464 -12.602
 1103    HB   VAL 136           HB       VAL 136  -0.694  22.437 -14.676
 1104   HG11  VAL 136          HG11      VAL 136   1.711  22.851 -12.894
 1105   HG12  VAL 136          HG12      VAL 136   1.659  21.903 -14.384
 1106   HG13  VAL 136          HG13      VAL 136   1.427  23.666 -14.439
 1107   HG21  VAL 136          HG21      VAL 136  -0.061  20.446 -13.389
 1108   HG22  VAL 136          HG22      VAL 136  -0.214  21.372 -11.882
 1109   HG23  VAL 136          HG23      VAL 136  -1.633  21.102 -12.918
 1110    H    VAL 137           H        VAL 137  -0.616  23.048 -10.609
 1111    HA   VAL 137           HA       VAL 137   0.444  25.412  -9.422
 1112    HB   VAL 137           HB       VAL 137   1.173  23.746  -7.619
 1113   HG11  VAL 137          HG11      VAL 137  -0.913  25.093  -7.501
 1114   HG12  VAL 137          HG12      VAL 137  -1.779  23.852  -8.432
 1115   HG13  VAL 137          HG13      VAL 137  -1.156  23.484  -6.806
 1116   HG21  VAL 137          HG21      VAL 137   0.157  21.538  -7.605
 1117   HG22  VAL 137          HG22      VAL 137  -0.534  21.768  -9.212
 1118   HG23  VAL 137          HG23      VAL 137   1.238  21.689  -8.994
 1119    H    SER 138           H        SER 138   2.535  25.967  -8.757
 1120    HA   SER 138           HA       SER 138   4.375  25.898 -10.735
 1121    HB2  SER 138           HB2      SER 138   5.014  26.317  -7.792
 1122    HB3  SER 138           HB3      SER 138   5.794  27.080  -9.189
 1123    HG   SER 138           HG       SER 138   4.225  28.467  -8.197
 1124    H    PHE 139           H        PHE 139   4.319  23.585  -7.949
 1125    HA   PHE 139           HA       PHE 139   6.949  22.582  -8.602
 1126    HB2  PHE 139           HB2      PHE 139   6.560  20.890  -6.953
 1127    HB3  PHE 139           HB3      PHE 139   6.063  22.454  -6.346
 1128    HD1  PHE 139           HD1      PHE 139   4.912  19.119  -7.474
 1129    HD2  PHE 139           HD2      PHE 139   3.714  22.903  -5.777
 1130    HE1  PHE 139           HE1      PHE 139   2.710  18.162  -6.875
 1131    HE2  PHE 139           HE2      PHE 139   1.497  21.945  -5.219
 1132    HZ   PHE 139           HZ       PHE 139   0.985  19.582  -5.783
 1133    H    LYS 140           H        LYS 140   3.713  21.840  -9.801
 1134    HA   LYS 140           HA       LYS 140   4.655  19.419 -11.227
 1135    HB2  LYS 140           HB2      LYS 140   2.001  20.907 -11.309
 1136    HB3  LYS 140           HB3      LYS 140   2.383  19.471 -12.273
 1137    HG2  LYS 140           HG2      LYS 140   2.837  18.209 -10.149
 1138    HG3  LYS 140           HG3      LYS 140   2.288  19.626  -9.238
 1139    HD2  LYS 140           HD2      LYS 140   0.069  19.473 -10.455
 1140    HD3  LYS 140           HD3      LYS 140   0.661  17.990 -11.236
 1141    HE2  LYS 140           HE2      LYS 140   1.030  17.019  -8.939
 1142    HE3  LYS 140           HE3      LYS 140   0.264  18.454  -8.234
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.056  16.564 -10.143
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.311  16.592  -8.518
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.780  17.866  -9.434
 1146    H    ARG 141           H        ARG 141   3.852  22.837 -12.009
 1147    HA   ARG 141           HA       ARG 141   3.848  22.898 -14.714
 1148    HB2  ARG 141           HB2      ARG 141   3.671  24.847 -13.240
 1149    HB3  ARG 141           HB3      ARG 141   5.396  24.823 -12.915
 1150    HG2  ARG 141           HG2      ARG 141   4.559  25.003 -15.799
 1151    HG3  ARG 141           HG3      ARG 141   4.184  26.389 -14.782
 1152    HD2  ARG 141           HD2      ARG 141   6.969  25.244 -15.171
 1153    HD3  ARG 141           HD3      ARG 141   6.288  26.663 -15.996
 1154    HE   ARG 141           HE       ARG 141   5.950  27.180 -13.285
 1155   HH11  ARG 141          HH11      ARG 141   8.714  26.744 -15.490
 1156   HH12  ARG 141          HH12      ARG 141   9.787  27.713 -14.545
 1157   HH21  ARG 141          HH21      ARG 141   7.390  28.466 -12.035
 1158   HH22  ARG 141          HH22      ARG 141   9.015  28.716 -12.556
 1159    H    ASP 142           H        ASP 142   6.995  22.832 -12.933
 1160    HA   ASP 142           HA       ASP 142   8.466  22.887 -15.398
 1161    HB2  ASP 142           HB2      ASP 142   9.392  23.797 -13.360
 1162    HB3  ASP 142           HB3      ASP 142   9.431  22.181 -12.625
 1163    H    VAL 143           H        VAL 143   7.207  20.207 -13.466
 1164    HA   VAL 143           HA       VAL 143   8.716  18.140 -14.867
 1165    HB   VAL 143           HB       VAL 143   6.116  17.995 -13.278
 1166   HG11  VAL 143          HG11      VAL 143   6.485  15.668 -13.015
 1167   HG12  VAL 143          HG12      VAL 143   6.716  15.963 -14.728
 1168   HG13  VAL 143          HG13      VAL 143   8.137  15.763 -13.670
 1169   HG21  VAL 143          HG21      VAL 143   7.450  17.370 -11.333
 1170   HG22  VAL 143          HG22      VAL 143   8.960  17.594 -12.251
 1171   HG23  VAL 143          HG23      VAL 143   7.913  18.970 -11.862
 1172    H    TYR 144           H        TYR 144   5.486  19.696 -15.118
 1173    HA   TYR 144           HA       TYR 144   4.509  17.882 -17.031
 1174    HB2  TYR 144           HB2      TYR 144   3.252  19.303 -15.380
 1175    HB3  TYR 144           HB3      TYR 144   3.474  20.669 -16.430
 1176    HD1  TYR 144           HD1      TYR 144   2.786  17.417 -18.142
 1177    HD2  TYR 144           HD2      TYR 144   0.966  20.838 -16.213
 1178    HE1  TYR 144           HE1      TYR 144   0.593  16.685 -18.908
 1179    HE2  TYR 144           HE2      TYR 144  -1.237  20.110 -16.994
 1180    HH   TYR 144           HH       TYR 144  -2.451  18.480 -18.220
 1181    H    ARG 145           H        ARG 145   6.185  21.027 -17.463
 1182    HA   ARG 145           HA       ARG 145   5.869  21.096 -20.306
 1183    HB2  ARG 145           HB2      ARG 145   7.827  22.567 -20.376
 1184    HB3  ARG 145           HB3      ARG 145   6.630  23.048 -19.172
 1185    HG2  ARG 145           HG2      ARG 145   7.989  22.126 -17.385
 1186    HG3  ARG 145           HG3      ARG 145   9.226  21.563 -18.510
 1187    HD2  ARG 145           HD2      ARG 145   8.416  24.492 -18.320
 1188    HD3  ARG 145           HD3      ARG 145   9.602  23.796 -17.235
 1189    HE   ARG 145           HE       ARG 145   9.857  24.137 -20.172
 1190   HH11  ARG 145          HH11      ARG 145  11.501  23.355 -17.045
 1191   HH12  ARG 145          HH12      ARG 145  13.070  23.455 -17.757
 1192   HH21  ARG 145          HH21      ARG 145  11.966  24.232 -21.032
 1193   HH22  ARG 145          HH22      ARG 145  13.344  23.943 -20.039
 1194    H    ARG 146           H        ARG 146   8.002  19.011 -18.368
 1195    HA   ARG 146           HA       ARG 146   9.701  18.279 -20.604
 1196    HB2  ARG 146           HB2      ARG 146   9.027  16.394 -18.306
 1197    HB3  ARG 146           HB3      ARG 146  10.471  16.442 -19.296
 1198    HG2  ARG 146           HG2      ARG 146   9.674  18.356 -17.088
 1199    HG3  ARG 146           HG3      ARG 146  10.993  17.206 -17.079
 1200    HD2  ARG 146           HD2      ARG 146  12.205  18.496 -18.748
 1201    HD3  ARG 146           HD3      ARG 146  10.862  19.639 -18.912
 1202    HE   ARG 146           HE       ARG 146  11.136  20.119 -16.450
 1203   HH11  ARG 146          HH21      ARG 146  13.949  19.201 -18.453
 1204   HH12  ARG 146          HH22      ARG 146  15.104  19.973 -17.430
 1205   HH21  ARG 146          HH11      ARG 146  12.681  21.140 -15.089
 1206   HH22  ARG 146          HH12      ARG 146  14.371  21.089 -15.482
 1207    H    VAL 147           H        VAL 147   6.695  16.878 -19.202
 1208    HA   VAL 147           HA       VAL 147   6.374  14.767 -21.083
 1209    HB   VAL 147           HB       VAL 147   4.174  16.401 -19.752
 1210   HG11  VAL 147          HG11      VAL 147   3.354  14.834 -21.460
 1211   HG12  VAL 147          HG12      VAL 147   4.244  13.505 -20.686
 1212   HG13  VAL 147          HG13      VAL 147   2.894  14.295 -19.837
 1213   HG21  VAL 147          HG21      VAL 147   4.246  14.811 -17.902
 1214   HG22  VAL 147          HG22      VAL 147   5.648  13.987 -18.618
 1215   HG23  VAL 147          HG23      VAL 147   5.781  15.652 -18.004
 1216    H    MET 148           H        MET 148   5.217  18.195 -21.145
 1217    HA   MET 148           HA       MET 148   3.888  17.902 -23.614
 1218    HB2  MET 148           HB2      MET 148   5.044  20.357 -22.264
 1219    HB3  MET 148           HB3      MET 148   4.114  20.414 -23.768
 1220    HG2  MET 148           HG2      MET 148   2.236  19.227 -22.673
 1221    HG3  MET 148           HG3      MET 148   3.115  19.271 -21.137
 1222    HE1  MET 148           HE1      MET 148   0.993  20.251 -20.093
 1223    HE2  MET 148           HE2      MET 148   0.248  21.791 -20.563
 1224    HE3  MET 148           HE3      MET 148   0.114  20.384 -21.642
 1225    H    LYS 149           H        LYS 149   7.360  19.023 -23.050
 1226    HA   LYS 149           HA       LYS 149   7.622  19.449 -25.873
 1227    HB2  LYS 149           HB2      LYS 149   9.872  19.928 -25.556
 1228    HB3  LYS 149           HB3      LYS 149   9.053  20.499 -24.122
 1229    HG2  LYS 149           HG2      LYS 149  11.003  19.588 -23.305
 1230    HG3  LYS 149           HG3      LYS 149   9.832  18.323 -22.976
 1231    HD2  LYS 149           HD2      LYS 149  10.735  16.940 -24.797
 1232    HD3  LYS 149           HD3      LYS 149  11.675  18.309 -25.413
 1233    HE2  LYS 149           HE2      LYS 149  13.044  18.306 -23.359
 1234    HE3  LYS 149           HE3      LYS 149  12.045  17.016 -22.669
 1235    HZ1  LYS 149           HZ1      LYS 149  13.719  16.733 -25.108
 1236    HZ2  LYS 149           HZ2      LYS 149  14.078  16.134 -23.632
 1237    HZ3  LYS 149           HZ3      LYS 149  12.780  15.545 -24.452
 1238    H    GLU 150           H        GLU 150   7.934  16.543 -23.921
 1239    HA   GLU 150           HA       GLU 150   9.359  14.996 -25.868
 1240    HB2  GLU 150           HB2      GLU 150   7.585  14.358 -23.479
 1241    HB3  GLU 150           HB3      GLU 150   8.202  13.072 -24.510
 1242    HG2  GLU 150           HG2      GLU 150   9.997  15.150 -23.176
 1243    HG3  GLU 150           HG3      GLU 150   9.586  13.596 -22.447
 1244    H    PHE 151           H        PHE 151   5.900  15.689 -25.365
 1245    HA   PHE 151           HA       PHE 151   5.145  13.902 -27.608
 1246    HB2  PHE 151           HB2      PHE 151   3.562  15.357 -25.476
 1247    HB3  PHE 151           HB3      PHE 151   2.849  14.336 -26.711
 1248    HD1  PHE 151           HD2      PHE 151   5.409  12.228 -26.311
 1249    HD2  PHE 151           HD1      PHE 151   2.391  14.027 -23.803
 1250    HE1  PHE 151           HE2      PHE 151   5.598  10.355 -24.747
 1251    HE2  PHE 151           HE1      PHE 151   2.551  12.086 -22.259
 1252    HZ   PHE 151           HZ       PHE 151   4.166  10.275 -22.707
 1253    H    ALA 152           H        ALA 152   5.572  17.300 -27.037
 1254    HA   ALA 152           HA       ALA 152   3.686  18.508 -28.544
 1255    HB1  ALA 152           HB1      ALA 152   5.438  20.266 -29.050
 1256    HB2  ALA 152           HB2      ALA 152   5.303  19.830 -27.345
 1257    HB3  ALA 152           HB3      ALA 152   6.652  19.198 -28.327
 1258    H    SER 153           H        SER 153   6.896  17.555 -29.983
 1259    HA   SER 153           HA       SER 153   6.017  18.142 -32.578
 1260    HB2  SER 153           HB2      SER 153   8.152  16.088 -31.968
 1261    HB3  SER 153           HB3      SER 153   8.023  17.196 -33.353
 1262    HG   SER 153           HG       SER 153   9.554  17.940 -31.789
 1263    H    VAL 154           H        VAL 154   5.139  15.352 -30.669
 1264    HA   VAL 154           HA       VAL 154   4.734  13.571 -32.976
 1265    HB   VAL 154           HB       VAL 154   3.717  13.279 -30.123
 1266   HG11  VAL 154          HG11      VAL 154   3.655  10.864 -30.680
 1267   HG12  VAL 154          HG12      VAL 154   2.581  11.798 -31.730
 1268   HG13  VAL 154          HG13      VAL 154   4.153  11.230 -32.343
 1269   HG21  VAL 154          HG21      VAL 154   6.331  12.261 -31.324
 1270   HG22  VAL 154          HG22      VAL 154   6.163  13.449 -30.007
 1271   HG23  VAL 154          HG23      VAL 154   5.665  11.783 -29.747
 1272    H    VAL 155           H        VAL 155   2.813  15.710 -30.833
 1273    HA   VAL 155           HA       VAL 155   0.337  15.182 -32.284
 1274    HB   VAL 155           HB       VAL 155   1.120  17.338 -30.277
 1275   HG11  VAL 155          HG11      VAL 155  -0.860  18.037 -31.526
 1276   HG12  VAL 155          HG12      VAL 155  -1.636  16.449 -31.291
 1277   HG13  VAL 155          HG13      VAL 155  -1.362  17.540 -29.910
 1278   HG21  VAL 155          HG21      VAL 155  -0.183  14.595 -29.972
 1279   HG22  VAL 155          HG22      VAL 155   1.322  15.182 -29.222
 1280   HG23  VAL 155          HG23      VAL 155  -0.224  15.840 -28.714
 1281    H    MET 156           H        MET 156   2.879  17.720 -32.356
 1282    HA   MET 156           HA       MET 156   1.368  19.390 -34.131
 1283    HB2  MET 156           HB2      MET 156   4.297  19.357 -33.347
 1284    HB3  MET 156           HB3      MET 156   3.560  20.620 -34.349
 1285    HG2  MET 156           HG2      MET 156   2.045  21.280 -32.605
 1286    HG3  MET 156           HG3      MET 156   2.418  19.861 -31.639
 1287    HE1  MET 156           HE1      MET 156   3.723  22.350 -29.145
 1288    HE2  MET 156           HE2      MET 156   2.231  22.404 -30.109
 1289    HE3  MET 156           HE3      MET 156   2.812  20.859 -29.440
 1290    H    SER 157           H        SER 157   3.365  16.557 -34.777
 1291    HA   SER 157           HA       SER 157   3.857  17.109 -37.529
 1292    HB2  SER 157           HB2      SER 157   3.579  14.499 -35.980
 1293    HB3  SER 157           HB3      SER 157   4.041  14.583 -37.689
 1294    HG   SER 157           HG       SER 157   5.430  15.653 -35.447
 1295    H    LEU 158           H        LEU 158   0.876  16.258 -35.881
 1296    HA   LEU 158           HA       LEU 158  -0.548  15.412 -38.301
 1297    HB2  LEU 158           HB2      LEU 158  -1.372  16.277 -35.521
 1298    HB3  LEU 158           HB3      LEU 158  -2.551  15.997 -36.794
 1299    HG   LEU 158           HG       LEU 158  -1.945  13.628 -36.886
 1300   HD11  LEU 158          HD11      LEU 158  -0.106  14.267 -34.529
 1301   HD12  LEU 158          HD12      LEU 158  -0.586  12.632 -35.030
 1302   HD13  LEU 158          HD13      LEU 158   0.390  13.626 -36.115
 1303   HD21  LEU 158          HD21      LEU 158  -2.975  13.067 -34.693
 1304   HD22  LEU 158          HD22      LEU 158  -2.619  14.705 -34.089
 1305   HD23  LEU 158          HD23      LEU 158  -3.769  14.468 -35.417
 1306    H    GLN 159           H        GLN 159   0.242  18.478 -36.715
 1307    HA   GLN 159           HA       GLN 159  -1.952  19.914 -38.091
 1308    HB2  GLN 159           HB2      GLN 159  -0.084  21.106 -36.027
 1309    HB3  GLN 159           HB3      GLN 159  -1.730  21.598 -36.419
 1310    HG2  GLN 159           HG2      GLN 159  -0.866  19.131 -34.885
 1311    HG3  GLN 159           HG3      GLN 159  -1.681  20.545 -34.289
 1312   HE21  GLN 159          HE22      GLN 159  -2.464  17.554 -34.354
 1313   HE22  GLN 159          HE21      GLN 159  -4.073  17.574 -35.071
 1314    H    GLU 160           H        GLU 160   1.593  19.877 -37.834
 1315    HA   GLU 160           HA       GLU 160   1.943  21.898 -39.944
 1316    HB2  GLU 160           HB2      GLU 160   3.908  20.365 -38.189
 1317    HB3  GLU 160           HB3      GLU 160   4.338  21.634 -39.343
 1318    HG2  GLU 160           HG2      GLU 160   2.800  23.199 -38.044
 1319    HG3  GLU 160           HG3      GLU 160   2.712  21.958 -36.795
 1320    H    ASN 161           H        ASN 161   0.819  19.100 -40.325
 1321    HA   ASN 161           HA       ASN 161   2.688  17.301 -41.328
 1322    HB2  ASN 161           HB2      ASN 161   0.227  16.898 -40.672
 1323    HB3  ASN 161           HB3      ASN 161  -0.200  17.453 -42.293
 1324   HD21  ASN 161          HD22      ASN 161   1.808  15.124 -40.471
 1325   HD22  ASN 161          HD21      ASN 161   1.812  13.857 -41.696
 1326    H    THR 162           H        THR 162   1.017  19.942 -43.065
 1327    HA   THR 162           HA       THR 162   1.779  19.080 -45.652
 1328    HB   THR 162           HB       THR 162   1.258  21.733 -45.965
 1329    HG1  THR 162           HG1      THR 162  -0.346  22.293 -44.483
 1330   HG21  THR 162          HG21      THR 162  -1.063  21.013 -46.454
 1331   HG22  THR 162          HG22      THR 162   0.113  19.856 -47.094
 1332   HG23  THR 162          HG23      THR 162  -0.778  19.477 -45.602
 1333    HA   PRO 163           HA       PRO 163   5.533  21.917 -45.352
 1334    HB2  PRO 163           HB2      PRO 163   6.249  23.148 -42.986
 1335    HB3  PRO 163           HB3      PRO 163   5.166  23.868 -44.220
 1336    HG2  PRO 163           HG2      PRO 163   4.391  22.369 -41.704
 1337    HG3  PRO 163           HG3      PRO 163   3.743  23.925 -42.310
 1338    HD2  PRO 163           HD2      PRO 163   2.419  21.591 -42.790
 1339    HD3  PRO 163           HD3      PRO 163   2.521  22.845 -44.042
 1340    H    LYS 164           H        LYS 164   4.818  19.680 -42.692
 1341    HA   LYS 164           HA       LYS 164   7.420  19.059 -41.855
 1342    HB2  LYS 164           HB2      LYS 164   5.346  18.157 -40.830
 1343    HB3  LYS 164           HB3      LYS 164   5.097  17.132 -42.258
 1344    HG2  LYS 164           HG2      LYS 164   7.238  15.961 -41.764
 1345    HG3  LYS 164           HG3      LYS 164   7.471  17.008 -40.345
 1346    HD2  LYS 164           HD2      LYS 164   5.330  16.095 -39.383
 1347    HD3  LYS 164           HD3      LYS 164   5.149  15.083 -40.822
 1348    HE2  LYS 164           HE2      LYS 164   6.052  13.629 -39.200
 1349    HE3  LYS 164           HE3      LYS 164   7.391  14.022 -40.275
 1350    HZ1  LYS 164           HZ1      LYS 164   8.053  14.122 -37.958
 1351    HZ2  LYS 164           HZ2      LYS 164   8.158  15.628 -38.578
 1352    HZ3  LYS 164           HZ3      LYS 164   6.894  15.218 -37.591
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1  -0.291   1.106  -1.784
    2    H2   MET   1           H2       MET   1  -1.010   1.662  -3.144
    3    H3   MET   1           H3       MET   1  -1.121   0.072  -2.745
    4    HA   MET   1           HA       MET   1   1.254  -0.228  -3.045
    5    HB2  MET   1           HB2      MET   1  -0.334  -0.647  -4.949
    6    HB3  MET   1           HB3      MET   1  -0.052   0.993  -5.529
    7    HG2  MET   1           HG2      MET   1   2.367   0.442  -5.828
    8    HG3  MET   1           HG3      MET   1   2.048  -1.201  -5.257
    9    HE1  MET   1           HE1      MET   1   3.540  -0.550  -8.000
   10    HE2  MET   1           HE2      MET   1   3.204  -2.199  -7.427
   11    HE3  MET   1           HE3      MET   1   2.767  -1.723  -9.085
   12    H    ILE   2           H        ILE   2   3.252   0.766  -2.808
   13    HA   ILE   2           HA       ILE   2   3.641   3.548  -3.717
   14    HB   ILE   2           HB       ILE   2   4.467   2.410  -1.017
   15   HG12  ILE   2          HG12      ILE   2   2.169   3.235  -0.939
   16   HG13  ILE   2          HG13      ILE   2   3.235   4.255  -0.003
   17   HG21  ILE   2          HG21      ILE   2   5.520   4.625  -0.583
   18   HG22  ILE   2          HG22      ILE   2   6.333   3.719  -1.853
   19   HG23  ILE   2          HG23      ILE   2   5.262   5.068  -2.285
   20   HD11  ILE   2          HD11      ILE   2   2.159   4.970  -2.754
   21   HD12  ILE   2          HD12      ILE   2   1.588   5.583  -1.202
   22   HD13  ILE   2          HD13      ILE   2   3.226   5.981  -1.760
   23    H    ASP   3           H        ASP   3   5.814   3.817  -4.504
   24    HA   ASP   3           HA       ASP   3   6.633   1.475  -5.925
   25    HB2  ASP   3           HB2      ASP   3   6.679   3.757  -6.816
   26    HB3  ASP   3           HB3      ASP   3   7.956   4.193  -5.678
   27    H    ASP   4           H        ASP   4   8.182   3.350  -3.306
   28    HA   ASP   4           HA       ASP   4   9.287   0.931  -2.176
   29    HB2  ASP   4           HB2      ASP   4  11.108   1.393  -3.729
   30    HB3  ASP   4           HB3      ASP   4  11.181   3.071  -3.199
   31    H    ASP   5           H        ASP   5  10.574   4.207  -1.653
   32    HA   ASP   5           HA       ASP   5   9.974   3.911   1.128
   33    HB2  ASP   5           HB2      ASP   5  12.078   4.862   0.407
   34    HB3  ASP   5           HB3      ASP   5  11.242   6.185  -0.417
   35    H    GLY   6           H        GLY   6   8.864   6.240  -1.329
   36    HA2  GLY   6           HA2      GLY   6   6.336   6.726   0.078
   37    HA3  GLY   6           HA3      GLY   6   7.534   8.005   0.271
   38    H    TYR   7           H        TYR   7   7.580   6.368  -2.854
   39    HA   TYR   7           HA       TYR   7   6.249   8.750  -4.048
   40    HB2  TYR   7           HB2      TYR   7   8.431   6.915  -5.006
   41    HB3  TYR   7           HB3      TYR   7   7.345   7.641  -6.177
   42    HD1  TYR   7           HD1      TYR   7   9.684   8.491  -3.373
   43    HD2  TYR   7           HD2      TYR   7   7.459   9.944  -6.777
   44    HE1  TYR   7           HE1      TYR   7  10.829  10.681  -3.189
   45    HE2  TYR   7           HE2      TYR   7   8.523  12.147  -6.540
   46    HH   TYR   7           HH       TYR   7  10.206  13.408  -5.444
   47    H    ARG   8           H        ARG   8   4.255   8.474  -4.919
   48    HA   ARG   8           HA       ARG   8   3.179   5.700  -4.821
   49    HB2  ARG   8           HB2      ARG   8   1.887   7.579  -3.868
   50    HB3  ARG   8           HB3      ARG   8   1.778   8.309  -5.471
   51    HG2  ARG   8           HG2      ARG   8   0.571   6.229  -6.277
   52    HG3  ARG   8           HG3      ARG   8   0.656   5.601  -4.616
   53    HD2  ARG   8           HD2      ARG   8  -0.655   7.611  -3.861
   54    HD3  ARG   8           HD3      ARG   8  -0.788   8.103  -5.570
   55    HE   ARG   8           HE       ARG   8  -1.661   5.382  -5.186
   56   HH11  ARG   8          HH21      ARG   8  -2.785   8.725  -4.654
   57   HH12  ARG   8          HH22      ARG   8  -4.458   8.309  -4.703
   58   HH21  ARG   8          HH12      ARG   8  -3.905   4.841  -5.218
   59   HH22  ARG   8          HH11      ARG   8  -5.101   6.066  -5.054
   60    HA   PRO   9           HA       PRO   9   4.083   5.572  -9.271
   61    HB2  PRO   9           HB2      PRO   9   3.310   3.030  -9.865
   62    HB3  PRO   9           HB3      PRO   9   4.777   3.379  -8.906
   63    HG2  PRO   9           HG2      PRO   9   2.033   2.583  -7.892
   64    HG3  PRO   9           HG3      PRO   9   3.634   1.944  -7.404
   65    HD2  PRO   9           HD2      PRO   9   2.291   3.904  -6.007
   66    HD3  PRO   9           HD3      PRO   9   4.079   3.805  -6.069
   67    H    ASN  10           H        ASN  10   2.852   6.507 -10.813
   68    HA   ASN  10           HA       ASN  10  -0.071   6.014 -10.931
   69    HB2  ASN  10           HB2      ASN  10   1.366   8.704 -10.894
   70    HB3  ASN  10           HB3      ASN  10  -0.285   8.514 -11.451
   71   HD21  ASN  10          HD22      ASN  10   1.847   8.143  -8.614
   72   HD22  ASN  10          HD21      ASN  10   0.616   8.675  -7.488
   73    H    VAL  11           H        VAL  11  -0.929   6.854 -12.986
   74    HA   VAL  11           HA       VAL  11   0.993   7.042 -15.255
   75    HB   VAL  11           HB       VAL  11  -1.062   6.149 -16.571
   76   HG11  VAL  11          HG11      VAL  11   1.052   4.893 -16.310
   77   HG12  VAL  11          HG12      VAL  11   0.469   4.237 -14.770
   78   HG13  VAL  11          HG13      VAL  11  -0.354   3.814 -16.282
   79   HG21  VAL  11          HG21      VAL  11  -2.685   6.217 -14.632
   80   HG22  VAL  11          HG22      VAL  11  -2.575   4.633 -15.394
   81   HG23  VAL  11          HG23      VAL  11  -1.771   4.892 -13.864
   82    H    GLY  12           H        GLY  12   0.576   8.839 -16.587
   83    HA2  GLY  12           HA2      GLY  12  -1.735  10.608 -15.842
   84    HA3  GLY  12           HA3      GLY  12  -0.161  11.199 -16.383
   85    H    ILE  13           H        ILE  13  -3.139  11.040 -17.558
   86    HA   ILE  13           HA       ILE  13  -2.458   9.874 -20.225
   87    HB   ILE  13           HB       ILE  13  -5.049  10.424 -18.756
   88   HG12  ILE  13          HG12      ILE  13  -5.681   8.208 -19.739
   89   HG13  ILE  13          HG13      ILE  13  -4.082   8.096 -20.474
   90   HG21  ILE  13          HG21      ILE  13  -5.459  11.607 -20.782
   91   HG22  ILE  13          HG22      ILE  13  -4.802  10.285 -21.782
   92   HG23  ILE  13          HG23      ILE  13  -6.319  10.076 -20.872
   93   HD11  ILE  13          HD11      ILE  13  -4.621   8.228 -17.474
   94   HD12  ILE  13          HD12      ILE  13  -4.327   6.755 -18.423
   95   HD13  ILE  13          HD13      ILE  13  -3.042   7.944 -18.265
   96    H    VAL  14           H        VAL  14  -1.877  11.283 -21.805
   97    HA   VAL  14           HA       VAL  14  -2.791  14.117 -21.577
   98    HB   VAL  14           HB       VAL  14  -0.456  13.055 -23.239
   99   HG11  VAL  14          HG11      VAL  14  -1.266  15.905 -22.506
  100   HG12  VAL  14          HG12      VAL  14   0.088  15.410 -23.547
  101   HG13  VAL  14          HG13      VAL  14  -1.565  15.136 -24.080
  102   HG21  VAL  14          HG21      VAL  14  -0.426  14.414 -20.527
  103   HG22  VAL  14          HG22      VAL  14   0.237  12.808 -20.976
  104   HG23  VAL  14          HG23      VAL  14   0.977  14.282 -21.604
  105    H    ILE  15           H        ILE  15  -4.936  13.533 -22.433
  106    HA   ILE  15           HA       ILE  15  -5.098  12.250 -25.064
  107    HB   ILE  15           HB       ILE  15  -7.111  14.139 -23.765
  108   HG12  ILE  15          HG12      ILE  15  -6.887  11.996 -22.542
  109   HG13  ILE  15          HG13      ILE  15  -8.475  12.252 -23.236
  110   HG21  ILE  15          HG21      ILE  15  -7.482  14.297 -26.100
  111   HG22  ILE  15          HG22      ILE  15  -7.328  12.533 -26.322
  112   HG23  ILE  15          HG23      ILE  15  -8.719  13.238 -25.447
  113   HD11  ILE  15          HD11      ILE  15  -7.539   9.901 -23.508
  114   HD12  ILE  15          HD12      ILE  15  -8.097  10.670 -25.008
  115   HD13  ILE  15          HD13      ILE  15  -6.367  10.584 -24.663
  116    H    CYS  16           H        CYS  16  -4.854  13.217 -27.030
  117    HA   CYS  16           HA       CYS  16  -4.592  16.186 -27.070
  118    HB2  CYS  16           HB2      CYS  16  -2.892  14.150 -28.564
  119    HB3  CYS  16           HB3      CYS  16  -3.048  15.873 -29.031
  120    HG   CYS  16           HG       CYS  16  -2.207  14.598 -26.091
  121    H    ASN  17           H        ASN  17  -6.105  17.023 -28.315
  122    HA   ASN  17           HA       ASN  17  -7.898  15.203 -29.789
  123    HB2  ASN  17           HB2      ASN  17  -8.950  16.966 -28.336
  124    HB3  ASN  17           HB3      ASN  17  -8.141  18.215 -29.303
  125   HD21  ASN  17          HD22      ASN  17 -10.965  16.239 -29.124
  126   HD22  ASN  17          HD21      ASN  17 -11.474  16.398 -30.790
  127    H    ARG  18           H        ARG  18  -7.427  14.953 -31.812
  128    HA   ARG  18           HA       ARG  18  -5.205  15.699 -33.209
  129    HB2  ARG  18           HB2      ARG  18  -6.498  14.838 -35.135
  130    HB3  ARG  18           HB3      ARG  18  -6.677  13.829 -33.669
  131    HG2  ARG  18           HG2      ARG  18  -8.863  14.692 -33.217
  132    HG3  ARG  18           HG3      ARG  18  -8.703  15.953 -34.459
  133    HD2  ARG  18           HD2      ARG  18  -8.547  14.232 -36.224
  134    HD3  ARG  18           HD3      ARG  18  -8.760  12.952 -35.006
  135    HE   ARG  18           HE       ARG  18 -10.921  14.765 -34.756
  136   HH11  ARG  18          HH21      ARG  18  -9.729  12.421 -37.149
  137   HH12  ARG  18          HH22      ARG  18 -11.286  12.104 -37.822
  138   HH21  ARG  18          HH11      ARG  18 -13.004  14.331 -35.650
  139   HH22  ARG  18          HH12      ARG  18 -13.182  13.214 -36.951
  140    H    GLN  19           H        GLN  19  -7.676  17.987 -32.560
  141    HA   GLN  19           HA       GLN  19  -7.269  19.535 -35.000
  142    HB2  GLN  19           HB2      GLN  19  -8.434  20.156 -32.271
  143    HB3  GLN  19           HB3      GLN  19  -8.339  21.354 -33.570
  144    HG2  GLN  19           HG2      GLN  19  -9.862  20.198 -34.956
  145    HG3  GLN  19           HG3      GLN  19  -9.760  18.715 -34.006
  146   HE21  GLN  19          HE22      GLN  19 -10.598  18.703 -31.847
  147   HE22  GLN  19          HE21      GLN  19 -11.848  19.834 -31.299
  148    H    GLY  20           H        GLY  20  -5.287  18.883 -32.237
  149    HA2  GLY  20           HA2      GLY  20  -3.051  19.689 -32.032
  150    HA3  GLY  20           HA3      GLY  20  -3.505  21.205 -32.832
  151    H    GLN  21           H        GLN  21  -4.904  19.348 -30.088
  152    HA   GLN  21           HA       GLN  21  -4.602  21.644 -28.282
  153    HB2  GLN  21           HB2      GLN  21  -7.291  20.674 -29.367
  154    HB3  GLN  21           HB3      GLN  21  -7.140  21.406 -27.783
  155    HG2  GLN  21           HG2      GLN  21  -7.606  23.312 -28.867
  156    HG3  GLN  21           HG3      GLN  21  -5.883  23.352 -29.151
  157   HE21  GLN  21          HE22      GLN  21  -5.145  23.189 -31.384
  158   HE22  GLN  21          HE21      GLN  21  -6.230  22.974 -32.730
  159    H    VAL  22           H        VAL  22  -5.124  20.988 -26.050
  160    HA   VAL  22           HA       VAL  22  -4.536  18.079 -25.711
  161    HB   VAL  22           HB       VAL  22  -3.233  18.767 -23.740
  162   HG11  VAL  22          HG11      VAL  22  -2.340  20.128 -26.311
  163   HG12  VAL  22          HG12      VAL  22  -1.304  19.608 -24.965
  164   HG13  VAL  22          HG13      VAL  22  -2.154  18.398 -25.936
  165   HG21  VAL  22          HG21      VAL  22  -4.297  20.954 -23.265
  166   HG22  VAL  22          HG22      VAL  22  -2.537  21.088 -23.437
  167   HG23  VAL  22          HG23      VAL  22  -3.591  21.626 -24.752
  168    H    MET  23           H        MET  23  -5.072  17.108 -23.743
  169    HA   MET  23           HA       MET  23  -7.675  17.225 -22.773
  170    HB2  MET  23           HB2      MET  23  -6.218  15.345 -22.352
  171    HB3  MET  23           HB3      MET  23  -5.044  16.338 -21.520
  172    HG2  MET  23           HG2      MET  23  -6.391  14.869 -20.034
  173    HG3  MET  23           HG3      MET  23  -6.396  16.572 -19.606
  174    HE1  MET  23           HE1      MET  23  -8.697  14.606 -22.306
  175    HE2  MET  23           HE2      MET  23  -8.480  13.525 -20.899
  176    HE3  MET  23           HE3      MET  23 -10.068  14.257 -21.245
  177    H    TRP  24           H        TRP  24  -8.744  18.620 -21.433
  178    HA   TRP  24           HA       TRP  24  -7.561  19.449 -19.026
  179    HB2  TRP  24           HB2      TRP  24  -7.028  21.363 -20.813
  180    HB3  TRP  24           HB3      TRP  24  -8.701  21.817 -20.500
  181    HD1  TRP  24           HD1      TRP  24  -8.577  23.777 -18.875
  182    HE1  TRP  24           HE1      TRP  24  -7.442  24.311 -16.651
  183    HE3  TRP  24           HE3      TRP  24  -5.487  19.696 -18.541
  184    HZ2  TRP  24           HZ2      TRP  24  -5.498  23.017 -14.841
  185    HZ3  TRP  24           HZ3      TRP  24  -4.124  19.322 -16.547
  186    HH2  TRP  24           HH2      TRP  24  -4.208  20.925 -14.649
  187    H    ALA  25           H        ALA  25  -9.197  19.390 -17.493
  188    HA   ALA  25           HA       ALA  25 -11.982  19.256 -18.414
  189    HB1  ALA  25           HB1      ALA  25 -11.232  17.012 -18.935
  190    HB2  ALA  25           HB2      ALA  25 -10.439  16.848 -17.352
  191    HB3  ALA  25           HB3      ALA  25 -12.212  16.940 -17.468
  192    H    ARG  26           H        ARG  26 -13.475  19.346 -16.757
  193    HA   ARG  26           HA       ARG  26 -12.471  20.742 -14.361
  194    HB2  ARG  26           HB2      ARG  26 -14.393  21.610 -15.788
  195    HB3  ARG  26           HB3      ARG  26 -15.358  20.242 -15.222
  196    HG2  ARG  26           HG2      ARG  26 -14.971  21.029 -12.850
  197    HG3  ARG  26           HG3      ARG  26 -14.041  22.388 -13.498
  198    HD2  ARG  26           HD2      ARG  26 -16.167  23.276 -13.048
  199    HD3  ARG  26           HD3      ARG  26 -16.124  23.069 -14.808
  200    HE   ARG  26           HE       ARG  26 -17.237  20.698 -13.821
  201   HH11  ARG  26          HH11      ARG  26 -18.132  24.167 -13.685
  202   HH12  ARG  26          HH12      ARG  26 -19.820  23.845 -13.547
  203   HH21  ARG  26          HH21      ARG  26 -19.444  20.302 -13.713
  204   HH22  ARG  26          HH22      ARG  26 -20.591  21.600 -13.541
  205    H    ARG  27           H        ARG  27 -12.555  19.862 -12.302
  206    HA   ARG  27           HA       ARG  27 -12.903  16.969 -12.135
  207    HB2  ARG  27           HB2      ARG  27 -11.026  18.456 -11.148
  208    HB3  ARG  27           HB3      ARG  27 -12.165  18.923  -9.915
  209    HG2  ARG  27           HG2      ARG  27 -11.101  16.138 -10.508
  210    HG3  ARG  27           HG3      ARG  27 -10.627  17.180  -9.169
  211    HD2  ARG  27           HD2      ARG  27 -12.808  16.936  -8.115
  212    HD3  ARG  27           HD3      ARG  27 -13.385  15.969  -9.495
  213    HE   ARG  27           HE       ARG  27 -11.158  14.615  -8.648
  214   HH11  ARG  27          HH11      ARG  27 -14.416  15.388  -7.368
  215   HH12  ARG  27          HH12      ARG  27 -14.510  13.917  -6.464
  216   HH21  ARG  27          HH21      ARG  27 -11.364  12.738  -7.705
  217   HH22  ARG  27          HH22      ARG  27 -12.687  12.310  -6.638
  218    H    PHE  28           H        PHE  28 -14.672  15.965 -11.264
  219    HA   PHE  28           HA       PHE  28 -17.075  17.458 -10.869
  220    HB2  PHE  28           HB2      PHE  28 -18.095  15.470 -10.956
  221    HB3  PHE  28           HB3      PHE  28 -16.565  14.929 -11.598
  222    HD1  PHE  28           HD2      PHE  28 -18.904  14.843  -8.805
  223    HD2  PHE  28           HD1      PHE  28 -15.100  13.388 -10.271
  224    HE1  PHE  28           HE2      PHE  28 -18.997  12.990  -7.200
  225    HE2  PHE  28           HE1      PHE  28 -15.252  11.478  -8.668
  226    HZ   PHE  28           HZ       PHE  28 -17.158  11.309  -7.098
  227    H    GLY  29           H        GLY  29 -18.224  17.946  -8.978
  228    HA2  GLY  29           HA2      GLY  29 -18.672  18.204  -6.739
  229    HA3  GLY  29           HA3      GLY  29 -17.271  17.200  -6.332
  230    H    GLN  30           H        GLN  30 -15.208  18.574  -7.624
  231    HA   GLN  30           HA       GLN  30 -14.741  20.789  -5.800
  232    HB2  GLN  30           HB2      GLN  30 -13.074  19.045  -6.498
  233    HB3  GLN  30           HB3      GLN  30 -13.150  19.684  -8.143
  234    HG2  GLN  30           HG2      GLN  30 -12.361  21.903  -7.218
  235    HG3  GLN  30           HG3      GLN  30 -12.096  21.101  -5.672
  236   HE21  GLN  30          HE22      GLN  30 -10.605  21.965  -8.589
  237   HE22  GLN  30          HE21      GLN  30  -9.271  20.827  -8.580
  238    H    HIS  31           H        HIS  31 -15.381  20.351  -9.266
  239    HA   HIS  31           HA       HIS  31 -15.893  21.636 -10.946
  240    HB2  HIS  31           HB2      HIS  31 -17.340  23.305  -8.897
  241    HB3  HIS  31           HB3      HIS  31 -17.607  23.339 -10.642
  242    HD1  HIS  31           HD1      HIS  31 -19.722  22.215  -8.282
  243    HD2  HIS  31           HD2      HIS  31 -17.403  20.051 -11.056
  244    HE1  HIS  31           HE1      HIS  31 -20.846  19.948  -8.554
  245    H    SER  32           H        SER  32 -13.355  21.904 -10.319
  246    HA   SER  32           HA       SER  32 -12.778  24.314 -11.820
  247    HB2  SER  32           HB2      SER  32 -10.819  24.903 -10.351
  248    HB3  SER  32           HB3      SER  32 -12.405  25.240  -9.653
  249    HG   SER  32           HG       SER  32 -11.133  24.274  -8.102
  250    H    TRP  33           H        TRP  33 -10.275  24.026 -12.527
  251    HA   TRP  33           HA       TRP  33 -10.315  21.491 -13.885
  252    HB2  TRP  33           HB2      TRP  33  -8.080  23.544 -13.841
  253    HB3  TRP  33           HB3      TRP  33  -8.416  22.315 -15.061
  254    HD1  TRP  33           HD1      TRP  33  -9.390  25.808 -13.994
  255    HE1  TRP  33           HE1      TRP  33 -11.141  26.808 -15.557
  256    HE3  TRP  33           HE3      TRP  33 -10.265  21.723 -16.912
  257    HZ2  TRP  33           HZ2      TRP  33 -12.839  25.901 -17.743
  258    HZ3  TRP  33           HZ3      TRP  33 -11.981  21.790 -18.719
  259    HH2  TRP  33           HH2      TRP  33 -13.303  23.860 -19.102
  260    H    GLN  34           H        GLN  34  -8.582  19.869 -13.933
  261    HA   GLN  34           HA       GLN  34  -6.634  19.906 -11.742
  262    HB2  GLN  34           HB2      GLN  34  -8.729  18.759 -10.843
  263    HB3  GLN  34           HB3      GLN  34  -8.519  17.544 -12.104
  264    HG2  GLN  34           HG2      GLN  34  -6.076  17.329 -10.977
  265    HG3  GLN  34           HG3      GLN  34  -6.901  18.051  -9.610
  266   HE21  GLN  34          HE22      GLN  34  -6.695  15.196 -11.754
  267   HE22  GLN  34          HE21      GLN  34  -7.786  14.189 -10.786
  268    H    PHE  35           H        PHE  35  -4.829  18.715 -12.217
  269    HA   PHE  35           HA       PHE  35  -4.151  17.955 -14.870
  270    HB2  PHE  35           HB2      PHE  35  -2.321  16.644 -13.416
  271    HB3  PHE  35           HB3      PHE  35  -2.267  18.372 -13.692
  272    HD1  PHE  35           HD1      PHE  35  -3.492  15.832 -11.185
  273    HD2  PHE  35           HD2      PHE  35  -2.307  19.917 -11.880
  274    HE1  PHE  35           HE1      PHE  35  -3.887  16.363  -8.793
  275    HE2  PHE  35           HE2      PHE  35  -2.665  20.428  -9.479
  276    HZ   PHE  35           HZ       PHE  35  -3.479  18.661  -7.936
  277    HA   PRO  36           HA       PRO  36  -5.869  13.768 -14.748
  278    HB2  PRO  36           HB2      PRO  36  -3.830  13.182 -16.853
  279    HB3  PRO  36           HB3      PRO  36  -5.589  12.859 -16.875
  280    HG2  PRO  36           HG2      PRO  36  -4.541  14.921 -18.318
  281    HG3  PRO  36           HG3      PRO  36  -6.077  15.135 -17.415
  282    HD2  PRO  36           HD2      PRO  36  -3.277  15.964 -16.568
  283    HD3  PRO  36           HD3      PRO  36  -4.810  16.894 -16.528
  284    H    GLN  37           H        GLN  37  -5.231  11.926 -13.633
  285    HA   GLN  37           HA       GLN  37  -2.640  10.827 -13.597
  286    HB2  GLN  37           HB2      GLN  37  -1.733  11.143 -11.574
  287    HB3  GLN  37           HB3      GLN  37  -2.214  12.769 -11.980
  288    HG2  GLN  37           HG2      GLN  37  -3.682  10.909 -10.042
  289    HG3  GLN  37           HG3      GLN  37  -2.535  12.156  -9.609
  290   HE21  GLN  37          HE22      GLN  37  -5.548  12.000 -11.684
  291   HE22  GLN  37          HE21      GLN  37  -6.295  13.358 -10.879
  292    H    GLY  38           H        GLY  38  -2.754   8.647 -12.689
  293    HA2  GLY  38           HA2      GLY  38  -5.007   8.008 -10.893
  294    HA3  GLY  38           HA3      GLY  38  -4.952   7.119 -12.428
  295    H    GLY  39           H        GLY  39  -4.426   6.296  -9.478
  296    HA2  GLY  39           HA2      GLY  39  -1.640   5.718  -9.202
  297    HA3  GLY  39           HA3      GLY  39  -2.971   5.056  -8.247
  298    H    ILE  40           H        ILE  40  -0.645   3.734  -9.451
  299    HA   ILE  40           HA       ILE  40  -1.814   1.847 -11.421
  300    HB   ILE  40           HB       ILE  40   0.943   2.042 -10.141
  301   HG12  ILE  40          HG12      ILE  40  -0.144   2.627 -12.937
  302   HG13  ILE  40          HG13      ILE  40   0.474   3.796 -11.786
  303   HG21  ILE  40          HG21      ILE  40  -0.026   0.061 -12.248
  304   HG22  ILE  40          HG22      ILE  40   1.640   0.225 -11.651
  305   HG23  ILE  40          HG23      ILE  40   0.389  -0.332 -10.565
  306   HD11  ILE  40          HD11      ILE  40   2.750   2.647 -11.995
  307   HD12  ILE  40          HD12      ILE  40   2.055   1.741 -13.362
  308   HD13  ILE  40          HD13      ILE  40   2.160   3.504 -13.424
  309    H    ASN  41           H        ASN  41  -2.522  -0.212 -10.857
  310    HA   ASN  41           HA       ASN  41  -2.781  -0.750  -7.957
  311    HB2  ASN  41           HB2      ASN  41  -4.595  -2.283  -8.545
  312    HB3  ASN  41           HB3      ASN  41  -4.912  -0.672  -9.164
  313   HD21  ASN  41          HD22      ASN  41  -4.931  -3.988 -10.061
  314   HD22  ASN  41          HD21      ASN  41  -4.872  -3.722 -11.801
  315    HA   PRO  42           HA       PRO  42   0.224  -3.573  -7.663
  316    HB2  PRO  42           HB2      PRO  42  -1.668  -5.709  -6.637
  317    HB3  PRO  42           HB3      PRO  42  -0.079  -5.203  -5.976
  318    HG2  PRO  42           HG2      PRO  42  -2.352  -4.248  -4.865
  319    HG3  PRO  42           HG3      PRO  42  -0.996  -3.123  -5.197
  320    HD2  PRO  42           HD2      PRO  42  -3.490  -3.597  -6.850
  321    HD3  PRO  42           HD3      PRO  42  -2.726  -2.053  -6.365
  322    H    GLY  43           H        GLY  43   1.328  -4.394  -9.152
  323    HA2  GLY  43           HA2      GLY  43   2.213  -5.933 -10.602
  324    HA3  GLY  43           HA3      GLY  43   0.840  -7.011 -10.286
  325    H    GLU  44           H        GLU  44  -0.341  -3.947 -11.219
  326    HA   GLU  44           HA       GLU  44  -0.938  -4.954 -13.941
  327    HB2  GLU  44           HB2      GLU  44  -2.657  -4.010 -12.408
  328    HB3  GLU  44           HB3      GLU  44  -1.920  -2.410 -12.619
  329    HG2  GLU  44           HG2      GLU  44  -2.447  -2.339 -14.918
  330    HG3  GLU  44           HG3      GLU  44  -2.644  -4.080 -15.036
  331    H    SER  45           H        SER  45   0.259  -4.440 -15.656
  332    HA   SER  45           HA       SER  45   2.513  -2.699 -15.428
  333    HB2  SER  45           HB2      SER  45   2.538  -3.397 -17.998
  334    HB3  SER  45           HB3      SER  45   2.998  -4.500 -16.697
  335    HG   SER  45           HG       SER  45   1.584  -5.667 -17.854
  336    H    ALA  46           H        ALA  46   3.003  -1.052 -16.990
  337    HA   ALA  46           HA       ALA  46   1.441   1.162 -16.512
  338    HB1  ALA  46           HB1      ALA  46   3.847   1.153 -17.162
  339    HB2  ALA  46           HB2      ALA  46   3.391   0.676 -18.817
  340    HB3  ALA  46           HB3      ALA  46   2.912   2.271 -18.175
  341    H    GLU  47           H        GLU  47   1.520  -0.777 -19.539
  342    HA   GLU  47           HA       GLU  47  -0.451   0.937 -20.816
  343    HB2  GLU  47           HB2      GLU  47   0.911  -1.651 -21.676
  344    HB3  GLU  47           HB3      GLU  47  -0.224  -0.752 -22.691
  345    HG2  GLU  47           HG2      GLU  47   1.204   1.207 -22.692
  346    HG3  GLU  47           HG3      GLU  47   2.350   0.439 -21.590
  347    H    GLN  48           H        GLN  48  -0.955  -1.020 -18.349
  348    HA   GLN  48           HA       GLN  48  -3.641  -1.939 -19.287
  349    HB2  GLN  48           HB2      GLN  48  -1.754  -3.144 -17.206
  350    HB3  GLN  48           HB3      GLN  48  -3.480  -3.439 -17.209
  351    HG2  GLN  48           HG2      GLN  48  -2.137  -5.228 -18.293
  352    HG3  GLN  48           HG3      GLN  48  -3.459  -4.583 -19.252
  353   HE21  GLN  48          HE22      GLN  48   0.140  -3.962 -18.822
  354   HE22  GLN  48          HE21      GLN  48   0.428  -3.735 -20.531
  355    H    ALA  49           H        ALA  49  -1.808  -0.731 -16.378
  356    HA   ALA  49           HA       ALA  49  -3.975   0.394 -15.044
  357    HB1  ALA  49           HB1      ALA  49  -2.259   1.691 -13.850
  358    HB2  ALA  49           HB2      ALA  49  -1.765  -0.007 -14.057
  359    HB3  ALA  49           HB3      ALA  49  -1.053   1.266 -15.088
  360    H    MET  50           H        MET  50  -1.990   1.862 -17.680
  361    HA   MET  50           HA       MET  50  -3.003   4.502 -17.433
  362    HB2  MET  50           HB2      MET  50  -1.011   3.893 -18.682
  363    HB3  MET  50           HB3      MET  50  -1.973   3.007 -19.869
  364    HG2  MET  50           HG2      MET  50  -2.308   5.983 -19.295
  365    HG3  MET  50           HG3      MET  50  -1.175   5.362 -20.469
  366    HE1  MET  50           HE1      MET  50  -2.156   3.315 -22.221
  367    HE2  MET  50           HE2      MET  50  -3.145   4.142 -23.441
  368    HE3  MET  50           HE3      MET  50  -1.621   4.874 -22.894
  369    H    TYR  51           H        TYR  51  -4.385   1.681 -19.209
  370    HA   TYR  51           HA       TYR  51  -6.661   3.215 -20.059
  371    HB2  TYR  51           HB2      TYR  51  -6.216   0.229 -19.969
  372    HB3  TYR  51           HB3      TYR  51  -7.614   1.031 -20.680
  373    HD1  TYR  51           HD1      TYR  51  -3.908   0.758 -20.897
  374    HD2  TYR  51           HD2      TYR  51  -7.499   2.047 -22.883
  375    HE1  TYR  51           HE1      TYR  51  -2.648   0.884 -23.010
  376    HE2  TYR  51           HE2      TYR  51  -6.287   2.196 -25.010
  377    HH   TYR  51           HH       TYR  51  -4.274   1.778 -26.142
  378    H    ARG  52           H        ARG  52  -5.874   1.395 -17.102
  379    HA   ARG  52           HA       ARG  52  -8.539   1.309 -16.052
  380    HB2  ARG  52           HB2      ARG  52  -6.356   0.199 -15.123
  381    HB3  ARG  52           HB3      ARG  52  -6.040   1.758 -14.369
  382    HG2  ARG  52           HG2      ARG  52  -7.050   0.495 -12.687
  383    HG3  ARG  52           HG3      ARG  52  -8.309   1.587 -13.252
  384    HD2  ARG  52           HD2      ARG  52  -9.291  -0.570 -12.939
  385    HD3  ARG  52           HD3      ARG  52  -9.213  -0.311 -14.688
  386    HE   ARG  52           HE       ARG  52  -6.842  -1.688 -13.996
  387   HH11  ARG  52          HH11      ARG  52 -10.371  -2.316 -13.977
  388   HH12  ARG  52          HH12      ARG  52 -10.193  -4.028 -14.051
  389   HH21  ARG  52          HH21      ARG  52  -6.629  -3.943 -13.968
  390   HH22  ARG  52          HH22      ARG  52  -8.023  -4.980 -14.093
  391    H    ALA  53           H        ALA  53  -5.918   3.793 -15.713
  392    HA   ALA  53           HA       ALA  53  -7.506   5.697 -14.358
  393    HB1  ALA  53           HB1      ALA  53  -5.085   6.100 -16.161
  394    HB2  ALA  53           HB2      ALA  53  -5.744   7.299 -15.027
  395    HB3  ALA  53           HB3      ALA  53  -5.066   5.777 -14.410
  396    H    LEU  54           H        LEU  54  -7.121   5.114 -17.861
  397    HA   LEU  54           HA       LEU  54  -8.372   7.413 -18.944
  398    HB2  LEU  54           HB2      LEU  54  -7.117   5.657 -20.161
  399    HB3  LEU  54           HB3      LEU  54  -8.367   4.501 -19.710
  400    HG   LEU  54           HG       LEU  54  -9.994   5.607 -21.201
  401   HD11  LEU  54          HD11      LEU  54  -8.965   7.881 -21.267
  402   HD12  LEU  54          HD12      LEU  54  -7.512   7.195 -22.036
  403   HD13  LEU  54          HD13      LEU  54  -9.068   7.181 -22.900
  404   HD21  LEU  54          HD21      LEU  54  -8.807   3.650 -21.748
  405   HD22  LEU  54          HD22      LEU  54  -8.982   4.671 -23.190
  406   HD23  LEU  54          HD23      LEU  54  -7.404   4.577 -22.340
  407    H    PHE  55           H        PHE  55  -9.677   4.345 -17.782
  408    HA   PHE  55           HA       PHE  55 -12.459   5.012 -18.200
  409    HB2  PHE  55           HB2      PHE  55 -12.246   2.759 -18.203
  410    HB3  PHE  55           HB3      PHE  55 -10.885   2.745 -17.107
  411    HD1  PHE  55           HD1      PHE  55 -14.613   3.015 -17.208
  412    HD2  PHE  55           HD2      PHE  55 -11.100   2.349 -14.804
  413    HE1  PHE  55           HE1      PHE  55 -16.053   2.307 -15.304
  414    HE2  PHE  55           HE2      PHE  55 -12.544   1.649 -12.889
  415    HZ   PHE  55           HZ       PHE  55 -15.015   1.623 -13.147
  416    H    GLU  56           H        GLU  56 -10.336   5.027 -15.262
  417    HA   GLU  56           HA       GLU  56 -12.392   5.779 -13.489
  418    HB2  GLU  56           HB2      GLU  56  -9.390   6.220 -13.357
  419    HB3  GLU  56           HB3      GLU  56 -10.485   6.641 -12.038
  420    HG2  GLU  56           HG2      GLU  56 -11.239   4.343 -11.824
  421    HG3  GLU  56           HG3      GLU  56 -10.229   3.829 -13.167
  422    H    GLU  57           H        GLU  57 -10.202   7.872 -15.419
  423    HA   GLU  57           HA       GLU  57 -11.190  10.236 -14.043
  424    HB2  GLU  57           HB2      GLU  57  -9.167   9.994 -16.308
  425    HB3  GLU  57           HB3      GLU  57  -9.542  11.432 -15.361
  426    HG2  GLU  57           HG2      GLU  57  -8.885  10.028 -13.282
  427    HG3  GLU  57           HG3      GLU  57  -8.149   8.912 -14.432
  428    H    VAL  58           H        VAL  58 -11.217   9.126 -17.519
  429    HA   VAL  58           HA       VAL  58 -13.267  11.202 -17.991
  430    HB   VAL  58           HB       VAL  58 -12.553  11.220 -20.284
  431   HG11  VAL  58          HG11      VAL  58 -10.190  11.600 -18.389
  432   HG12  VAL  58          HG12      VAL  58 -10.382  12.295 -20.010
  433   HG13  VAL  58          HG13      VAL  58 -11.482  12.783 -18.722
  434   HG21  VAL  58          HG21      VAL  58 -11.686   8.884 -20.475
  435   HG22  VAL  58          HG22      VAL  58 -10.610  10.117 -21.141
  436   HG23  VAL  58          HG23      VAL  58 -10.235   9.394 -19.564
  437    H    GLY  59           H        GLY  59 -13.021   7.789 -17.706
  438    HA2  GLY  59           HA2      GLY  59 -14.660   6.214 -18.004
  439    HA3  GLY  59           HA3      GLY  59 -15.785   7.480 -18.501
  440    H    LEU  60           H        LEU  60 -12.623   6.641 -19.952
  441    HA   LEU  60           HA       LEU  60 -14.000   5.690 -22.429
  442    HB2  LEU  60           HB2      LEU  60 -11.335   7.089 -22.079
  443    HB3  LEU  60           HB3      LEU  60 -11.809   6.253 -23.545
  444    HG   LEU  60           HG       LEU  60 -13.120   8.691 -22.309
  445   HD11  LEU  60          HD11      LEU  60 -10.962   9.089 -23.464
  446   HD12  LEU  60          HD12      LEU  60 -11.588   8.300 -24.932
  447   HD13  LEU  60          HD13      LEU  60 -12.294   9.819 -24.370
  448   HD21  LEU  60          HD21      LEU  60 -13.971   7.193 -24.823
  449   HD22  LEU  60          HD22      LEU  60 -14.931   7.450 -23.346
  450   HD23  LEU  60          HD23      LEU  60 -14.533   8.814 -24.376
  451    H    SER  61           H        SER  61 -12.687   3.973 -23.552
  452    HA   SER  61           HA       SER  61 -11.669   2.034 -21.522
  453    HB2  SER  61           HB2      SER  61 -13.126   0.381 -22.560
  454    HB3  SER  61           HB3      SER  61 -14.064   1.772 -22.021
  455    HG   SER  61           HG       SER  61 -13.776   2.520 -24.353
  456    H    ARG  62           H        ARG  62 -11.011  -0.064 -23.057
  457    HA   ARG  62           HA       ARG  62  -8.480   0.740 -24.174
  458    HB2  ARG  62           HB2      ARG  62  -9.813  -1.990 -24.053
  459    HB3  ARG  62           HB3      ARG  62  -8.114  -1.682 -24.439
  460    HG2  ARG  62           HG2      ARG  62  -7.766  -0.727 -22.185
  461    HG3  ARG  62           HG3      ARG  62  -9.445  -1.124 -21.754
  462    HD2  ARG  62           HD2      ARG  62  -8.926  -3.531 -22.298
  463    HD3  ARG  62           HD3      ARG  62  -7.236  -3.055 -22.569
  464    HE   ARG  62           HE       ARG  62  -8.159  -2.192 -19.977
  465   HH11  ARG  62          HH11      ARG  62  -7.162  -5.133 -21.707
  466   HH12  ARG  62          HH12      ARG  62  -6.630  -5.966 -20.293
  467   HH21  ARG  62          HH21      ARG  62  -7.418  -3.292 -18.076
  468   HH22  ARG  62          HH22      ARG  62  -6.796  -4.897 -18.186
  469    H    LYS  63           H        LYS  63 -10.295   2.013 -25.753
  470    HA   LYS  63           HA       LYS  63  -9.741   0.902 -28.414
  471    HB2  LYS  63           HB2      LYS  63 -11.974   0.422 -29.101
  472    HB3  LYS  63           HB3      LYS  63 -11.712  -0.429 -27.579
  473    HG2  LYS  63           HG2      LYS  63 -12.881   1.533 -26.417
  474    HG3  LYS  63           HG3      LYS  63 -13.286   2.150 -28.015
  475    HD2  LYS  63           HD2      LYS  63 -15.194   1.011 -27.201
  476    HD3  LYS  63           HD3      LYS  63 -14.511   0.022 -28.502
  477    HE2  LYS  63           HE2      LYS  63 -13.446  -1.461 -26.808
  478    HE3  LYS  63           HE3      LYS  63 -14.063  -0.433 -25.506
  479    HZ1  LYS  63           HZ1      LYS  63 -15.458  -2.379 -25.840
  480    HZ2  LYS  63           HZ2      LYS  63 -16.320  -1.037 -26.192
  481    HZ3  LYS  63           HZ3      LYS  63 -15.746  -1.990 -27.398
  482    H    ASP  64           H        ASP  64 -10.970   3.443 -26.310
  483    HA   ASP  64           HA       ASP  64 -11.998   5.046 -28.489
  484    HB2  ASP  64           HB2      ASP  64 -11.521   5.581 -25.551
  485    HB3  ASP  64           HB3      ASP  64 -12.442   6.633 -26.615
  486    H    VAL  65           H        VAL  65  -8.857   4.439 -27.690
  487    HA   VAL  65           HA       VAL  65  -7.861   7.096 -28.442
  488    HB   VAL  65           HB       VAL  65  -6.415   7.159 -26.442
  489   HG11  VAL  65          HG11      VAL  65  -9.347   7.084 -25.625
  490   HG12  VAL  65          HG12      VAL  65  -8.047   8.045 -24.917
  491   HG13  VAL  65          HG13      VAL  65  -8.615   8.390 -26.565
  492   HG21  VAL  65          HG21      VAL  65  -6.976   5.768 -24.447
  493   HG22  VAL  65          HG22      VAL  65  -8.137   4.845 -25.406
  494   HG23  VAL  65          HG23      VAL  65  -6.403   4.768 -25.788
  495    H    ARG  66           H        ARG  66  -5.405   7.022 -28.571
  496    HA   ARG  66           HA       ARG  66  -4.358   4.442 -29.654
  497    HB2  ARG  66           HB2      ARG  66  -5.420   5.589 -31.507
  498    HB3  ARG  66           HB3      ARG  66  -4.856   7.163 -30.952
  499    HG2  ARG  66           HG2      ARG  66  -3.676   6.587 -32.913
  500    HG3  ARG  66           HG3      ARG  66  -2.557   6.575 -31.566
  501    HD2  ARG  66           HD2      ARG  66  -3.833   3.946 -32.307
  502    HD3  ARG  66           HD3      ARG  66  -2.715   4.637 -33.489
  503    HE   ARG  66           HE       ARG  66  -1.215   4.834 -31.247
  504   HH11  ARG  66          HH11      ARG  66  -2.886   2.057 -32.734
  505   HH12  ARG  66          HH12      ARG  66  -1.691   0.917 -32.228
  506   HH21  ARG  66          HH21      ARG  66   0.340   3.360 -30.620
  507   HH22  ARG  66          HH22      ARG  66   0.184   1.668 -30.977
  508    H    ILE  67           H        ILE  67  -2.274   4.241 -28.606
  509    HA   ILE  67           HA       ILE  67  -1.069   6.604 -27.395
  510    HB   ILE  67           HB       ILE  67  -0.001   3.781 -27.798
  511   HG12  ILE  67          HG12      ILE  67  -1.102   4.968 -25.218
  512   HG13  ILE  67          HG13      ILE  67  -2.159   4.120 -26.338
  513   HG21  ILE  67          HG21      ILE  67   0.965   6.060 -25.996
  514   HG22  ILE  67          HG22      ILE  67   1.602   4.399 -25.987
  515   HG23  ILE  67          HG23      ILE  67   1.818   5.398 -27.413
  516   HD11  ILE  67          HD11      ILE  67  -0.755   2.096 -26.197
  517   HD12  ILE  67          HD12      ILE  67   0.310   2.898 -25.017
  518   HD13  ILE  67          HD13      ILE  67  -1.374   2.580 -24.606
  519    H    LEU  68           H        LEU  68   0.305   7.993 -28.305
  520    HA   LEU  68           HA       LEU  68   1.579   7.240 -30.918
  521    HB2  LEU  68           HB2      LEU  68   0.394   9.763 -29.899
  522    HB3  LEU  68           HB3      LEU  68   1.992   9.980 -30.580
  523    HG   LEU  68           HG       LEU  68   0.137  10.352 -32.168
  524   HD11  LEU  68          HD11      LEU  68   1.162   9.192 -34.071
  525   HD12  LEU  68          HD12      LEU  68   2.400   9.845 -32.987
  526   HD13  LEU  68          HD13      LEU  68   2.033   8.104 -32.967
  527   HD21  LEU  68          HD21      LEU  68  -0.245   7.328 -32.205
  528   HD22  LEU  68          HD22      LEU  68  -1.324   8.458 -31.356
  529   HD23  LEU  68          HD23      LEU  68  -1.132   8.548 -33.124
  530    H    ALA  69           H        ALA  69   2.176   8.353 -27.585
  531    HA   ALA  69           HA       ALA  69   4.977   7.579 -27.760
  532    HB1  ALA  69           HB1      ALA  69   4.244  10.526 -27.263
  533    HB2  ALA  69           HB2      ALA  69   5.867   9.815 -27.190
  534    HB3  ALA  69           HB3      ALA  69   5.008   9.909 -28.735
  535    H    SER  70           H        SER  70   6.004   8.062 -25.514
  536    HA   SER  70           HA       SER  70   4.200   8.684 -23.339
  537    HB2  SER  70           HB2      SER  70   4.855   6.656 -22.023
  538    HB3  SER  70           HB3      SER  70   3.786   6.330 -23.391
  539    HG   SER  70           HG       SER  70   5.404   4.793 -23.461
  540    H    THR  71           H        THR  71   5.590   9.123 -21.295
  541    HA   THR  71           HA       THR  71   7.893  10.585 -22.165
  542    HB   THR  71           HB       THR  71   8.248  10.846 -19.627
  543    HG1  THR  71           HG1      THR  71   7.149   9.209 -18.745
  544   HG21  THR  71          HG21      THR  71   5.617  11.642 -20.932
  545   HG22  THR  71          HG22      THR  71   6.253  12.316 -19.413
  546   HG23  THR  71          HG23      THR  71   7.131  12.569 -20.930
  547    H    ARG  72           H        ARG  72  10.082  10.206 -21.924
  548    HA   ARG  72           HA       ARG  72  10.785   7.503 -22.463
  549    HB2  ARG  72           HB2      ARG  72  12.471   9.993 -21.970
  550    HB3  ARG  72           HB3      ARG  72  13.130   8.448 -22.530
  551    HG2  ARG  72           HG2      ARG  72  11.728   8.503 -24.532
  552    HG3  ARG  72           HG3      ARG  72  10.965  10.008 -24.022
  553    HD2  ARG  72           HD2      ARG  72  13.934   9.688 -24.633
  554    HD3  ARG  72           HD3      ARG  72  12.727  10.294 -25.756
  555    HE   ARG  72           HE       ARG  72  12.300  12.209 -24.343
  556   HH11  ARG  72          HH11      ARG  72  15.349  10.485 -23.595
  557   HH12  ARG  72          HH12      ARG  72  16.088  11.862 -22.863
  558   HH21  ARG  72          HH21      ARG  72  13.276  13.996 -23.421
  559   HH22  ARG  72          HH22      ARG  72  14.877  13.900 -22.733
  560    H    ASN  73           H        ASN  73  10.655   9.208 -19.443
  561    HA   ASN  73           HA       ASN  73  11.250   6.779 -18.023
  562    HB2  ASN  73           HB2      ASN  73  12.818   7.690 -16.448
  563    HB3  ASN  73           HB3      ASN  73  13.499   7.906 -18.049
  564   HD21  ASN  73          HD22      ASN  73  13.466  10.147 -18.993
  565   HD22  ASN  73          HD21      ASN  73  13.351  11.518 -17.918
  566    H    TRP  74           H        TRP  74  10.707   7.369 -15.535
  567    HA   TRP  74           HA       TRP  74   8.016   8.476 -15.607
  568    HB2  TRP  74           HB2      TRP  74   9.650   7.385 -13.282
  569    HB3  TRP  74           HB3      TRP  74   7.934   7.764 -13.285
  570    HD1  TRP  74           HD1      TRP  74  10.422   5.276 -14.885
  571    HE1  TRP  74           HE1      TRP  74   9.192   3.174 -15.610
  572    HE3  TRP  74           HE3      TRP  74   5.692   6.514 -13.414
  573    HZ2  TRP  74           HZ2      TRP  74   6.471   2.301 -15.934
  574    HZ3  TRP  74           HZ3      TRP  74   3.778   5.042 -14.001
  575    HH2  TRP  74           HH2      TRP  74   4.114   2.997 -15.330
  576    H    LEU  75           H        LEU  75   7.615  10.584 -15.316
  577    HA   LEU  75           HA       LEU  75   9.621  12.477 -14.280
  578    HB2  LEU  75           HB2      LEU  75   6.734  12.691 -15.246
  579    HB3  LEU  75           HB3      LEU  75   7.450  13.982 -14.313
  580    HG   LEU  75           HG       LEU  75   7.485  14.433 -16.704
  581   HD11  LEU  75          HD11      LEU  75   9.202  15.491 -15.284
  582   HD12  LEU  75          HD12      LEU  75  10.307  14.130 -15.587
  583   HD13  LEU  75          HD13      LEU  75   9.805  15.183 -16.914
  584   HD21  LEU  75          HD21      LEU  75   8.884  13.263 -18.275
  585   HD22  LEU  75          HD22      LEU  75   9.510  12.185 -17.014
  586   HD23  LEU  75          HD23      LEU  75   7.803  12.087 -17.502
  587    H    ARG  76           H        ARG  76   9.632  13.214 -12.120
  588    HA   ARG  76           HA       ARG  76   7.439  12.414 -10.351
  589    HB2  ARG  76           HB2      ARG  76   8.867  11.232  -8.755
  590    HB3  ARG  76           HB3      ARG  76   8.830  10.420 -10.316
  591    HG2  ARG  76           HG2      ARG  76  11.043  11.566 -10.865
  592    HG3  ARG  76           HG3      ARG  76  11.124  12.068  -9.173
  593    HD2  ARG  76           HD2      ARG  76  10.838   9.182 -10.119
  594    HD3  ARG  76           HD3      ARG  76  12.386   9.979  -9.780
  595    HE   ARG  76           HE       ARG  76  10.616  10.199  -7.518
  596   HH11  ARG  76          HH21      ARG  76  12.760   7.894  -9.177
  597   HH12  ARG  76          HH22      ARG  76  13.148   7.004  -7.751
  598   HH21  ARG  76          HH11      ARG  76  11.139   9.003  -5.604
  599   HH22  ARG  76          HH12      ARG  76  12.199   7.642  -5.687
  600    H    TYR  77           H        TYR  77   7.329  13.589  -8.444
  601    HA   TYR  77           HA       TYR  77   9.260  15.733  -7.901
  602    HB2  TYR  77           HB2      TYR  77   7.437  17.458  -8.013
  603    HB3  TYR  77           HB3      TYR  77   7.913  16.815  -9.570
  604    HD1  TYR  77           HD2      TYR  77   5.257  16.668  -6.947
  605    HD2  TYR  77           HD1      TYR  77   6.347  15.644 -10.975
  606    HE1  TYR  77           HE2      TYR  77   2.952  15.950  -7.366
  607    HE2  TYR  77           HE1      TYR  77   3.994  15.041 -11.466
  608    HH   TYR  77           HH       TYR  77   1.887  14.610 -10.530
  609    H    LYS  78           H        LYS  78   8.478  16.907  -5.878
  610    HA   LYS  78           HA       LYS  78   7.363  14.884  -4.017
  611    HB2  LYS  78           HB2      LYS  78   8.916  17.450  -3.508
  612    HB3  LYS  78           HB3      LYS  78   7.980  16.621  -2.259
  613    HG2  LYS  78           HG2      LYS  78   9.293  14.474  -2.943
  614    HG3  LYS  78           HG3      LYS  78  10.417  15.598  -3.744
  615    HD2  LYS  78           HD2      LYS  78  10.627  16.823  -1.549
  616    HD3  LYS  78           HD3      LYS  78   9.543  15.607  -0.819
  617    HE2  LYS  78           HE2      LYS  78  11.170  13.810  -1.389
  618    HE3  LYS  78           HE3      LYS  78  12.222  14.990  -2.178
  619    HZ1  LYS  78           HZ1      LYS  78  11.574  14.959   0.726
  620    HZ2  LYS  78           HZ2      LYS  78  12.990  14.498   0.059
  621    HZ3  LYS  78           HZ3      LYS  78  12.535  16.061  -0.010
  622    H    LEU  79           H        LEU  79   5.745  15.434  -2.609
  623    HA   LEU  79           HA       LEU  79   3.697  17.270  -3.760
  624    HB2  LEU  79           HB2      LEU  79   3.565  15.091  -1.638
  625    HB3  LEU  79           HB3      LEU  79   2.205  16.152  -2.009
  626    HG   LEU  79           HG       LEU  79   3.522  14.337  -4.075
  627   HD11  LEU  79          HD11      LEU  79   1.013  13.780  -2.431
  628   HD12  LEU  79          HD12      LEU  79   1.667  12.774  -3.741
  629   HD13  LEU  79          HD13      LEU  79   2.580  12.964  -2.245
  630   HD21  LEU  79          HD21      LEU  79   2.184  16.222  -5.024
  631   HD22  LEU  79          HD22      LEU  79   1.436  14.650  -5.330
  632   HD23  LEU  79          HD23      LEU  79   0.788  15.699  -4.052
  633    HA   PRO  80           HA       PRO  80   4.836  20.108  -0.395
  634    HB2  PRO  80           HB2      PRO  80   2.761  21.866  -0.495
  635    HB3  PRO  80           HB3      PRO  80   3.972  21.787  -1.808
  636    HG2  PRO  80           HG2      PRO  80   1.309  20.316  -1.681
  637    HG3  PRO  80           HG3      PRO  80   1.885  21.441  -2.998
  638    HD2  PRO  80           HD2      PRO  80   2.180  18.770  -3.220
  639    HD3  PRO  80           HD3      PRO  80   3.520  19.857  -3.699
  640    H    LYS  81           H        LYS  81   4.120  20.304   1.870
  641    HA   LYS  81           HA       LYS  81   2.860  17.956   2.613
  642    HB2  LYS  81           HB2      LYS  81   3.239  18.563   4.914
  643    HB3  LYS  81           HB3      LYS  81   4.582  19.063   3.919
  644    HG2  LYS  81           HG2      LYS  81   4.379  20.897   5.273
  645    HG3  LYS  81           HG3      LYS  81   3.453  21.421   3.878
  646    HD2  LYS  81           HD2      LYS  81   2.342  22.085   5.914
  647    HD3  LYS  81           HD3      LYS  81   1.333  20.883   5.118
  648    HE2  LYS  81           HE2      LYS  81   2.154  19.129   6.662
  649    HE3  LYS  81           HE3      LYS  81   3.283  20.277   7.390
  650    HZ1  LYS  81           HZ1      LYS  81   0.318  20.476   7.525
  651    HZ2  LYS  81           HZ2      LYS  81   1.313  20.045   8.748
  652    HZ3  LYS  81           HZ3      LYS  81   1.361  21.568   8.169
  653    H    ARG  82           H        ARG  82   1.252  20.897   1.998
  654    HA   ARG  82           HA       ARG  82  -1.173  20.264   3.412
  655    HB2  ARG  82           HB2      ARG  82  -2.119  22.175   2.264
  656    HB3  ARG  82           HB3      ARG  82  -0.500  22.552   2.819
  657    HG2  ARG  82           HG2      ARG  82   0.139  21.793   0.274
  658    HG3  ARG  82           HG3      ARG  82  -1.554  22.196   0.013
  659    HD2  ARG  82           HD2      ARG  82  -0.248  24.143  -0.473
  660    HD3  ARG  82           HD3      ARG  82  -1.111  24.448   1.045
  661    HE   ARG  82           HE       ARG  82   1.521  23.340   1.549
  662   HH11  ARG  82          HH21      ARG  82  -0.052  26.368   0.541
  663   HH12  ARG  82          HH22      ARG  82   1.196  27.395   1.151
  664   HH21  ARG  82          HH11      ARG  82   3.198  24.721   2.367
  665   HH22  ARG  82          HH12      ARG  82   3.079  26.431   2.202
  666    H    LEU  83           H        LEU  83   0.129  19.300   0.290
  667    HA   LEU  83           HA       LEU  83  -2.515  18.275  -0.557
  668    HB2  LEU  83           HB2      LEU  83  -1.050  19.690  -2.091
  669    HB3  LEU  83           HB3      LEU  83   0.076  18.328  -2.125
  670    HG   LEU  83           HG       LEU  83  -1.750  16.892  -3.100
  671   HD11  LEU  83          HD11      LEU  83  -3.747  18.049  -4.069
  672   HD12  LEU  83          HD12      LEU  83  -3.769  18.063  -2.307
  673   HD13  LEU  83          HD13      LEU  83  -3.300  19.529  -3.197
  674   HD21  LEU  83          HD21      LEU  83  -1.683  17.959  -5.331
  675   HD22  LEU  83          HD22      LEU  83  -1.100  19.467  -4.592
  676   HD23  LEU  83          HD23      LEU  83  -0.107  17.986  -4.520
  677    H    VAL  84           H        VAL  84   0.618  17.192   0.618
  678    HA   VAL  84           HA       VAL  84   0.602  14.464   0.097
  679    HB   VAL  84           HB       VAL  84   1.314  15.958   2.650
  680   HG11  VAL  84          HG11      VAL  84   2.574  13.956   3.384
  681   HG12  VAL  84          HG12      VAL  84   0.845  13.638   3.360
  682   HG13  VAL  84          HG13      VAL  84   1.870  13.016   2.056
  683   HG21  VAL  84          HG21      VAL  84   2.730  16.328   0.578
  684   HG22  VAL  84          HG22      VAL  84   3.617  15.592   1.919
  685   HG23  VAL  84          HG23      VAL  84   3.070  14.589   0.568
  686    H    ARG  85           H        ARG  85  -0.531  12.747   0.717
  687    HA   ARG  85           HA       ARG  85  -3.295  13.325   1.305
  688    HB2  ARG  85           HB2      ARG  85  -2.117  10.520   1.142
  689    HB3  ARG  85           HB3      ARG  85  -3.756  11.033   0.781
  690    HG2  ARG  85           HG2      ARG  85  -1.243  11.477  -0.868
  691    HG3  ARG  85           HG3      ARG  85  -2.651  10.520  -1.287
  692    HD2  ARG  85           HD2      ARG  85  -2.482  13.545  -1.099
  693    HD3  ARG  85           HD3      ARG  85  -2.604  12.589  -2.569
  694    HE   ARG  85           HE       ARG  85  -4.806  11.760  -1.662
  695   HH11  ARG  85          HH11      ARG  85  -3.631  15.070  -0.941
  696   HH12  ARG  85          HH12      ARG  85  -5.221  15.706  -0.682
  697   HH21  ARG  85          HH21      ARG  85  -6.905  12.650  -1.342
  698   HH22  ARG  85          HH22      ARG  85  -7.113  14.313  -0.932
  699    H    TRP  86           H        TRP  86  -0.789  11.723   3.156
  700    HA   TRP  86           HA       TRP  86  -0.572  10.837   5.167
  701    HB2  TRP  86           HB2      TRP  86  -2.798  12.635   6.099
  702    HB3  TRP  86           HB3      TRP  86  -1.579  11.850   7.093
  703    HD1  TRP  86           HD1      TRP  86  -2.038  14.699   4.638
  704    HE1  TRP  86           HE1      TRP  86  -0.045  16.290   4.675
  705    HE3  TRP  86           HE3      TRP  86   1.035  12.013   7.716
  706    HZ2  TRP  86           HZ2      TRP  86   2.587  16.388   5.909
  707    HZ3  TRP  86           HZ3      TRP  86   3.298  12.858   8.275
  708    HH2  TRP  86           HH2      TRP  86   4.085  15.041   7.375
  709    H    ASP  87           H        ASP  87  -3.149  10.106   3.342
  710    HA   ASP  87           HA       ASP  87  -4.423   8.188   5.217
  711    HB2  ASP  87           HB2      ASP  87  -5.868   9.603   3.815
  712    HB3  ASP  87           HB3      ASP  87  -5.085   8.978   2.359
  713    H    THR  88           H        THR  88  -2.053   8.310   2.637
  714    HA   THR  88           HA       THR  88  -2.209   5.558   1.822
  715    HB   THR  88           HB       THR  88   0.060   6.435   0.748
  716    HG1  THR  88           HG1      THR  88  -0.380   8.845   0.444
  717   HG21  THR  88          HG21      THR  88  -2.086   6.047  -0.479
  718   HG22  THR  88          HG22      THR  88  -2.622   7.682  -0.020
  719   HG23  THR  88          HG23      THR  88  -1.211   7.458  -1.087
  720    H    LYS  89           H        LYS  89  -0.536   4.023   2.240
  721    HA   LYS  89           HA       LYS  89   1.245   4.518   4.581
  722    HB2  LYS  89           HB2      LYS  89  -0.607   2.134   4.255
  723    HB3  LYS  89           HB3      LYS  89   0.720   2.221   5.407
  724    HG2  LYS  89           HG2      LYS  89  -1.665   4.120   5.381
  725    HG3  LYS  89           HG3      LYS  89  -1.526   2.668   6.372
  726    HD2  LYS  89           HD2      LYS  89   0.461   3.608   7.515
  727    HD3  LYS  89           HD3      LYS  89   0.316   5.096   6.550
  728    HE2  LYS  89           HE2      LYS  89  -1.952   5.489   7.451
  729    HE3  LYS  89           HE3      LYS  89  -1.864   3.987   8.380
  730    HZ1  LYS  89           HZ1      LYS  89  -0.103   6.351   8.793
  731    HZ2  LYS  89           HZ2      LYS  89  -1.345   5.907   9.752
  732    HZ3  LYS  89           HZ3      LYS  89  -0.027   4.955   9.654
  733    HA   PRO  90           HA       PRO  90   3.570   4.613   4.679
  734    HB2  PRO  90           HB2      PRO  90   5.164   5.208   2.177
  735    HB3  PRO  90           HB3      PRO  90   5.732   5.141   3.871
  736    HG2  PRO  90           HG2      PRO  90   6.201   3.069   2.174
  737    HG3  PRO  90           HG3      PRO  90   5.680   2.745   3.865
  738    HD2  PRO  90           HD2      PRO  90   4.024   2.696   1.341
  739    HD3  PRO  90           HD3      PRO  90   3.988   1.590   2.734
  740    H    VAL  91           H        VAL  91   3.373   7.003   4.763
  741    HA   VAL  91           HA       VAL  91   1.338   8.141   3.086
  742    HB   VAL  91           HB       VAL  91   1.870  10.256   4.157
  743   HG11  VAL  91          HG11      VAL  91   1.139   9.698   6.415
  744   HG12  VAL  91          HG12      VAL  91   0.298   8.703   5.217
  745   HG13  VAL  91          HG13      VAL  91   1.610   7.995   6.177
  746   HG21  VAL  91          HG21      VAL  91   4.283  10.113   4.545
  747   HG22  VAL  91          HG22      VAL  91   3.417  10.480   6.026
  748   HG23  VAL  91          HG23      VAL  91   4.037   8.834   5.759
  749    H    CYS  92           H        CYS  92   1.583   9.288   1.228
  750    HA   CYS  92           HA       CYS  92   4.200   8.790  -0.007
  751    HB2  CYS  92           HB2      CYS  92   3.136   8.948  -2.105
  752    HB3  CYS  92           HB3      CYS  92   2.211   7.902  -0.991
  753    HG   CYS  92           HG       CYS  92   0.632   9.308  -2.664
  754    H    ILE  93           H        ILE  93   5.628  10.248  -0.504
  755    HA   ILE  93           HA       ILE  93   5.047  13.102   0.103
  756    HB   ILE  93           HB       ILE  93   7.468  13.274   0.598
  757   HG12  ILE  93          HG12      ILE  93   8.716  11.190   1.186
  758   HG13  ILE  93          HG13      ILE  93   7.478  10.224   0.396
  759   HG21  ILE  93          HG21      ILE  93   5.732  12.950   2.347
  760   HG22  ILE  93          HG22      ILE  93   5.965  11.194   2.256
  761   HG23  ILE  93          HG23      ILE  93   7.287  12.243   2.804
  762   HD11  ILE  93          HD11      ILE  93   9.156  12.308  -1.060
  763   HD12  ILE  93          HD12      ILE  93   9.591  10.591  -0.910
  764   HD13  ILE  93          HD13      ILE  93   8.129  11.040  -1.780
  765    H    GLY  94           H        GLY  94   5.484  11.024  -2.548
  766    HA2  GLY  94           HA2      GLY  94   5.631  13.394  -4.258
  767    HA3  GLY  94           HA3      GLY  94   6.974  12.262  -4.423
  768    H    GLN  95           H        GLN  95   5.297  12.834  -6.543
  769    HA   GLN  95           HA       GLN  95   3.496  10.447  -6.811
  770    HB2  GLN  95           HB2      GLN  95   2.757  13.066  -7.055
  771    HB3  GLN  95           HB3      GLN  95   3.382  12.815  -8.669
  772    HG2  GLN  95           HG2      GLN  95   1.063  12.416  -8.861
  773    HG3  GLN  95           HG3      GLN  95   1.743  10.813  -8.836
  774   HE21  GLN  95          HE22      GLN  95  -0.222  13.201  -7.001
  775   HE22  GLN  95          HE21      GLN  95  -0.728  12.081  -5.758
  776    H    LYS  96           H        LYS  96   4.476   8.874  -8.085
  777    HA   LYS  96           HA       LYS  96   6.675   9.634  -9.981
  778    HB2  LYS  96           HB2      LYS  96   7.394   7.801  -8.613
  779    HB3  LYS  96           HB3      LYS  96   5.822   7.035  -8.622
  780    HG2  LYS  96           HG2      LYS  96   6.087   6.409 -11.014
  781    HG3  LYS  96           HG3      LYS  96   7.642   7.248 -11.072
  782    HD2  LYS  96           HD2      LYS  96   8.626   5.661  -9.535
  783    HD3  LYS  96           HD3      LYS  96   7.047   4.905  -9.222
  784    HE2  LYS  96           HE2      LYS  96   6.889   4.110 -11.548
  785    HE3  LYS  96           HE3      LYS  96   8.360   4.982 -11.989
  786    HZ1  LYS  96           HZ1      LYS  96   8.711   2.573 -11.548
  787    HZ2  LYS  96           HZ2      LYS  96   9.650   3.523 -10.606
  788    HZ3  LYS  96           HZ3      LYS  96   8.335   2.795  -9.962
  789    H    GLN  97           H        GLN  97   6.043   9.732 -12.222
  790    HA   GLN  97           HA       GLN  97   3.863   8.008 -12.986
  791    HB2  GLN  97           HB2      GLN  97   2.440   9.699 -14.049
  792    HB3  GLN  97           HB3      GLN  97   2.456   9.829 -12.310
  793    HG2  GLN  97           HG2      GLN  97   4.256  11.648 -13.927
  794    HG3  GLN  97           HG3      GLN  97   2.528  11.956 -13.799
  795   HE21  GLN  97          HE22      GLN  97   5.574  12.011 -12.006
  796   HE22  GLN  97          HE21      GLN  97   4.900  12.646 -10.521
  797    H    LYS  98           H        LYS  98   3.704   7.462 -15.082
  798    HA   LYS  98           HA       LYS  98   5.690   8.654 -16.977
  799    HB2  LYS  98           HB2      LYS  98   6.026   6.254 -16.793
  800    HB3  LYS  98           HB3      LYS  98   4.293   5.939 -16.929
  801    HG2  LYS  98           HG2      LYS  98   4.307   6.767 -19.262
  802    HG3  LYS  98           HG3      LYS  98   6.034   7.100 -19.160
  803    HD2  LYS  98           HD2      LYS  98   4.866   4.334 -18.620
  804    HD3  LYS  98           HD3      LYS  98   5.225   4.862 -20.256
  805    HE2  LYS  98           HE2      LYS  98   7.350   4.918 -18.060
  806    HE3  LYS  98           HE3      LYS  98   6.989   3.456 -18.985
  807    HZ1  LYS  98           HZ1      LYS  98   7.576   4.622 -21.024
  808    HZ2  LYS  98           HZ2      LYS  98   7.912   6.018 -20.224
  809    HZ3  LYS  98           HZ3      LYS  98   8.819   4.678 -19.974
  810    H    TRP  99           H        TRP  99   4.716   9.839 -18.617
  811    HA   TRP  99           HA       TRP  99   1.752  10.012 -18.515
  812    HB2  TRP  99           HB2      TRP  99   3.818  11.925 -19.576
  813    HB3  TRP  99           HB3      TRP  99   2.102  12.078 -19.878
  814    HD1  TRP  99           HD1      TRP  99   4.611  12.246 -16.958
  815    HE1  TRP  99           HE1      TRP  99   3.687  13.849 -15.198
  816    HE3  TRP  99           HE3      TRP  99  -0.132  12.836 -18.791
  817    HZ2  TRP  99           HZ2      TRP  99   1.174  15.193 -14.621
  818    HZ3  TRP  99           HZ3      TRP  99  -1.780  14.250 -17.605
  819    HH2  TRP  99           HH2      TRP  99  -1.150  15.398 -15.493
  820    H    PHE 100           H        PHE 100   0.580   9.502 -20.355
  821    HA   PHE 100           HA       PHE 100   2.083   8.329 -22.663
  822    HB2  PHE 100           HB2      PHE 100  -0.570   7.581 -21.413
  823    HB3  PHE 100           HB3      PHE 100  -0.167   7.167 -23.072
  824    HD1  PHE 100           HD2      PHE 100   1.018   6.709 -19.528
  825    HD2  PHE 100           HD1      PHE 100   1.204   5.315 -23.613
  826    HE1  PHE 100           HE2      PHE 100   2.206   4.670 -18.781
  827    HE2  PHE 100           HE1      PHE 100   2.415   3.293 -22.861
  828    HZ   PHE 100           HZ       PHE 100   2.908   2.951 -20.454
  829    H    LEU 101           H        LEU 101   1.631   9.101 -24.656
  830    HA   LEU 101           HA       LEU 101  -0.020  11.561 -24.844
  831    HB2  LEU 101           HB2      LEU 101   2.237  11.778 -25.745
  832    HB3  LEU 101           HB3      LEU 101   2.051  10.293 -26.669
  833    HG   LEU 101           HG       LEU 101   0.307  11.330 -28.070
  834   HD11  LEU 101          HD11      LEU 101  -0.057  13.776 -27.921
  835   HD12  LEU 101          HD12      LEU 101  -0.704  12.907 -26.535
  836   HD13  LEU 101          HD13      LEU 101   0.821  13.805 -26.373
  837   HD21  LEU 101          HD21      LEU 101   1.753  12.915 -29.279
  838   HD22  LEU 101          HD22      LEU 101   2.860  12.974 -27.892
  839   HD23  LEU 101          HD23      LEU 101   2.642  11.462 -28.793
  840    H    LEU 102           H        LEU 102  -2.080  10.819 -25.031
  841    HA   LEU 102           HA       LEU 102  -2.629   8.584 -26.897
  842    HB2  LEU 102           HB2      LEU 102  -4.144   9.888 -24.603
  843    HB3  LEU 102           HB3      LEU 102  -5.004   8.986 -25.846
  844    HG   LEU 102           HG       LEU 102  -2.820   7.844 -24.054
  845   HD11  LEU 102          HD11      LEU 102  -4.778   8.149 -22.771
  846   HD12  LEU 102          HD12      LEU 102  -5.848   7.667 -24.086
  847   HD13  LEU 102          HD13      LEU 102  -4.829   6.458 -23.274
  848   HD21  LEU 102          HD21      LEU 102  -2.550   6.603 -25.927
  849   HD22  LEU 102          HD22      LEU 102  -3.883   5.673 -25.236
  850   HD23  LEU 102          HD23      LEU 102  -4.171   6.859 -26.557
  851    H    GLN 103           H        GLN 103  -3.500   8.925 -28.814
  852    HA   GLN 103           HA       GLN 103  -4.483  11.687 -29.434
  853    HB2  GLN 103           HB2      GLN 103  -3.916   9.273 -31.195
  854    HB3  GLN 103           HB3      GLN 103  -4.794  10.692 -31.771
  855    HG2  GLN 103           HG2      GLN 103  -1.969  10.718 -30.609
  856    HG3  GLN 103           HG3      GLN 103  -2.365  10.770 -32.328
  857   HE21  GLN 103          HE22      GLN 103  -0.807  12.782 -30.823
  858   HE22  GLN 103          HE21      GLN 103  -1.731  14.268 -31.008
  859    H    LEU 104           H        LEU 104  -6.669  12.071 -29.638
  860    HA   LEU 104           HA       LEU 104  -8.440  10.150 -28.396
  861    HB2  LEU 104           HB2      LEU 104  -8.633  12.697 -28.334
  862    HB3  LEU 104           HB3      LEU 104  -9.111  12.648 -30.027
  863    HG   LEU 104           HG       LEU 104 -11.118  11.288 -29.411
  864   HD11  LEU 104          HD11      LEU 104 -10.030  11.643 -26.578
  865   HD12  LEU 104          HD12      LEU 104 -11.703  11.215 -26.922
  866   HD13  LEU 104          HD13      LEU 104 -10.426  10.115 -27.405
  867   HD21  LEU 104          HD21      LEU 104 -11.189  13.770 -29.546
  868   HD22  LEU 104          HD22      LEU 104 -12.325  13.155 -28.332
  869   HD23  LEU 104          HD23      LEU 104 -10.784  13.876 -27.812
  870    H    VAL 105           H        VAL 105  -9.721   8.591 -29.409
  871    HA   VAL 105           HA       VAL 105  -9.764   8.546 -32.399
  872    HB   VAL 105           HB       VAL 105  -9.840   6.227 -30.438
  873   HG11  VAL 105          HG11      VAL 105  -9.764   4.779 -32.416
  874   HG12  VAL 105          HG12      VAL 105 -11.253   5.717 -32.330
  875   HG13  VAL 105          HG13      VAL 105  -9.969   6.202 -33.466
  876   HG21  VAL 105          HG21      VAL 105  -7.710   5.564 -31.435
  877   HG22  VAL 105          HG22      VAL 105  -7.712   7.007 -32.472
  878   HG23  VAL 105          HG23      VAL 105  -7.543   7.163 -30.711
  879    H    SER 106           H        SER 106 -11.522   7.981 -29.309
  880    HA   SER 106           HA       SER 106 -14.053   8.749 -30.669
  881    HB2  SER 106           HB2      SER 106 -13.708   6.441 -28.730
  882    HB3  SER 106           HB3      SER 106 -15.212   6.946 -29.519
  883    HG   SER 106           HG       SER 106 -14.367   5.193 -30.663
  884    H    GLY 107           H        GLY 107 -14.998  10.380 -29.505
  885    HA2  GLY 107           HA2      GLY 107 -15.135  10.498 -26.676
  886    HA3  GLY 107           HA3      GLY 107 -13.792  11.514 -27.223
  887    H    ASP 108           H        ASP 108 -15.267  13.095 -26.176
  888    HA   ASP 108           HA       ASP 108 -16.585  14.834 -26.059
  889    HB2  ASP 108           HB2      ASP 108 -15.651  15.629 -28.115
  890    HB3  ASP 108           HB3      ASP 108 -16.782  14.668 -29.069
  891    H    ALA 109           H        ALA 109 -18.018  12.543 -28.372
  892    HA   ALA 109           HA       ALA 109 -20.693  12.821 -27.160
  893    HB1  ALA 109           HB1      ALA 109 -21.371  11.201 -28.883
  894    HB2  ALA 109           HB2      ALA 109 -20.488  12.561 -29.604
  895    HB3  ALA 109           HB3      ALA 109 -19.680  10.987 -29.377
  896    H    GLU 110           H        GLU 110 -17.959  10.524 -27.202
  897    HA   GLU 110           HA       GLU 110 -19.506   8.601 -25.623
  898    HB2  GLU 110           HB2      GLU 110 -17.000   8.284 -27.300
  899    HB3  GLU 110           HB3      GLU 110 -17.742   6.991 -26.345
  900    HG2  GLU 110           HG2      GLU 110 -19.888   7.311 -27.587
  901    HG3  GLU 110           HG3      GLU 110 -19.113   8.532 -28.592
  902    H    ILE 111           H        ILE 111 -17.421  11.069 -24.874
  903    HA   ILE 111           HA       ILE 111 -15.983   9.753 -22.668
  904    HB   ILE 111           HB       ILE 111 -16.161  12.487 -23.858
  905   HG12  ILE 111          HG12      ILE 111 -13.898  10.829 -22.741
  906   HG13  ILE 111          HG13      ILE 111 -14.365  11.015 -24.443
  907   HG21  ILE 111          HG21      ILE 111 -15.232  13.650 -21.938
  908   HG22  ILE 111          HG22      ILE 111 -16.777  12.971 -21.486
  909   HG23  ILE 111          HG23      ILE 111 -15.272  12.154 -20.962
  910   HD11  ILE 111          HD11      ILE 111 -12.451  12.378 -24.107
  911   HD12  ILE 111          HD12      ILE 111 -13.839  13.483 -24.220
  912   HD13  ILE 111          HD13      ILE 111 -13.113  13.103 -22.634
  913    H    ASN 112           H        ASN 112 -16.656   9.823 -20.526
  914    HA   ASN 112           HA       ASN 112 -19.569  10.453 -20.089
  915    HB2  ASN 112           HB2      ASN 112 -19.492   8.116 -20.592
  916    HB3  ASN 112           HB3      ASN 112 -18.055   7.861 -19.600
  917   HD21  ASN 112          HD22      ASN 112 -21.592   8.193 -19.478
  918   HD22  ASN 112          HD21      ASN 112 -21.700   7.911 -17.755
  919    H    MET 113           H        MET 113 -16.435   9.698 -18.526
  920    HA   MET 113           HA       MET 113 -15.464  10.305 -16.633
  921    HB2  MET 113           HB2      MET 113 -17.107  12.815 -16.483
  922    HB3  MET 113           HB3      MET 113 -15.392  12.539 -16.130
  923    HG2  MET 113           HG2      MET 113 -14.967  12.258 -18.537
  924    HG3  MET 113           HG3      MET 113 -16.665  12.616 -18.865
  925    HE1  MET 113           HE1      MET 113 -13.956  14.212 -19.993
  926    HE2  MET 113           HE2      MET 113 -13.594  15.709 -19.096
  927    HE3  MET 113           HE3      MET 113 -13.161  14.136 -18.404
  928    H    GLN 114           H        GLN 114 -18.691   9.389 -16.217
  929    HA   GLN 114           HA       GLN 114 -18.363   9.594 -13.281
  930    HB2  GLN 114           HB2      GLN 114 -20.815  10.380 -14.894
  931    HB3  GLN 114           HB3      GLN 114 -20.858  10.104 -13.155
  932    HG2  GLN 114           HG2      GLN 114 -19.095  12.215 -14.483
  933    HG3  GLN 114           HG3      GLN 114 -20.686  12.513 -13.810
  934   HE21  GLN 114          HE22      GLN 114 -17.371  12.664 -13.024
  935   HE22  GLN 114          HE21      GLN 114 -17.577  12.693 -11.286
  936    H    THR 115           H        THR 115 -17.866   7.518 -15.224
  937    HA   THR 115           HA       THR 115 -19.961   5.535 -14.814
  938    HB   THR 115           HB       THR 115 -18.894   5.683 -16.964
  939    HG1  THR 115           HG1      THR 115 -19.576   3.633 -16.488
  940   HG21  THR 115          HG21      THR 115 -16.653   6.467 -16.422
  941   HG22  THR 115          HG22      THR 115 -16.270   4.920 -15.636
  942   HG23  THR 115          HG23      THR 115 -16.579   4.986 -17.383
  943    H    SER 116           H        SER 116 -16.874   6.322 -13.338
  944    HA   SER 116           HA       SER 116 -16.353   3.700 -12.276
  945    HB2  SER 116           HB2      SER 116 -14.323   5.140 -11.456
  946    HB3  SER 116           HB3      SER 116 -14.557   4.835 -13.198
  947    HG   SER 116           HG       SER 116 -14.163   7.058 -12.899
  948    H    SER 117           H        SER 117 -15.712   3.551  -9.934
  949    HA   SER 117           HA       SER 117 -17.980   4.139  -8.363
  950    HB2  SER 117           HB2      SER 117 -15.250   3.252  -7.357
  951    HB3  SER 117           HB3      SER 117 -16.827   2.946  -6.612
  952    HG   SER 117           HG       SER 117 -16.064   1.116  -7.795
  953    H    THR 118           H        THR 118 -14.850   5.770  -8.652
  954    HA   THR 118           HA       THR 118 -15.830   8.113  -7.213
  955    HB   THR 118           HB       THR 118 -13.428   8.235  -6.196
  956    HG1  THR 118           HG1      THR 118 -12.585   6.308  -7.048
  957   HG21  THR 118          HG21      THR 118 -15.451   6.333  -4.936
  958   HG22  THR 118          HG22      THR 118 -14.176   7.241  -4.103
  959   HG23  THR 118          HG23      THR 118 -15.520   8.107  -4.861
  960    HA   PRO 119           HA       PRO 119 -13.970   8.575 -11.354
  961    HB2  PRO 119           HB2      PRO 119 -15.834  10.903 -11.506
  962    HB3  PRO 119           HB3      PRO 119 -15.521   9.576 -12.677
  963    HG2  PRO 119           HG2      PRO 119 -17.798   9.669 -11.135
  964    HG3  PRO 119           HG3      PRO 119 -17.001   8.131 -11.587
  965    HD2  PRO 119           HD2      PRO 119 -16.853   9.656  -9.004
  966    HD3  PRO 119           HD3      PRO 119 -16.941   7.903  -9.305
  967    H    GLU 120           H        GLU 120 -13.571  11.057 -12.499
  968    HA   GLU 120           HA       GLU 120 -12.293  12.723 -10.423
  969    HB2  GLU 120           HB2      GLU 120 -10.558  11.272 -11.710
  970    HB3  GLU 120           HB3      GLU 120 -10.960  12.290 -13.102
  971    HG2  GLU 120           HG2      GLU 120  -9.197  13.473 -12.181
  972    HG3  GLU 120           HG3      GLU 120 -10.569  14.267 -11.422
  973    H    PHE 121           H        PHE 121 -13.243  12.660 -13.969
  974    HA   PHE 121           HA       PHE 121 -13.583  15.572 -13.661
  975    HB2  PHE 121           HB2      PHE 121 -13.335  13.813 -16.087
  976    HB3  PHE 121           HB3      PHE 121 -13.499  15.565 -16.119
  977    HD1  PHE 121           HD2      PHE 121 -11.740  16.757 -14.301
  978    HD2  PHE 121           HD1      PHE 121 -11.124  13.095 -16.475
  979    HE1  PHE 121           HE2      PHE 121  -9.306  17.102 -14.179
  980    HE2  PHE 121           HE1      PHE 121  -8.670  13.444 -16.352
  981    HZ   PHE 121           HZ       PHE 121  -7.751  15.444 -15.186
  982    H    ASP 122           H        ASP 122 -15.303  16.672 -14.896
  983    HA   ASP 122           HA       ASP 122 -17.782  15.100 -15.264
  984    HB2  ASP 122           HB2      ASP 122 -18.996  16.123 -13.679
  985    HB3  ASP 122           HB3      ASP 122 -17.454  16.428 -12.940
  986    H    GLY 123           H        GLY 123 -15.641  17.463 -16.528
  987    HA2  GLY 123           HA2      GLY 123 -17.368  17.745 -18.834
  988    HA3  GLY 123           HA3      GLY 123 -17.029  19.283 -18.011
  989    H    TRP 124           H        TRP 124 -16.162  18.317 -20.675
  990    HA   TRP 124           HA       TRP 124 -13.205  18.385 -20.346
  991    HB2  TRP 124           HB2      TRP 124 -13.142  17.351 -22.580
  992    HB3  TRP 124           HB3      TRP 124 -13.894  16.323 -21.372
  993    HD1  TRP 124           HD1      TRP 124 -14.502  17.837 -24.727
  994    HE1  TRP 124           HE1      TRP 124 -16.872  17.362 -25.578
  995    HE3  TRP 124           HE3      TRP 124 -16.492  15.822 -20.461
  996    HZ2  TRP 124           HZ2      TRP 124 -19.386  16.436 -24.458
  997    HZ3  TRP 124           HZ3      TRP 124 -18.880  15.167 -20.373
  998    HH2  TRP 124           HH2      TRP 124 -20.338  15.480 -22.364
  999    H    ARG 125           H        ARG 125 -12.032  19.804 -21.624
 1000    HA   ARG 125           HA       ARG 125 -13.361  21.560 -23.606
 1001    HB2  ARG 125           HB2      ARG 125 -13.525  22.786 -21.453
 1002    HB3  ARG 125           HB3      ARG 125 -11.806  22.518 -21.160
 1003    HG2  ARG 125           HG2      ARG 125 -11.329  23.895 -23.253
 1004    HG3  ARG 125           HG3      ARG 125 -13.054  24.289 -23.303
 1005    HD2  ARG 125           HD2      ARG 125 -12.918  25.325 -21.088
 1006    HD3  ARG 125           HD3      ARG 125 -11.254  24.742 -20.887
 1007    HE   ARG 125           HE       ARG 125 -11.821  26.536 -23.166
 1008   HH11  ARG 125          HH11      ARG 125 -10.578  26.334 -19.834
 1009   HH12  ARG 125          HH12      ARG 125  -9.554  27.724 -19.982
 1010   HH21  ARG 125          HH21      ARG 125 -10.546  28.443 -23.324
 1011   HH22  ARG 125          HH22      ARG 125  -9.600  28.981 -21.986
 1012    H    TRP 126           H        TRP 126 -11.996  21.081 -25.453
 1013    HA   TRP 126           HA       TRP 126  -9.196  20.436 -24.926
 1014    HB2  TRP 126           HB2      TRP 126 -10.468  20.945 -27.608
 1015    HB3  TRP 126           HB3      TRP 126  -9.012  20.026 -27.245
 1016    HD1  TRP 126           HD1      TRP 126 -12.080  19.230 -28.563
 1017    HE1  TRP 126           HE1      TRP 126 -13.214  17.102 -27.747
 1018    HE3  TRP 126           HE3      TRP 126  -9.333  18.420 -24.303
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.023  15.301 -25.490
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.947  16.589 -22.771
 1021    HH2  TRP 126           HH2      TRP 126 -11.775  15.025 -23.338
 1022    H    VAL 127           H        VAL 127  -7.495  21.808 -25.028
 1023    HA   VAL 127           HA       VAL 127  -8.018  24.691 -25.600
 1024    HB   VAL 127           HB       VAL 127  -6.553  25.173 -23.645
 1025   HG11  VAL 127          HG11      VAL 127  -8.221  24.874 -21.935
 1026   HG12  VAL 127          HG12      VAL 127  -9.034  25.240 -23.469
 1027   HG13  VAL 127          HG13      VAL 127  -9.007  23.570 -22.849
 1028   HG21  VAL 127          HG21      VAL 127  -6.856  22.199 -23.001
 1029   HG22  VAL 127          HG22      VAL 127  -5.350  23.051 -23.421
 1030   HG23  VAL 127          HG23      VAL 127  -6.203  23.423 -21.916
 1031    H    SER 128           H        SER 128  -6.017  25.932 -26.101
 1032    HA   SER 128           HA       SER 128  -4.403  24.747 -28.040
 1033    HB2  SER 128           HB2      SER 128  -3.598  27.047 -26.219
 1034    HB3  SER 128           HB3      SER 128  -3.013  26.726 -27.857
 1035    HG   SER 128           HG       SER 128  -4.686  28.333 -27.841
 1036    H    TYR 129           H        TYR 129  -2.172  24.162 -28.064
 1037    HA   TYR 129           HA       TYR 129  -1.296  22.509 -25.918
 1038    HB2  TYR 129           HB2      TYR 129  -0.601  22.858 -28.548
 1039    HB3  TYR 129           HB3      TYR 129   0.751  23.675 -27.760
 1040    HD1  TYR 129           HD2      TYR 129   2.239  22.304 -26.181
 1041    HD2  TYR 129           HD1      TYR 129  -0.986  20.535 -28.447
 1042    HE1  TYR 129           HE2      TYR 129   3.042  20.039 -25.577
 1043    HE2  TYR 129           HE1      TYR 129  -0.218  18.294 -27.784
 1044    HH   TYR 129           HH       TYR 129   1.283  17.047 -26.514
 1045    H    TRP 130           H        TRP 130   0.456  22.918 -24.431
 1046    HA   TRP 130           HA       TRP 130   1.485  24.003 -22.793
 1047    HB2  TRP 130           HB2      TRP 130   1.431  26.632 -24.244
 1048    HB3  TRP 130           HB3      TRP 130   2.614  26.013 -23.108
 1049    HD1  TRP 130           HD1      TRP 130   1.757  26.152 -26.743
 1050    HE1  TRP 130           HE1      TRP 130   3.415  24.885 -28.169
 1051    HE3  TRP 130           HE3      TRP 130   4.402  23.924 -22.985
 1052    HZ2  TRP 130           HZ2      TRP 130   5.831  23.242 -27.711
 1053    HZ3  TRP 130           HZ3      TRP 130   6.394  22.533 -23.496
 1054    HH2  TRP 130           HH2      TRP 130   7.123  22.227 -25.840
 1055    H    TYR 131           H        TYR 131  -1.681  25.238 -23.706
 1056    HA   TYR 131           HA       TYR 131  -1.940  27.255 -21.774
 1057    HB2  TYR 131           HB2      TYR 131  -3.551  26.993 -23.519
 1058    HB3  TYR 131           HB3      TYR 131  -4.056  25.424 -22.948
 1059    HD1  TYR 131           HD1      TYR 131  -5.381  25.180 -20.828
 1060    HD2  TYR 131           HD2      TYR 131  -4.392  29.041 -22.492
 1061    HE1  TYR 131           HE1      TYR 131  -7.184  26.204 -19.504
 1062    HE2  TYR 131           HE2      TYR 131  -6.191  30.079 -21.155
 1063    HH   TYR 131           HH       TYR 131  -7.913  29.733 -19.595
 1064    HA   PRO 132           HA       PRO 132  -3.373  24.060 -18.486
 1065    HB2  PRO 132           HB2      PRO 132  -1.873  21.614 -19.366
 1066    HB3  PRO 132           HB3      PRO 132  -3.409  21.748 -18.468
 1067    HG2  PRO 132           HG2      PRO 132  -3.463  21.176 -21.090
 1068    HG3  PRO 132           HG3      PRO 132  -4.589  22.419 -20.447
 1069    HD2  PRO 132           HD2      PRO 132  -1.888  22.860 -21.793
 1070    HD3  PRO 132           HD3      PRO 132  -3.451  23.624 -22.156
 1071    H    VAL 133           H        VAL 133  -0.067  24.124 -19.843
 1072    HA   VAL 133           HA       VAL 133   1.364  23.489 -17.453
 1073    HB   VAL 133           HB       VAL 133   2.152  25.367 -19.734
 1074   HG11  VAL 133          HG11      VAL 133   3.660  25.685 -17.858
 1075   HG12  VAL 133          HG12      VAL 133   3.910  23.924 -17.719
 1076   HG13  VAL 133          HG13      VAL 133   4.479  24.820 -19.152
 1077   HG21  VAL 133          HG21      VAL 133   3.358  23.396 -20.670
 1078   HG22  VAL 133          HG22      VAL 133   2.689  22.390 -19.361
 1079   HG23  VAL 133          HG23      VAL 133   1.622  23.107 -20.596
 1080    H    ARG 134           H        ARG 134  -0.195  26.514 -18.631
 1081    HA   ARG 134           HA       ARG 134   0.804  27.934 -16.239
 1082    HB2  ARG 134           HB2      ARG 134  -1.075  28.908 -18.423
 1083    HB3  ARG 134           HB3      ARG 134  -0.292  29.889 -17.185
 1084    HG2  ARG 134           HG2      ARG 134   0.985  28.506 -19.564
 1085    HG3  ARG 134           HG3      ARG 134   0.889  30.227 -19.223
 1086    HD2  ARG 134           HD2      ARG 134   2.617  28.150 -17.820
 1087    HD3  ARG 134           HD3      ARG 134   3.172  29.445 -18.855
 1088    HE   ARG 134           HE       ARG 134   2.519  29.559 -16.031
 1089   HH11  ARG 134          HH21      ARG 134   2.838  31.595 -18.942
 1090   HH12  ARG 134          HH22      ARG 134   3.053  33.060 -18.058
 1091   HH21  ARG 134          HH11      ARG 134   2.743  31.537 -14.865
 1092   HH22  ARG 134          HH12      ARG 134   3.004  33.020 -15.704
 1093    H    GLN 135           H        GLN 135  -1.953  25.935 -16.981
 1094    HA   GLN 135           HA       GLN 135  -3.630  27.348 -15.010
 1095    HB2  GLN 135           HB2      GLN 135  -4.134  24.663 -16.331
 1096    HB3  GLN 135           HB3      GLN 135  -5.261  25.622 -15.379
 1097    HG2  GLN 135           HG2      GLN 135  -4.406  25.972 -18.208
 1098    HG3  GLN 135           HG3      GLN 135  -5.989  26.116 -17.484
 1099   HE21  GLN 135          HE22      GLN 135  -3.408  27.844 -18.827
 1100   HE22  GLN 135          HE21      GLN 135  -3.841  29.449 -18.255
 1101    H    VAL 136           H        VAL 136  -1.456  24.478 -15.040
 1102    HA   VAL 136           HA       VAL 136  -2.479  23.439 -12.600
 1103    HB   VAL 136           HB       VAL 136  -0.437  22.094 -12.569
 1104   HG11  VAL 136          HG11      VAL 136  -2.372  21.333 -13.728
 1105   HG12  VAL 136          HG12      VAL 136  -1.847  22.115 -15.240
 1106   HG13  VAL 136          HG13      VAL 136  -0.912  20.769 -14.533
 1107   HG21  VAL 136          HG21      VAL 136   1.155  23.743 -13.610
 1108   HG22  VAL 136          HG22      VAL 136   1.212  22.124 -14.331
 1109   HG23  VAL 136          HG23      VAL 136   0.366  23.437 -15.171
 1110    H    VAL 137           H        VAL 137  -1.209  23.124 -10.605
 1111    HA   VAL 137           HA       VAL 137  -0.492  25.570  -9.348
 1112    HB   VAL 137           HB       VAL 137   0.280  24.080  -7.499
 1113   HG11  VAL 137          HG11      VAL 137  -1.951  23.248  -6.919
 1114   HG12  VAL 137          HG12      VAL 137  -2.074  24.846  -7.666
 1115   HG13  VAL 137          HG13      VAL 137  -2.484  23.396  -8.601
 1116   HG21  VAL 137          HG21      VAL 137   1.073  22.130  -8.711
 1117   HG22  VAL 137          HG22      VAL 137  -0.218  21.649  -7.607
 1118   HG23  VAL 137          HG23      VAL 137  -0.558  21.775  -9.337
 1119    H    SER 138           H        SER 138   1.477  26.320  -8.560
 1120    HA   SER 138           HA       SER 138   3.344  26.641 -10.479
 1121    HB2  SER 138           HB2      SER 138   3.890  26.933  -7.503
 1122    HB3  SER 138           HB3      SER 138   4.547  27.907  -8.831
 1123    HG   SER 138           HG       SER 138   2.800  28.978  -7.768
 1124    H    PHE 139           H        PHE 139   3.553  24.150  -7.835
 1125    HA   PHE 139           HA       PHE 139   6.319  23.607  -8.528
 1126    HB2  PHE 139           HB2      PHE 139   6.274  21.907  -6.894
 1127    HB3  PHE 139           HB3      PHE 139   5.424  23.299  -6.259
 1128    HD1  PHE 139           HD1      PHE 139   2.946  23.229  -5.901
 1129    HD2  PHE 139           HD2      PHE 139   5.161  19.789  -7.286
 1130    HE1  PHE 139           HE1      PHE 139   1.007  21.775  -5.406
 1131    HE2  PHE 139           HE2      PHE 139   3.244  18.338  -6.734
 1132    HZ   PHE 139           HZ       PHE 139   1.136  19.335  -5.842
 1133    H    LYS 140           H        LYS 140   3.243  22.463  -9.797
 1134    HA   LYS 140           HA       LYS 140   4.532  20.135 -11.106
 1135    HB2  LYS 140           HB2      LYS 140   1.653  21.128 -11.222
 1136    HB3  LYS 140           HB3      LYS 140   2.295  19.695 -12.051
 1137    HG2  LYS 140           HG2      LYS 140   3.059  18.834  -9.771
 1138    HG3  LYS 140           HG3      LYS 140   2.104  20.143  -9.055
 1139    HD2  LYS 140           HD2      LYS 140   0.105  19.235 -10.405
 1140    HD3  LYS 140           HD3      LYS 140   1.144  17.853 -10.818
 1141    HE2  LYS 140           HE2      LYS 140   1.513  17.663  -8.219
 1142    HE3  LYS 140           HE3      LYS 140   0.094  18.716  -8.087
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.634  16.436  -7.993
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.106  16.986  -9.465
 1145    HZ3  LYS 140           HZ3      LYS 140   0.215  16.005  -9.329
 1146    H    ARG 141           H        ARG 141   3.522  23.419 -11.959
 1147    HA   ARG 141           HA       ARG 141   3.333  23.428 -14.691
 1148    HB2  ARG 141           HB2      ARG 141   3.238  25.440 -13.274
 1149    HB3  ARG 141           HB3      ARG 141   4.945  25.277 -12.862
 1150    HG2  ARG 141           HG2      ARG 141   5.562  25.820 -15.225
 1151    HG3  ARG 141           HG3      ARG 141   3.848  26.022 -15.595
 1152    HD2  ARG 141           HD2      ARG 141   4.791  28.207 -15.204
 1153    HD3  ARG 141           HD3      ARG 141   3.684  27.811 -13.895
 1154    HE   ARG 141           HE       ARG 141   5.416  27.735 -12.379
 1155   HH11  ARG 141          HH11      ARG 141   6.833  28.057 -15.632
 1156   HH12  ARG 141          HH12      ARG 141   8.409  28.449 -15.048
 1157   HH21  ARG 141          HH21      ARG 141   7.510  28.250 -11.616
 1158   HH22  ARG 141          HH22      ARG 141   8.797  28.562 -12.719
 1159    H    ASP 142           H        ASP 142   6.545  23.385 -13.046
 1160    HA   ASP 142           HA       ASP 142   7.987  23.409 -15.534
 1161    HB2  ASP 142           HB2      ASP 142   9.058  24.182 -13.521
 1162    HB3  ASP 142           HB3      ASP 142   8.802  22.625 -12.716
 1163    H    VAL 143           H        VAL 143   6.860  20.723 -13.435
 1164    HA   VAL 143           HA       VAL 143   8.192  18.649 -14.904
 1165    HB   VAL 143           HB       VAL 143   5.586  18.477 -13.326
 1166   HG11  VAL 143          HG11      VAL 143   7.730  16.350 -13.676
 1167   HG12  VAL 143          HG12      VAL 143   6.074  16.163 -13.049
 1168   HG13  VAL 143          HG13      VAL 143   6.322  16.476 -14.755
 1169   HG21  VAL 143          HG21      VAL 143   8.429  18.242 -12.238
 1170   HG22  VAL 143          HG22      VAL 143   7.279  19.548 -11.869
 1171   HG23  VAL 143          HG23      VAL 143   6.923  17.919 -11.348
 1172    H    TYR 144           H        TYR 144   4.927  20.173 -15.097
 1173    HA   TYR 144           HA       TYR 144   4.022  18.412 -17.091
 1174    HB2  TYR 144           HB2      TYR 144   2.690  19.771 -15.426
 1175    HB3  TYR 144           HB3      TYR 144   2.912  21.166 -16.472
 1176    HD1  TYR 144           HD2      TYR 144   2.318  17.763 -18.022
 1177    HD2  TYR 144           HD1      TYR 144   0.453  21.359 -16.495
 1178    HE1  TYR 144           HE2      TYR 144   0.151  16.946 -18.765
 1179    HE2  TYR 144           HE1      TYR 144  -1.740  20.519 -17.239
 1180    HH   TYR 144           HH       TYR 144  -2.163  17.378 -18.923
 1181    H    ARG 145           H        ARG 145   5.722  21.576 -17.319
 1182    HA   ARG 145           HA       ARG 145   5.572  21.970 -20.086
 1183    HB2  ARG 145           HB2      ARG 145   6.396  23.628 -18.497
 1184    HB3  ARG 145           HB3      ARG 145   7.661  22.550 -17.922
 1185    HG2  ARG 145           HG2      ARG 145   8.781  22.597 -20.040
 1186    HG3  ARG 145           HG3      ARG 145   7.456  23.537 -20.752
 1187    HD2  ARG 145           HD2      ARG 145   9.293  25.028 -20.332
 1188    HD3  ARG 145           HD3      ARG 145   8.014  25.415 -19.166
 1189    HE   ARG 145           HE       ARG 145   9.643  23.586 -17.841
 1190   HH11  ARG 145          HH11      ARG 145  10.284  26.711 -19.429
 1191   HH12  ARG 145          HH12      ARG 145  11.587  27.126 -18.370
 1192   HH21  ARG 145          HH21      ARG 145  11.255  24.187 -16.374
 1193   HH22  ARG 145          HH22      ARG 145  12.184  25.639 -16.618
 1194    H    ARG 146           H        ARG 146   7.655  19.705 -18.147
 1195    HA   ARG 146           HA       ARG 146   9.352  19.044 -20.397
 1196    HB2  ARG 146           HB2      ARG 146   8.735  17.069 -18.168
 1197    HB3  ARG 146           HB3      ARG 146  10.163  17.175 -19.176
 1198    HG2  ARG 146           HG2      ARG 146   9.379  18.862 -16.816
 1199    HG3  ARG 146           HG3      ARG 146  10.797  17.863 -17.016
 1200    HD2  ARG 146           HD2      ARG 146  11.698  19.479 -18.694
 1201    HD3  ARG 146           HD3      ARG 146  10.257  20.482 -18.479
 1202    HE   ARG 146           HE       ARG 146  10.878  21.089 -16.321
 1203   HH11  ARG 146          HH11      ARG 146  13.452  19.101 -17.825
 1204   HH12  ARG 146          HH12      ARG 146  14.610  19.468 -16.602
 1205   HH21  ARG 146          HH21      ARG 146  12.348  21.468 -14.696
 1206   HH22  ARG 146          HH22      ARG 146  13.994  20.895 -14.794
 1207    H    VAL 147           H        VAL 147   6.429  17.460 -19.011
 1208    HA   VAL 147           HA       VAL 147   6.217  15.375 -20.902
 1209    HB   VAL 147           HB       VAL 147   3.948  16.900 -19.540
 1210   HG11  VAL 147          HG11      VAL 147   3.114  15.415 -21.293
 1211   HG12  VAL 147          HG12      VAL 147   4.075  14.069 -20.652
 1212   HG13  VAL 147          HG13      VAL 147   2.723  14.746 -19.705
 1213   HG21  VAL 147          HG21      VAL 147   4.074  15.239 -17.760
 1214   HG22  VAL 147          HG22      VAL 147   5.474  14.458 -18.534
 1215   HG23  VAL 147          HG23      VAL 147   5.599  16.096 -17.852
 1216    H    MET 148           H        MET 148   4.891  18.728 -20.999
 1217    HA   MET 148           HA       MET 148   3.579  18.429 -23.472
 1218    HB2  MET 148           HB2      MET 148   4.655  20.900 -22.081
 1219    HB3  MET 148           HB3      MET 148   3.651  20.947 -23.531
 1220    HG2  MET 148           HG2      MET 148   2.454  19.192 -21.516
 1221    HG3  MET 148           HG3      MET 148   2.797  20.765 -20.844
 1222    HE1  MET 148           HE1      MET 148   0.063  19.513 -20.808
 1223    HE2  MET 148           HE2      MET 148   0.229  21.204 -20.275
 1224    HE3  MET 148           HE3      MET 148  -1.049  20.747 -21.418
 1225    H    LYS 149           H        LYS 149   6.999  19.674 -22.845
 1226    HA   LYS 149           HA       LYS 149   7.311  20.070 -25.673
 1227    HB2  LYS 149           HB2      LYS 149   9.516  20.702 -25.316
 1228    HB3  LYS 149           HB3      LYS 149   8.610  21.276 -23.937
 1229    HG2  LYS 149           HG2      LYS 149  10.616  20.561 -23.055
 1230    HG3  LYS 149           HG3      LYS 149   9.508  19.264 -22.641
 1231    HD2  LYS 149           HD2      LYS 149  10.511  17.767 -24.245
 1232    HD3  LYS 149           HD3      LYS 149  11.282  19.103 -25.116
 1233    HE2  LYS 149           HE2      LYS 149  12.771  19.521 -23.193
 1234    HE3  LYS 149           HE3      LYS 149  11.958  18.262 -22.256
 1235    HZ1  LYS 149           HZ1      LYS 149  12.723  16.622 -23.864
 1236    HZ2  LYS 149           HZ2      LYS 149  13.468  17.783 -24.774
 1237    HZ3  LYS 149           HZ3      LYS 149  14.012  17.455 -23.269
 1238    H    GLU 150           H        GLU 150   7.742  17.192 -23.701
 1239    HA   GLU 150           HA       GLU 150   9.285  15.735 -25.645
 1240    HB2  GLU 150           HB2      GLU 150   7.444  14.918 -23.363
 1241    HB3  GLU 150           HB3      GLU 150   8.230  13.726 -24.380
 1242    HG2  GLU 150           HG2      GLU 150   9.708  15.844 -22.762
 1243    HG3  GLU 150           HG3      GLU 150   9.423  14.194 -22.229
 1244    H    PHE 151           H        PHE 151   5.834  16.488 -25.363
 1245    HA   PHE 151           HA       PHE 151   5.172  14.559 -27.532
 1246    HB2  PHE 151           HB2      PHE 151   3.532  15.970 -25.419
 1247    HB3  PHE 151           HB3      PHE 151   2.855  14.936 -26.668
 1248    HD1  PHE 151           HD2      PHE 151   5.480  12.898 -26.248
 1249    HD2  PHE 151           HD1      PHE 151   2.345  14.579 -23.796
 1250    HE1  PHE 151           HE2      PHE 151   5.659  10.995 -24.716
 1251    HE2  PHE 151           HE1      PHE 151   2.503  12.622 -22.280
 1252    HZ   PHE 151           HZ       PHE 151   4.168  10.844 -22.719
 1253    H    ALA 152           H        ALA 152   5.257  18.012 -26.902
 1254    HA   ALA 152           HA       ALA 152   3.345  18.979 -28.553
 1255    HB1  ALA 152           HB1      ALA 152   4.811  20.980 -28.879
 1256    HB2  ALA 152           HB2      ALA 152   4.775  20.443 -27.192
 1257    HB3  ALA 152           HB3      ALA 152   6.183  20.069 -28.209
 1258    H    SER 153           H        SER 153   6.745  18.296 -29.688
 1259    HA   SER 153           HA       SER 153   6.106  18.868 -32.347
 1260    HB2  SER 153           HB2      SER 153   8.248  16.893 -31.568
 1261    HB3  SER 153           HB3      SER 153   8.212  18.045 -32.925
 1262    HG   SER 153           HG       SER 153   9.546  18.795 -31.177
 1263    H    VAL 154           H        VAL 154   5.107  16.062 -30.554
 1264    HA   VAL 154           HA       VAL 154   5.004  14.291 -32.933
 1265    HB   VAL 154           HB       VAL 154   4.065  13.783 -30.080
 1266   HG11  VAL 154          HG11      VAL 154   4.326  11.398 -30.700
 1267   HG12  VAL 154          HG12      VAL 154   3.166  12.206 -31.764
 1268   HG13  VAL 154          HG13      VAL 154   4.810  11.869 -32.339
 1269   HG21  VAL 154          HG21      VAL 154   6.803  13.172 -31.276
 1270   HG22  VAL 154          HG22      VAL 154   6.459  14.274 -29.921
 1271   HG23  VAL 154          HG23      VAL 154   6.194  12.543 -29.727
 1272    H    VAL 155           H        VAL 155   2.950  16.260 -30.786
 1273    HA   VAL 155           HA       VAL 155   0.500  15.486 -32.158
 1274    HB   VAL 155           HB       VAL 155   1.214  17.833 -30.350
 1275   HG11  VAL 155          HG11      VAL 155  -1.518  16.809 -31.292
 1276   HG12  VAL 155          HG12      VAL 155  -1.256  18.036 -30.023
 1277   HG13  VAL 155          HG13      VAL 155  -0.780  18.372 -31.694
 1278   HG21  VAL 155          HG21      VAL 155  -0.095  15.114 -29.852
 1279   HG22  VAL 155          HG22      VAL 155   1.450  15.684 -29.192
 1280   HG23  VAL 155          HG23      VAL 155  -0.050  16.415 -28.669
 1281    H    MET 156           H        MET 156   2.935  18.125 -32.427
 1282    HA   MET 156           HA       MET 156   1.621  19.606 -34.412
 1283    HB2  MET 156           HB2      MET 156   4.554  19.210 -33.793
 1284    HB3  MET 156           HB3      MET 156   4.002  20.332 -35.035
 1285    HG2  MET 156           HG2      MET 156   2.776  21.660 -33.468
 1286    HG3  MET 156           HG3      MET 156   2.959  20.465 -32.185
 1287    HE1  MET 156           HE1      MET 156   3.509  23.566 -31.774
 1288    HE2  MET 156           HE2      MET 156   3.659  22.330 -30.502
 1289    HE3  MET 156           HE3      MET 156   4.983  23.482 -30.781
 1290    H    SER 157           H        SER 157   3.240  16.448 -34.806
 1291    HA   SER 157           HA       SER 157   3.763  16.486 -37.560
 1292    HB2  SER 157           HB2      SER 157   2.483  14.295 -35.886
 1293    HB3  SER 157           HB3      SER 157   3.326  14.057 -37.425
 1294    HG   SER 157           HG       SER 157   4.774  13.612 -35.741
 1295    H    LEU 158           H        LEU 158   0.697  16.340 -35.830
 1296    HA   LEU 158           HA       LEU 158  -0.871  15.517 -38.175
 1297    HB2  LEU 158           HB2      LEU 158  -1.538  16.303 -35.318
 1298    HB3  LEU 158           HB3      LEU 158  -2.770  15.959 -36.524
 1299    HG   LEU 158           HG       LEU 158  -2.072  13.638 -36.662
 1300   HD11  LEU 158          HD11      LEU 158  -0.062  14.373 -34.485
 1301   HD12  LEU 158          HD12      LEU 158  -0.556  12.710 -34.889
 1302   HD13  LEU 158          HD13      LEU 158   0.282  13.682 -36.096
 1303   HD21  LEU 158          HD21      LEU 158  -2.595  14.703 -33.839
 1304   HD22  LEU 158          HD22      LEU 158  -3.812  14.377 -35.082
 1305   HD23  LEU 158          HD23      LEU 158  -2.899  13.033 -34.391
 1306    H    GLN 159           H        GLN 159  -0.019  18.545 -36.512
 1307    HA   GLN 159           HA       GLN 159  -2.261  19.997 -37.824
 1308    HB2  GLN 159           HB2      GLN 159  -0.740  21.326 -35.690
 1309    HB3  GLN 159           HB3      GLN 159  -2.485  21.222 -35.896
 1310    HG2  GLN 159           HG2      GLN 159  -0.631  19.181 -34.625
 1311    HG3  GLN 159           HG3      GLN 159  -1.670  20.290 -33.798
 1312   HE21  GLN 159          HE22      GLN 159  -3.394  18.938 -36.547
 1313   HE22  GLN 159          HE21      GLN 159  -4.266  17.752 -35.597
 1314    H    GLU 160           H        GLU 160   1.251  19.937 -37.546
 1315    HA   GLU 160           HA       GLU 160   1.578  22.325 -39.258
 1316    HB2  GLU 160           HB2      GLU 160   3.578  20.740 -37.599
 1317    HB3  GLU 160           HB3      GLU 160   3.927  22.210 -38.498
 1318    HG2  GLU 160           HG2      GLU 160   2.078  21.969 -36.095
 1319    HG3  GLU 160           HG3      GLU 160   3.685  22.686 -36.121
 1320    H    ASN 161           H        ASN 161   0.718  19.494 -39.962
 1321    HA   ASN 161           HA       ASN 161   2.697  17.910 -41.050
 1322    HB2  ASN 161           HB2      ASN 161   0.216  17.367 -40.639
 1323    HB3  ASN 161           HB3      ASN 161  -0.131  18.160 -42.178
 1324   HD21  ASN 161          HD22      ASN 161   1.733  15.525 -40.639
 1325   HD22  ASN 161          HD21      ASN 161   1.834  14.500 -42.068
 1326    H    THR 162           H        THR 162   1.219  20.774 -42.559
 1327    HA   THR 162           HA       THR 162   2.042  20.162 -45.200
 1328    HB   THR 162           HB       THR 162   1.742  22.877 -45.205
 1329    HG1  THR 162           HG1      THR 162   0.053  23.349 -43.790
 1330   HG21  THR 162          HG21      THR 162  -0.581  22.393 -45.950
 1331   HG22  THR 162          HG22      THR 162   0.574  21.260 -46.666
 1332   HG23  THR 162          HG23      THR 162  -0.442  20.742 -45.301
 1333    HA   PRO 163           HA       PRO 163   6.023  22.557 -44.455
 1334    HB2  PRO 163           HB2      PRO 163   6.648  23.648 -42.001
 1335    HB3  PRO 163           HB3      PRO 163   5.742  24.500 -43.283
 1336    HG2  PRO 163           HG2      PRO 163   4.632  23.007 -40.892
 1337    HG3  PRO 163           HG3      PRO 163   4.182  24.638 -41.473
 1338    HD2  PRO 163           HD2      PRO 163   2.690  22.458 -42.157
 1339    HD3  PRO 163           HD3      PRO 163   2.997  23.742 -43.341
 1340    H    LYS 164           H        LYS 164   4.887  20.439 -41.822
 1341    HA   LYS 164           HA       LYS 164   7.650  19.353 -41.525
 1342    HB2  LYS 164           HB2      LYS 164   5.257  19.013 -39.689
 1343    HB3  LYS 164           HB3      LYS 164   6.865  18.373 -39.433
 1344    HG2  LYS 164           HG2      LYS 164   6.046  21.309 -39.451
 1345    HG3  LYS 164           HG3      LYS 164   6.496  20.348 -38.052
 1346    HD2  LYS 164           HD2      LYS 164   8.350  21.206 -40.317
 1347    HD3  LYS 164           HD3      LYS 164   8.289  21.873 -38.683
 1348    HE2  LYS 164           HE2      LYS 164   8.934  19.654 -37.748
 1349    HE3  LYS 164           HE3      LYS 164   9.043  19.000 -39.386
 1350    HZ1  LYS 164           HZ1      LYS 164  10.729  21.204 -38.322
 1351    HZ2  LYS 164           HZ2      LYS 164  11.210  19.668 -38.559
 1352    HZ3  LYS 164           HZ3      LYS 164  10.822  20.599 -39.840
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1  -1.198   2.242  -3.332
    2    H2   MET   1           H2       MET   1  -1.632   1.073  -2.253
    3    H3   MET   1           H3       MET   1  -1.163   2.547  -1.727
    4    HA   MET   1           HA       MET   1   0.599   1.023  -1.347
    5    HB2  MET   1           HB2      MET   1   1.718  -0.205  -3.082
    6    HB3  MET   1           HB3      MET   1   0.024  -0.646  -3.054
    7    HG2  MET   1           HG2      MET   1  -0.376   0.757  -5.075
    8    HG3  MET   1           HG3      MET   1   1.335   1.209  -5.091
    9    HE1  MET   1           HE1      MET   1   1.018  -1.128  -8.231
   10    HE2  MET   1           HE2      MET   1  -0.224  -0.010  -7.625
   11    HE3  MET   1           HE3      MET   1   1.493   0.475  -7.636
   12    H    ILE   2           H        ILE   2   2.768   1.763  -1.317
   13    HA   ILE   2           HA       ILE   2   3.359   4.239  -2.882
   14    HB   ILE   2           HB       ILE   2   4.416   3.259  -0.193
   15   HG12  ILE   2          HG12      ILE   2   2.221   4.311   0.059
   16   HG13  ILE   2          HG13      ILE   2   3.486   5.305   0.765
   17   HG21  ILE   2          HG21      ILE   2   5.671   5.441  -0.176
   18   HG22  ILE   2          HG22      ILE   2   6.276   4.265  -1.344
   19   HG23  ILE   2          HG23      ILE   2   5.272   5.625  -1.895
   20   HD11  ILE   2          HD11      ILE   2   1.832   6.664  -0.423
   21   HD12  ILE   2          HD12      ILE   2   3.420   6.825  -1.200
   22   HD13  ILE   2          HD13      ILE   2   2.145   5.819  -1.936
   23    H    ASP   3           H        ASP   3   5.302   4.223  -4.076
   24    HA   ASP   3           HA       ASP   3   6.218   1.461  -4.670
   25    HB2  ASP   3           HB2      ASP   3   5.217   2.773  -6.459
   26    HB3  ASP   3           HB3      ASP   3   6.468   4.011  -6.271
   27    H    ASP   4           H        ASP   4   7.625   4.642  -3.772
   28    HA   ASP   4           HA       ASP   4  10.178   3.479  -3.054
   29    HB2  ASP   4           HB2      ASP   4  10.506   3.415  -5.462
   30    HB3  ASP   4           HB3      ASP   4   9.865   5.051  -5.647
   31    H    ASP   5           H        ASP   5  10.118   4.596  -1.192
   32    HA   ASP   5           HA       ASP   5  10.556   6.190   0.285
   33    HB2  ASP   5           HB2      ASP   5  12.555   6.291  -1.129
   34    HB3  ASP   5           HB3      ASP   5  11.841   7.633  -2.035
   35    H    GLY   6           H        GLY   6   7.999   6.258  -0.464
   36    HA2  GLY   6           HA2      GLY   6   6.216   7.592   0.276
   37    HA3  GLY   6           HA3      GLY   6   7.304   8.968   0.383
   38    H    TYR   7           H        TYR   7   6.870   6.970  -2.571
   39    HA   TYR   7           HA       TYR   7   5.540   9.302  -3.850
   40    HB2  TYR   7           HB2      TYR   7   7.619   7.418  -4.968
   41    HB3  TYR   7           HB3      TYR   7   6.511   8.310  -5.993
   42    HD1  TYR   7           HD2      TYR   7   8.819   8.955  -3.086
   43    HD2  TYR   7           HD1      TYR   7   7.067  10.466  -6.717
   44    HE1  TYR   7           HE2      TYR   7  10.068  11.004  -2.789
   45    HE2  TYR   7           HE1      TYR   7   8.281  12.572  -6.411
   46    HH   TYR   7           HH       TYR   7  10.596  13.158  -3.705
   47    H    ARG   8           H        ARG   8   3.711   9.034  -4.791
   48    HA   ARG   8           HA       ARG   8   2.395   6.367  -4.624
   49    HB2  ARG   8           HB2      ARG   8   1.220   8.398  -3.821
   50    HB3  ARG   8           HB3      ARG   8   1.379   9.117  -5.405
   51    HG2  ARG   8           HG2      ARG   8  -0.858   8.373  -5.263
   52    HG3  ARG   8           HG3      ARG   8  -0.086   7.169  -6.288
   53    HD2  ARG   8           HD2      ARG   8   0.141   5.655  -4.325
   54    HD3  ARG   8           HD3      ARG   8  -0.590   6.872  -3.286
   55    HE   ARG   8           HE       ARG   8  -1.893   5.141  -5.276
   56   HH11  ARG   8          HH11      ARG   8  -2.341   8.014  -3.216
   57   HH12  ARG   8          HH12      ARG   8  -4.063   7.905  -3.214
   58   HH21  ARG   8          HH21      ARG   8  -4.195   4.994  -5.242
   59   HH22  ARG   8          HH22      ARG   8  -5.133   6.179  -4.410
   60    HA   PRO   9           HA       PRO   9   3.536   6.065  -9.006
   61    HB2  PRO   9           HB2      PRO   9   2.749   3.519  -9.555
   62    HB3  PRO   9           HB3      PRO   9   4.156   3.877  -8.513
   63    HG2  PRO   9           HG2      PRO   9   1.319   3.210  -7.655
   64    HG3  PRO   9           HG3      PRO   9   2.852   2.506  -7.056
   65    HD2  PRO   9           HD2      PRO   9   1.563   4.551  -5.766
   66    HD3  PRO   9           HD3      PRO   9   3.347   4.422  -5.777
   67    H    ASN  10           H        ASN  10   2.415   6.879 -10.743
   68    HA   ASN  10           HA       ASN  10  -0.517   6.418 -10.954
   69    HB2  ASN  10           HB2      ASN  10   0.982   9.065 -11.041
   70    HB3  ASN  10           HB3      ASN  10  -0.632   8.887 -11.706
   71   HD21  ASN  10          HD22      ASN  10   1.267   8.674  -8.708
   72   HD22  ASN  10          HD21      ASN  10  -0.041   9.287  -7.714
   73    H    VAL  11           H        VAL  11  -1.355   6.992 -13.081
   74    HA   VAL  11           HA       VAL  11   0.615   7.058 -15.327
   75    HB   VAL  11           HB       VAL  11  -1.381   6.021 -16.607
   76   HG11  VAL  11          HG11      VAL  11  -0.704   3.723 -15.965
   77   HG12  VAL  11          HG12      VAL  11   0.692   4.798 -16.153
   78   HG13  VAL  11          HG13      VAL  11   0.125   4.365 -14.534
   79   HG21  VAL  11          HG21      VAL  11  -3.112   6.281 -14.793
   80   HG22  VAL  11          HG22      VAL  11  -2.929   4.617 -15.341
   81   HG23  VAL  11          HG23      VAL  11  -2.225   5.083 -13.814
   82    H    GLY  12           H        GLY  12   0.460   8.918 -16.518
   83    HA2  GLY  12           HA2      GLY  12  -1.910  10.705 -16.161
   84    HA3  GLY  12           HA3      GLY  12  -0.327  11.166 -16.803
   85    H    ILE  13           H        ILE  13  -3.475  10.638 -17.794
   86    HA   ILE  13           HA       ILE  13  -2.770   9.365 -20.384
   87    HB   ILE  13           HB       ILE  13  -5.526  10.440 -19.779
   88   HG12  ILE  13          HG12      ILE  13  -5.281   9.181 -17.770
   89   HG13  ILE  13          HG13      ILE  13  -6.357   8.360 -18.891
   90   HG21  ILE  13          HG21      ILE  13  -4.533   8.026 -21.354
   91   HG22  ILE  13          HG22      ILE  13  -6.197   8.641 -21.270
   92   HG23  ILE  13          HG23      ILE  13  -4.931   9.616 -22.028
   93   HD11  ILE  13          HD11      ILE  13  -3.456   7.583 -18.373
   94   HD12  ILE  13          HD12      ILE  13  -4.898   6.783 -17.728
   95   HD13  ILE  13          HD13      ILE  13  -4.604   6.745 -19.462
   96    H    VAL  14           H        VAL  14  -1.672  10.899 -21.676
   97    HA   VAL  14           HA       VAL  14  -2.730  13.679 -21.740
   98    HB   VAL  14           HB       VAL  14  -0.399  12.519 -23.297
   99   HG11  VAL  14          HG11      VAL  14  -1.419  14.575 -24.280
  100   HG12  VAL  14          HG12      VAL  14  -1.186  15.415 -22.729
  101   HG13  VAL  14          HG13      VAL  14   0.210  14.852 -23.679
  102   HG21  VAL  14          HG21      VAL  14   1.071  13.687 -21.708
  103   HG22  VAL  14          HG22      VAL  14  -0.335  14.069 -20.693
  104   HG23  VAL  14          HG23      VAL  14   0.176  12.372 -20.955
  105    H    ILE  15           H        ILE  15  -4.875  12.940 -22.495
  106    HA   ILE  15           HA       ILE  15  -5.110  11.636 -25.083
  107    HB   ILE  15           HB       ILE  15  -7.131  13.448 -23.706
  108   HG12  ILE  15          HG12      ILE  15  -6.682  11.353 -22.430
  109   HG13  ILE  15          HG13      ILE  15  -8.325  11.512 -23.030
  110   HG21  ILE  15          HG21      ILE  15  -7.643  13.499 -26.025
  111   HG22  ILE  15          HG22      ILE  15  -7.421  11.745 -26.189
  112   HG23  ILE  15          HG23      ILE  15  -8.790  12.405 -25.256
  113   HD11  ILE  15          HD11      ILE  15  -7.360   9.200 -23.308
  114   HD12  ILE  15          HD12      ILE  15  -7.939   9.919 -24.818
  115   HD13  ILE  15          HD13      ILE  15  -6.200   9.872 -24.481
  116    H    CYS  16           H        CYS  16  -4.830  12.410 -26.987
  117    HA   CYS  16           HA       CYS  16  -4.646  15.359 -27.465
  118    HB2  CYS  16           HB2      CYS  16  -3.364  12.992 -28.919
  119    HB3  CYS  16           HB3      CYS  16  -3.291  14.688 -29.479
  120    HG   CYS  16           HG       CYS  16  -2.415  13.404 -26.548
  121    H    ASN  17           H        ASN  17  -6.258  16.148 -28.696
  122    HA   ASN  17           HA       ASN  17  -8.390  14.227 -29.332
  123    HB2  ASN  17           HB2      ASN  17  -8.372  17.270 -29.130
  124    HB3  ASN  17           HB3      ASN  17  -9.807  16.256 -29.330
  125   HD21  ASN  17          HD22      ASN  17 -10.481  14.862 -27.623
  126   HD22  ASN  17          HD21      ASN  17  -9.957  15.155 -25.984
  127    H    ARG  18           H        ARG  18  -6.090  14.535 -31.273
  128    HA   ARG  18           HA       ARG  18  -5.632  14.726 -33.454
  129    HB2  ARG  18           HB2      ARG  18  -8.602  14.254 -33.913
  130    HB3  ARG  18           HB3      ARG  18  -7.283  14.046 -35.080
  131    HG2  ARG  18           HG2      ARG  18  -6.266  12.382 -33.423
  132    HG3  ARG  18           HG3      ARG  18  -7.836  12.391 -32.592
  133    HD2  ARG  18           HD2      ARG  18  -7.284  11.710 -35.500
  134    HD3  ARG  18           HD3      ARG  18  -7.669  10.545 -34.236
  135    HE   ARG  18           HE       ARG  18  -9.481  12.490 -35.575
  136   HH11  ARG  18          HH11      ARG  18  -9.260   9.877 -33.175
  137   HH12  ARG  18          HH12      ARG  18 -10.877   9.302 -33.449
  138   HH21  ARG  18          HH21      ARG  18 -11.684  11.891 -35.761
  139   HH22  ARG  18          HH22      ARG  18 -12.315  10.571 -34.847
  140    H    GLN  19           H        GLN  19  -7.458  17.197 -32.128
  141    HA   GLN  19           HA       GLN  19  -7.545  18.738 -34.639
  142    HB2  GLN  19           HB2      GLN  19  -8.501  19.305 -31.815
  143    HB3  GLN  19           HB3      GLN  19  -8.745  20.399 -33.176
  144    HG2  GLN  19           HG2      GLN  19 -10.335  19.067 -34.201
  145    HG3  GLN  19           HG3      GLN  19  -9.731  17.570 -33.504
  146   HE21  GLN  19          HE22      GLN  19 -10.493  16.845 -31.504
  147   HE22  GLN  19          HE21      GLN  19 -11.691  17.719 -30.545
  148    H    GLY  20           H        GLY  20  -5.026  18.141 -32.540
  149    HA2  GLY  20           HA2      GLY  20  -2.987  19.313 -32.282
  150    HA3  GLY  20           HA3      GLY  20  -3.716  20.778 -32.946
  151    H    GLN  21           H        GLN  21  -5.121  18.826 -30.321
  152    HA   GLN  21           HA       GLN  21  -4.770  20.967 -28.352
  153    HB2  GLN  21           HB2      GLN  21  -7.473  20.222 -29.587
  154    HB3  GLN  21           HB3      GLN  21  -7.328  20.849 -27.961
  155    HG2  GLN  21           HG2      GLN  21  -7.716  22.822 -28.976
  156    HG3  GLN  21           HG3      GLN  21  -5.971  22.827 -29.133
  157   HE21  GLN  21          HE22      GLN  21  -5.071  22.829 -31.294
  158   HE22  GLN  21          HE21      GLN  21  -6.050  22.634 -32.724
  159    H    VAL  22           H        VAL  22  -5.448  20.154 -26.209
  160    HA   VAL  22           HA       VAL  22  -5.229  17.181 -26.098
  161    HB   VAL  22           HB       VAL  22  -3.633  17.462 -24.277
  162   HG11  VAL  22          HG11      VAL  22  -2.879  17.206 -26.649
  163   HG12  VAL  22          HG12      VAL  22  -2.662  18.972 -26.741
  164   HG13  VAL  22          HG13      VAL  22  -1.708  18.006 -25.599
  165   HG21  VAL  22          HG21      VAL  22  -4.353  19.750 -23.510
  166   HG22  VAL  22          HG22      VAL  22  -2.618  19.566 -23.708
  167   HG23  VAL  22          HG23      VAL  22  -3.561  20.445 -24.940
  168    H    MET  23           H        MET  23  -5.566  16.294 -24.003
  169    HA   MET  23           HA       MET  23  -8.028  16.508 -22.881
  170    HB2  MET  23           HB2      MET  23  -6.125  14.785 -22.495
  171    HB3  MET  23           HB3      MET  23  -5.501  15.868 -21.282
  172    HG2  MET  23           HG2      MET  23  -6.855  14.180 -20.207
  173    HG3  MET  23           HG3      MET  23  -7.656  15.740 -20.047
  174    HE1  MET  23           HE1      MET  23 -10.877  13.669 -20.271
  175    HE2  MET  23           HE2      MET  23  -9.408  13.225 -19.368
  176    HE3  MET  23           HE3      MET  23  -9.954  14.919 -19.411
  177    H    TRP  24           H        TRP  24  -9.063  18.043 -21.666
  178    HA   TRP  24           HA       TRP  24  -7.848  18.994 -19.292
  179    HB2  TRP  24           HB2      TRP  24  -7.247  20.711 -21.210
  180    HB3  TRP  24           HB3      TRP  24  -8.915  21.231 -21.020
  181    HD1  TRP  24           HD1      TRP  24  -8.859  23.353 -19.643
  182    HE1  TRP  24           HE1      TRP  24  -7.635  24.247 -17.582
  183    HE3  TRP  24           HE3      TRP  24  -5.704  19.412 -18.832
  184    HZ2  TRP  24           HZ2      TRP  24  -5.691  23.210 -15.612
  185    HZ3  TRP  24           HZ3      TRP  24  -4.223  19.372 -16.863
  186    HH2  TRP  24           HH2      TRP  24  -4.295  21.199 -15.210
  187    H    ALA  25           H        ALA  25  -9.504  19.149 -17.776
  188    HA   ALA  25           HA       ALA  25 -12.291  19.150 -18.633
  189    HB1  ALA  25           HB1      ALA  25 -12.706  16.892 -17.549
  190    HB2  ALA  25           HB2      ALA  25 -11.790  16.814 -19.072
  191    HB3  ALA  25           HB3      ALA  25 -10.950  16.652 -17.517
  192    H    ARG  26           H        ARG  26 -13.739  19.375 -16.930
  193    HA   ARG  26           HA       ARG  26 -12.697  21.028 -14.784
  194    HB2  ARG  26           HB2      ARG  26 -14.812  21.447 -16.094
  195    HB3  ARG  26           HB3      ARG  26 -15.549  20.064 -15.273
  196    HG2  ARG  26           HG2      ARG  26 -15.090  21.247 -13.061
  197    HG3  ARG  26           HG3      ARG  26 -14.505  22.634 -13.989
  198    HD2  ARG  26           HD2      ARG  26 -17.318  21.463 -13.963
  199    HD3  ARG  26           HD3      ARG  26 -16.802  23.007 -13.296
  200    HE   ARG  26           HE       ARG  26 -16.387  23.843 -15.520
  201   HH11  ARG  26          HH11      ARG  26 -18.401  20.844 -15.445
  202   HH12  ARG  26          HH12      ARG  26 -19.154  21.216 -16.950
  203   HH21  ARG  26          HH21      ARG  26 -17.422  24.256 -17.510
  204   HH22  ARG  26          HH22      ARG  26 -18.582  23.156 -18.154
  205    H    ARG  27           H        ARG  27 -12.585  20.502 -12.595
  206    HA   ARG  27           HA       ARG  27 -12.528  17.674 -11.982
  207    HB2  ARG  27           HB2      ARG  27 -10.687  19.068 -11.328
  208    HB3  ARG  27           HB3      ARG  27 -11.728  20.161 -10.427
  209    HG2  ARG  27           HG2      ARG  27 -10.341  18.645  -9.029
  210    HG3  ARG  27           HG3      ARG  27 -12.067  18.565  -8.676
  211    HD2  ARG  27           HD2      ARG  27 -12.330  16.451  -9.629
  212    HD3  ARG  27           HD3      ARG  27 -10.870  16.614 -10.624
  213    HE   ARG  27           HE       ARG  27  -9.631  15.710  -8.993
  214   HH11  ARG  27          HH21      ARG  27 -12.697  16.638  -7.330
  215   HH12  ARG  27          HH22      ARG  27 -12.195  15.877  -5.860
  216   HH21  ARG  27          HH11      ARG  27  -9.135  14.670  -7.251
  217   HH22  ARG  27          HH12      ARG  27 -10.085  14.709  -5.776
  218    H    PHE  28           H        PHE  28 -14.180  16.611 -11.129
  219    HA   PHE  28           HA       PHE  28 -16.653  17.571 -10.163
  220    HB2  PHE  28           HB2      PHE  28 -16.227  15.274 -10.888
  221    HB3  PHE  28           HB3      PHE  28 -14.982  15.069  -9.671
  222    HD1  PHE  28           HD1      PHE  28 -18.656  15.978  -9.783
  223    HD2  PHE  28           HD2      PHE  28 -15.513  13.688  -7.899
  224    HE1  PHE  28           HE1      PHE  28 -20.330  14.872  -8.316
  225    HE2  PHE  28           HE2      PHE  28 -17.205  12.524  -6.500
  226    HZ   PHE  28           HZ       PHE  28 -19.611  13.149  -6.677
  227    H    GLY  29           H        GLY  29 -17.310  18.242  -8.120
  228    HA2  GLY  29           HA2      GLY  29 -17.279  18.711  -5.883
  229    HA3  GLY  29           HA3      GLY  29 -15.731  17.874  -5.728
  230    H    GLN  30           H        GLN  30 -14.223  19.482  -7.643
  231    HA   GLN  30           HA       GLN  30 -13.719  21.792  -5.913
  232    HB2  GLN  30           HB2      GLN  30 -12.022  20.093  -6.844
  233    HB3  GLN  30           HB3      GLN  30 -12.196  20.947  -8.387
  234    HG2  GLN  30           HG2      GLN  30 -11.468  23.053  -7.217
  235    HG3  GLN  30           HG3      GLN  30 -11.242  22.107  -5.743
  236   HE21  GLN  30          HE22      GLN  30 -10.027  22.655  -9.071
  237   HE22  GLN  30          HE21      GLN  30  -8.525  21.768  -8.868
  238    H    HIS  31           H        HIS  31 -14.981  21.121  -9.158
  239    HA   HIS  31           HA       HIS  31 -15.787  22.333 -10.812
  240    HB2  HIS  31           HB2      HIS  31 -16.614  24.298  -8.663
  241    HB3  HIS  31           HB3      HIS  31 -17.273  24.191 -10.295
  242    HD1  HIS  31           HD1      HIS  31 -18.859  21.997 -10.817
  243    HD2  HIS  31           HD2      HIS  31 -17.439  22.465  -6.879
  244    HE1  HIS  31           HE1      HIS  31 -20.165  20.350  -9.381
  245    H    SER  32           H        SER  32 -13.055  22.522 -10.598
  246    HA   SER  32           HA       SER  32 -12.685  24.859 -12.302
  247    HB2  SER  32           HB2      SER  32 -10.510  25.444 -11.148
  248    HB3  SER  32           HB3      SER  32 -11.983  25.869 -10.269
  249    HG   SER  32           HG       SER  32 -10.580  24.938  -8.837
  250    H    TRP  33           H        TRP  33 -10.328  24.513 -13.385
  251    HA   TRP  33           HA       TRP  33 -10.651  21.821 -14.471
  252    HB2  TRP  33           HB2      TRP  33  -8.773  24.024 -15.336
  253    HB3  TRP  33           HB3      TRP  33  -9.252  22.580 -16.241
  254    HD1  TRP  33           HD1      TRP  33 -10.587  26.007 -15.162
  255    HE1  TRP  33           HE1      TRP  33 -12.775  26.538 -16.352
  256    HE3  TRP  33           HE3      TRP  33 -11.152  21.650 -17.766
  257    HZ2  TRP  33           HZ2      TRP  33 -14.623  25.194 -18.143
  258    HZ3  TRP  33           HZ3      TRP  33 -13.178  21.270 -19.169
  259    HH2  TRP  33           HH2      TRP  33 -14.917  23.032 -19.351
  260    H    GLN  34           H        GLN  34  -8.980  20.206 -14.694
  261    HA   GLN  34           HA       GLN  34  -6.574  20.526 -13.024
  262    HB2  GLN  34           HB2      GLN  34  -8.554  19.726 -11.572
  263    HB3  GLN  34           HB3      GLN  34  -8.516  18.243 -12.530
  264    HG2  GLN  34           HG2      GLN  34  -6.002  18.100 -11.719
  265    HG3  GLN  34           HG3      GLN  34  -6.466  19.339 -10.574
  266   HE21  GLN  34          HE22      GLN  34  -7.032  15.975 -11.671
  267   HE22  GLN  34          HE21      GLN  34  -7.740  15.411 -10.156
  268    H    PHE  35           H        PHE  35  -5.106  18.847 -13.263
  269    HA   PHE  35           HA       PHE  35  -4.811  17.559 -15.823
  270    HB2  PHE  35           HB2      PHE  35  -2.781  16.577 -14.492
  271    HB3  PHE  35           HB3      PHE  35  -2.819  18.303 -14.790
  272    HD1  PHE  35           HD2      PHE  35  -3.525  15.703 -12.154
  273    HD2  PHE  35           HD1      PHE  35  -2.872  19.886 -12.995
  274    HE1  PHE  35           HE2      PHE  35  -3.629  16.211  -9.734
  275    HE2  PHE  35           HE1      PHE  35  -2.996  20.395 -10.568
  276    HZ   PHE  35           HZ       PHE  35  -3.408  18.559  -8.936
  277    HA   PRO  36           HA       PRO  36  -6.554  13.599 -14.559
  278    HB2  PRO  36           HB2      PRO  36  -5.213  11.800 -16.122
  279    HB3  PRO  36           HB3      PRO  36  -6.319  13.018 -16.779
  280    HG2  PRO  36           HG2      PRO  36  -3.298  13.221 -16.643
  281    HG3  PRO  36           HG3      PRO  36  -4.383  13.550 -18.026
  282    HD2  PRO  36           HD2      PRO  36  -3.444  15.522 -16.379
  283    HD3  PRO  36           HD3      PRO  36  -5.051  15.605 -17.152
  284    H    GLN  37           H        GLN  37  -3.651  11.796 -14.900
  285    HA   GLN  37           HA       GLN  37  -2.251  10.713 -13.497
  286    HB2  GLN  37           HB2      GLN  37  -2.595  12.797 -11.367
  287    HB3  GLN  37           HB3      GLN  37  -1.304  11.602 -11.593
  288    HG2  GLN  37           HG2      GLN  37  -0.551  12.718 -13.629
  289    HG3  GLN  37           HG3      GLN  37  -1.869  13.885 -13.549
  290   HE21  GLN  37          HE22      GLN  37   0.763  14.683 -13.768
  291   HE22  GLN  37          HE21      GLN  37   1.252  15.482 -12.290
  292    H    GLY  38           H        GLY  38  -3.233   8.820 -13.143
  293    HA2  GLY  38           HA2      GLY  38  -5.254   8.564 -10.942
  294    HA3  GLY  38           HA3      GLY  38  -5.340   7.633 -12.446
  295    H    GLY  39           H        GLY  39  -4.883   6.715  -9.589
  296    HA2  GLY  39           HA2      GLY  39  -2.128   6.035  -9.241
  297    HA3  GLY  39           HA3      GLY  39  -3.502   5.444  -8.298
  298    H    ILE  40           H        ILE  40  -1.211   4.007  -9.384
  299    HA   ILE  40           HA       ILE  40  -2.238   2.263 -11.521
  300    HB   ILE  40           HB       ILE  40   0.293   2.229  -9.846
  301   HG12  ILE  40          HG12      ILE  40  -0.462   3.005 -12.696
  302   HG13  ILE  40          HG13      ILE  40   0.184   4.045 -11.439
  303   HG21  ILE  40          HG21      ILE  40  -0.334  -0.126 -10.439
  304   HG22  ILE  40          HG22      ILE  40  -0.373   0.349 -12.150
  305   HG23  ILE  40          HG23      ILE  40   1.139   0.412 -11.228
  306   HD11  ILE  40          HD11      ILE  40   1.664   1.904 -13.014
  307   HD12  ILE  40          HD12      ILE  40   1.908   3.652 -13.041
  308   HD13  ILE  40          HD13      ILE  40   2.362   2.725 -11.601
  309    H    ASN  41           H        ASN  41  -3.243   0.380 -11.315
  310    HA   ASN  41           HA       ASN  41  -4.421  -0.351  -8.755
  311    HB2  ASN  41           HB2      ASN  41  -5.802  -0.465 -10.721
  312    HB3  ASN  41           HB3      ASN  41  -4.584  -1.373 -11.602
  313   HD21  ASN  41          HD22      ASN  41  -6.031  -3.042 -12.122
  314   HD22  ASN  41          HD21      ASN  41  -6.616  -4.194 -10.913
  315    HA   PRO  42           HA       PRO  42  -0.929  -2.753  -7.654
  316    HB2  PRO  42           HB2      PRO  42  -2.916  -4.299  -5.961
  317    HB3  PRO  42           HB3      PRO  42  -1.272  -3.734  -5.529
  318    HG2  PRO  42           HG2      PRO  42  -3.442  -2.316  -4.738
  319    HG3  PRO  42           HG3      PRO  42  -2.014  -1.458  -5.399
  320    HD2  PRO  42           HD2      PRO  42  -4.609  -2.151  -6.787
  321    HD3  PRO  42           HD3      PRO  42  -3.643  -0.643  -6.842
  322    H    GLY  43           H        GLY  43  -0.073  -4.016  -9.013
  323    HA2  GLY  43           HA2      GLY  43   0.579  -6.142  -9.803
  324    HA3  GLY  43           HA3      GLY  43  -1.012  -6.796  -9.402
  325    H    GLU  44           H        GLU  44  -1.482  -3.864 -11.017
  326    HA   GLU  44           HA       GLU  44  -1.743  -5.169 -13.703
  327    HB2  GLU  44           HB2      GLU  44  -3.835  -4.386 -12.727
  328    HB3  GLU  44           HB3      GLU  44  -3.147  -2.766 -12.491
  329    HG2  GLU  44           HG2      GLU  44  -2.970  -2.375 -14.821
  330    HG3  GLU  44           HG3      GLU  44  -3.257  -4.091 -15.189
  331    H    SER  45           H        SER  45  -0.119  -4.659 -15.083
  332    HA   SER  45           HA       SER  45   1.894  -2.816 -14.310
  333    HB2  SER  45           HB2      SER  45   1.623  -4.123 -17.010
  334    HB3  SER  45           HB3      SER  45   3.085  -3.538 -16.219
  335    HG   SER  45           HG       SER  45   2.813  -5.839 -16.038
  336    H    ALA  46           H        ALA  46   2.810  -1.193 -15.683
  337    HA   ALA  46           HA       ALA  46   1.468   1.098 -15.486
  338    HB1  ALA  46           HB1      ALA  46   3.165   2.039 -17.047
  339    HB2  ALA  46           HB2      ALA  46   3.898   0.853 -15.948
  340    HB3  ALA  46           HB3      ALA  46   3.527   0.386 -17.632
  341    H    GLU  47           H        GLU  47   1.499  -0.858 -18.539
  342    HA   GLU  47           HA       GLU  47   0.085   1.254 -19.935
  343    HB2  GLU  47           HB2      GLU  47   0.753  -1.612 -20.704
  344    HB3  GLU  47           HB3      GLU  47  -0.124  -0.500 -21.759
  345    HG2  GLU  47           HG2      GLU  47   1.745   1.038 -21.817
  346    HG3  GLU  47           HG3      GLU  47   2.646   0.081 -20.639
  347    H    GLN  48           H        GLN  48  -0.766  -1.913 -18.459
  348    HA   GLN  48           HA       GLN  48  -3.536  -1.893 -19.229
  349    HB2  GLN  48           HB2      GLN  48  -2.154  -3.303 -16.911
  350    HB3  GLN  48           HB3      GLN  48  -3.779  -3.614 -17.525
  351    HG2  GLN  48           HG2      GLN  48  -2.764  -5.262 -18.660
  352    HG3  GLN  48           HG3      GLN  48  -2.421  -4.000 -19.834
  353   HE21  GLN  48          HE22      GLN  48  -0.149  -3.435 -20.160
  354   HE22  GLN  48          HE21      GLN  48   1.140  -4.120 -19.213
  355    H    ALA  49           H        ALA  49  -1.776  -0.593 -16.397
  356    HA   ALA  49           HA       ALA  49  -4.082   0.336 -14.976
  357    HB1  ALA  49           HB1      ALA  49  -1.192   1.297 -14.926
  358    HB2  ALA  49           HB2      ALA  49  -2.444   1.714 -13.739
  359    HB3  ALA  49           HB3      ALA  49  -1.898   0.023 -13.900
  360    H    MET  50           H        MET  50  -2.036   1.789 -17.552
  361    HA   MET  50           HA       MET  50  -3.192   4.396 -17.411
  362    HB2  MET  50           HB2      MET  50  -1.052   3.971 -18.420
  363    HB3  MET  50           HB3      MET  50  -1.751   2.931 -19.642
  364    HG2  MET  50           HG2      MET  50  -2.373   5.876 -19.343
  365    HG3  MET  50           HG3      MET  50  -1.180   5.197 -20.434
  366    HE1  MET  50           HE1      MET  50  -3.099   3.512 -23.263
  367    HE2  MET  50           HE2      MET  50  -1.534   4.090 -22.647
  368    HE3  MET  50           HE3      MET  50  -2.355   2.724 -21.854
  369    H    TYR  51           H        TYR  51  -4.146   1.491 -19.307
  370    HA   TYR  51           HA       TYR  51  -6.513   2.777 -20.279
  371    HB2  TYR  51           HB2      TYR  51  -6.074  -0.183 -19.823
  372    HB3  TYR  51           HB3      TYR  51  -7.357   0.563 -20.758
  373    HD1  TYR  51           HD2      TYR  51  -6.758   1.881 -22.877
  374    HD2  TYR  51           HD1      TYR  51  -3.929  -0.499 -20.737
  375    HE1  TYR  51           HE2      TYR  51  -5.420   1.666 -24.926
  376    HE2  TYR  51           HE1      TYR  51  -2.407  -0.533 -22.673
  377    HH   TYR  51           HH       TYR  51  -3.478   0.767 -25.913
  378    H    ARG  52           H        ARG  52  -5.823   1.186 -17.144
  379    HA   ARG  52           HA       ARG  52  -8.573   0.952 -16.374
  380    HB2  ARG  52           HB2      ARG  52  -6.541  -0.120 -15.194
  381    HB3  ARG  52           HB3      ARG  52  -6.237   1.468 -14.488
  382    HG2  ARG  52           HG2      ARG  52  -7.457   0.282 -12.853
  383    HG3  ARG  52           HG3      ARG  52  -8.556   1.475 -13.535
  384    HD2  ARG  52           HD2      ARG  52  -9.696  -0.660 -13.186
  385    HD3  ARG  52           HD3      ARG  52  -9.626  -0.293 -14.921
  386    HE   ARG  52           HE       ARG  52  -7.359  -1.893 -14.186
  387   HH11  ARG  52          HH11      ARG  52 -10.897  -2.322 -14.350
  388   HH12  ARG  52          HH12      ARG  52 -10.806  -3.955 -14.893
  389   HH21  ARG  52          HH21      ARG  52  -7.238  -3.929 -15.111
  390   HH22  ARG  52          HH22      ARG  52  -8.645  -4.952 -15.241
  391    H    ALA  53           H        ALA  53  -6.120   3.573 -15.760
  392    HA   ALA  53           HA       ALA  53  -8.042   5.231 -14.445
  393    HB1  ALA  53           HB1      ALA  53  -5.671   5.555 -14.081
  394    HB2  ALA  53           HB2      ALA  53  -5.403   5.880 -15.806
  395    HB3  ALA  53           HB3      ALA  53  -6.340   7.031 -14.819
  396    H    LEU  54           H        LEU  54  -7.206   4.787 -17.839
  397    HA   LEU  54           HA       LEU  54  -8.486   7.050 -19.005
  398    HB2  LEU  54           HB2      LEU  54  -6.959   5.512 -20.163
  399    HB3  LEU  54           HB3      LEU  54  -8.045   4.189 -19.781
  400    HG   LEU  54           HG       LEU  54  -9.739   5.121 -21.365
  401   HD11  LEU  54          HD11      LEU  54  -8.812   7.463 -21.499
  402   HD12  LEU  54          HD12      LEU  54  -7.342   6.796 -22.262
  403   HD13  LEU  54          HD13      LEU  54  -8.912   6.675 -23.088
  404   HD21  LEU  54          HD21      LEU  54  -7.077   4.212 -22.392
  405   HD22  LEU  54          HD22      LEU  54  -8.438   3.220 -21.785
  406   HD23  LEU  54          HD23      LEU  54  -8.645   4.171 -23.261
  407    H    PHE  55           H        PHE  55  -9.623   3.848 -17.993
  408    HA   PHE  55           HA       PHE  55 -12.402   4.299 -18.669
  409    HB2  PHE  55           HB2      PHE  55 -12.060   2.075 -18.697
  410    HB3  PHE  55           HB3      PHE  55 -10.786   2.120 -17.505
  411    HD1  PHE  55           HD2      PHE  55 -14.520   2.394 -17.822
  412    HD2  PHE  55           HD1      PHE  55 -11.148   1.507 -15.287
  413    HE1  PHE  55           HE2      PHE  55 -16.068   1.659 -16.016
  414    HE2  PHE  55           HE1      PHE  55 -12.700   0.757 -13.482
  415    HZ   PHE  55           HZ       PHE  55 -15.161   0.835 -13.850
  416    H    GLU  56           H        GLU  56 -10.687   4.265 -15.475
  417    HA   GLU  56           HA       GLU  56 -12.980   4.794 -13.997
  418    HB2  GLU  56           HB2      GLU  56 -10.072   5.478 -13.399
  419    HB3  GLU  56           HB3      GLU  56 -11.384   5.675 -12.235
  420    HG2  GLU  56           HG2      GLU  56 -11.912   3.276 -12.356
  421    HG3  GLU  56           HG3      GLU  56 -10.591   3.022 -13.492
  422    H    GLU  57           H        GLU  57 -10.735   7.138 -15.491
  423    HA   GLU  57           HA       GLU  57 -12.256   9.359 -14.296
  424    HB2  GLU  57           HB2      GLU  57  -9.666   9.464 -15.873
  425    HB3  GLU  57           HB3      GLU  57 -10.347  10.717 -14.844
  426    HG2  GLU  57           HG2      GLU  57  -9.221   8.027 -13.986
  427    HG3  GLU  57           HG3      GLU  57  -8.531   9.616 -13.679
  428    H    VAL  58           H        VAL  58 -11.431   8.149 -17.576
  429    HA   VAL  58           HA       VAL  58 -12.955  10.428 -18.696
  430    HB   VAL  58           HB       VAL  58 -11.249   8.606 -20.382
  431   HG11  VAL  58          HG11      VAL  58 -11.852  11.588 -20.465
  432   HG12  VAL  58          HG12      VAL  58 -10.946  10.654 -21.682
  433   HG13  VAL  58          HG13      VAL  58 -12.670  10.341 -21.415
  434   HG21  VAL  58          HG21      VAL  58  -9.287  10.137 -20.014
  435   HG22  VAL  58          HG22      VAL  58 -10.143  10.883 -18.655
  436   HG23  VAL  58          HG23      VAL  58  -9.651   9.176 -18.586
  437    H    GLY  59           H        GLY  59 -13.177   6.975 -18.149
  438    HA2  GLY  59           HA2      GLY  59 -15.013   5.600 -18.487
  439    HA3  GLY  59           HA3      GLY  59 -15.871   6.910 -19.295
  440    H    LEU  60           H        LEU  60 -12.609   6.061 -20.343
  441    HA   LEU  60           HA       LEU  60 -13.694   4.940 -22.891
  442    HB2  LEU  60           HB2      LEU  60 -11.147   6.473 -22.258
  443    HB3  LEU  60           HB3      LEU  60 -11.402   5.595 -23.757
  444    HG   LEU  60           HG       LEU  60 -12.919   8.005 -22.714
  445   HD11  LEU  60          HD11      LEU  60 -11.950   9.116 -24.716
  446   HD12  LEU  60          HD12      LEU  60 -10.688   8.473 -23.657
  447   HD13  LEU  60          HD13      LEU  60 -11.128   7.618 -25.160
  448   HD21  LEU  60          HD21      LEU  60 -13.461   6.462 -25.288
  449   HD22  LEU  60          HD22      LEU  60 -14.561   6.642 -23.905
  450   HD23  LEU  60          HD23      LEU  60 -14.140   8.040 -24.879
  451    H    SER  61           H        SER  61 -12.590   3.054 -23.707
  452    HA   SER  61           HA       SER  61 -11.325   1.479 -21.487
  453    HB2  SER  61           HB2      SER  61 -13.001   0.476 -23.805
  454    HB3  SER  61           HB3      SER  61 -12.408  -0.461 -22.420
  455    HG   SER  61           HG       SER  61 -14.584   0.155 -22.088
  456    H    ARG  62           H        ARG  62 -10.092  -0.489 -22.501
  457    HA   ARG  62           HA       ARG  62  -7.929   0.530 -24.077
  458    HB2  ARG  62           HB2      ARG  62  -6.970  -1.763 -23.792
  459    HB3  ARG  62           HB3      ARG  62  -7.409  -0.966 -22.309
  460    HG2  ARG  62           HG2      ARG  62  -9.549  -2.352 -22.246
  461    HG3  ARG  62           HG3      ARG  62  -8.865  -3.262 -23.594
  462    HD2  ARG  62           HD2      ARG  62  -8.322  -4.487 -21.635
  463    HD3  ARG  62           HD3      ARG  62  -6.821  -3.698 -22.137
  464    HE   ARG  62           HE       ARG  62  -8.290  -2.119 -20.183
  465   HH11  ARG  62          HH11      ARG  62  -6.327  -5.080 -20.355
  466   HH12  ARG  62          HH12      ARG  62  -5.804  -4.992 -18.712
  467   HH21  ARG  62          HH21      ARG  62  -7.438  -1.920 -18.024
  468   HH22  ARG  62          HH22      ARG  62  -6.388  -3.119 -17.371
  469    H    LYS  63           H        LYS  63  -9.511   1.231 -25.637
  470    HA   LYS  63           HA       LYS  63  -9.213  -0.294 -28.111
  471    HB2  LYS  63           HB2      LYS  63 -11.559  -0.681 -28.550
  472    HB3  LYS  63           HB3      LYS  63 -11.218  -1.369 -26.964
  473    HG2  LYS  63           HG2      LYS  63 -12.111   0.801 -25.945
  474    HG3  LYS  63           HG3      LYS  63 -12.637   1.251 -27.577
  475    HD2  LYS  63           HD2      LYS  63 -14.112  -0.742 -27.661
  476    HD3  LYS  63           HD3      LYS  63 -13.570  -1.190 -26.034
  477    HE2  LYS  63           HE2      LYS  63 -15.654  -0.052 -25.749
  478    HE3  LYS  63           HE3      LYS  63 -14.380   1.045 -25.192
  479    HZ1  LYS  63           HZ1      LYS  63 -14.604   2.341 -27.143
  480    HZ2  LYS  63           HZ2      LYS  63 -15.592   1.244 -27.889
  481    HZ3  LYS  63           HZ3      LYS  63 -16.112   2.122 -26.614
  482    H    ASP  64           H        ASP  64 -10.355   2.500 -26.270
  483    HA   ASP  64           HA       ASP  64 -11.289   3.975 -28.591
  484    HB2  ASP  64           HB2      ASP  64 -11.028   4.539 -25.617
  485    HB3  ASP  64           HB3      ASP  64 -11.764   5.668 -26.752
  486    H    VAL  65           H        VAL  65  -8.143   3.554 -27.504
  487    HA   VAL  65           HA       VAL  65  -7.313   6.192 -28.481
  488    HB   VAL  65           HB       VAL  65  -5.978   6.660 -26.501
  489   HG11  VAL  65          HG11      VAL  65  -8.889   6.297 -25.691
  490   HG12  VAL  65          HG12      VAL  65  -7.711   7.467 -25.066
  491   HG13  VAL  65          HG13      VAL  65  -8.294   7.592 -26.741
  492   HG21  VAL  65          HG21      VAL  65  -7.426   4.320 -25.179
  493   HG22  VAL  65          HG22      VAL  65  -5.710   4.347 -25.600
  494   HG23  VAL  65          HG23      VAL  65  -6.324   5.470 -24.378
  495    H    ARG  66           H        ARG  66  -4.875   6.292 -28.580
  496    HA   ARG  66           HA       ARG  66  -3.687   3.670 -29.410
  497    HB2  ARG  66           HB2      ARG  66  -4.654   4.587 -31.400
  498    HB3  ARG  66           HB3      ARG  66  -4.246   6.234 -30.952
  499    HG2  ARG  66           HG2      ARG  66  -2.880   5.666 -32.749
  500    HG3  ARG  66           HG3      ARG  66  -1.835   5.756 -31.349
  501    HD2  ARG  66           HD2      ARG  66  -2.976   3.059 -32.135
  502    HD3  ARG  66           HD3      ARG  66  -1.752   3.774 -33.191
  503    HE   ARG  66           HE       ARG  66  -0.481   4.007 -30.841
  504   HH11  ARG  66          HH11      ARG  66  -2.029   1.177 -32.363
  505   HH12  ARG  66          HH12      ARG  66  -0.868   0.058 -31.740
  506   HH21  ARG  66          HH21      ARG  66   1.041   2.567 -30.068
  507   HH22  ARG  66          HH22      ARG  66   0.917   0.867 -30.379
  508    H    ILE  67           H        ILE  67  -1.737   3.566 -28.215
  509    HA   ILE  67           HA       ILE  67  -0.610   5.972 -27.049
  510    HB   ILE  67           HB       ILE  67   0.458   3.121 -27.248
  511   HG12  ILE  67          HG12      ILE  67  -0.885   4.449 -24.844
  512   HG13  ILE  67          HG13      ILE  67  -1.800   3.474 -25.982
  513   HG21  ILE  67          HG21      ILE  67   1.926   3.796 -25.372
  514   HG22  ILE  67          HG22      ILE  67   2.226   4.782 -26.797
  515   HG23  ILE  67          HG23      ILE  67   1.266   5.452 -25.447
  516   HD11  ILE  67          HD11      ILE  67  -0.246   1.552 -25.559
  517   HD12  ILE  67          HD12      ILE  67   0.527   2.499 -24.259
  518   HD13  ILE  67          HD13      ILE  67  -1.172   2.053 -24.136
  519    H    LEU  68           H        LEU  68   0.726   7.334 -27.970
  520    HA   LEU  68           HA       LEU  68   1.997   6.595 -30.578
  521    HB2  LEU  68           HB2      LEU  68   0.324   8.782 -29.796
  522    HB3  LEU  68           HB3      LEU  68   1.937   9.454 -29.940
  523    HG   LEU  68           HG       LEU  68   0.677   9.732 -31.995
  524   HD11  LEU  68          HD11      LEU  68   2.251   8.851 -33.619
  525   HD12  LEU  68          HD12      LEU  68   3.140   9.374 -32.178
  526   HD13  LEU  68          HD13      LEU  68   2.856   7.649 -32.469
  527   HD21  LEU  68          HD21      LEU  68   0.523   6.690 -32.234
  528   HD22  LEU  68          HD22      LEU  68  -0.812   7.757 -31.737
  529   HD23  LEU  68          HD23      LEU  68  -0.115   7.903 -33.359
  530    H    ALA  69           H        ALA  69   2.590   7.959 -27.341
  531    HA   ALA  69           HA       ALA  69   5.407   7.306 -27.513
  532    HB1  ALA  69           HB1      ALA  69   4.556  10.225 -27.111
  533    HB2  ALA  69           HB2      ALA  69   6.207   9.589 -26.960
  534    HB3  ALA  69           HB3      ALA  69   5.402   9.590 -28.536
  535    H    SER  70           H        SER  70   6.407   7.846 -25.271
  536    HA   SER  70           HA       SER  70   4.557   8.428 -23.101
  537    HB2  SER  70           HB2      SER  70   5.438   6.439 -21.784
  538    HB3  SER  70           HB3      SER  70   4.254   6.089 -23.049
  539    HG   SER  70           HG       SER  70   5.995   4.604 -23.148
  540    H    THR  71           H        THR  71   5.857   8.978 -21.081
  541    HA   THR  71           HA       THR  71   8.162  10.485 -21.803
  542    HB   THR  71           HB       THR  71   8.395  10.551 -19.192
  543    HG1  THR  71           HG1      THR  71   7.103   8.873 -18.577
  544   HG21  THR  71          HG21      THR  71   5.954  11.582 -20.686
  545   HG22  THR  71          HG22      THR  71   6.458  12.132 -19.073
  546   HG23  THR  71          HG23      THR  71   7.511  12.410 -20.471
  547    H    ARG  72           H        ARG  72  10.393  10.196 -21.295
  548    HA   ARG  72           HA       ARG  72  11.315   7.663 -22.105
  549    HB2  ARG  72           HB2      ARG  72  12.970   9.762 -20.641
  550    HB3  ARG  72           HB3      ARG  72  13.561   8.492 -21.713
  551    HG2  ARG  72           HG2      ARG  72  12.293   9.608 -23.613
  552    HG3  ARG  72           HG3      ARG  72  11.907  10.924 -22.487
  553    HD2  ARG  72           HD2      ARG  72  14.477  11.065 -22.085
  554    HD3  ARG  72           HD3      ARG  72  14.615  10.087 -23.560
  555    HE   ARG  72           HE       ARG  72  12.881  12.415 -23.870
  556   HH11  ARG  72          HH11      ARG  72  16.287  11.381 -24.107
  557   HH12  ARG  72          HH12      ARG  72  16.771  12.788 -24.985
  558   HH21  ARG  72          HH21      ARG  72  13.534  14.296 -24.803
  559   HH22  ARG  72          HH22      ARG  72  15.129  14.464 -25.500
  560    H    ASN  73           H        ASN  73  10.944   9.005 -18.874
  561    HA   ASN  73           HA       ASN  73  10.941   6.405 -17.705
  562    HB2  ASN  73           HB2      ASN  73  12.619   6.611 -16.077
  563    HB3  ASN  73           HB3      ASN  73  13.425   7.099 -17.547
  564   HD21  ASN  73          HD22      ASN  73  13.488   9.621 -17.916
  565   HD22  ASN  73          HD21      ASN  73  13.716  10.591 -16.481
  566    H    TRP  74           H        TRP  74  10.377   6.906 -15.152
  567    HA   TRP  74           HA       TRP  74   7.901   8.290 -15.285
  568    HB2  TRP  74           HB2      TRP  74   9.498   7.362 -12.867
  569    HB3  TRP  74           HB3      TRP  74   7.794   7.804 -12.893
  570    HD1  TRP  74           HD1      TRP  74  10.178   5.027 -14.122
  571    HE1  TRP  74           HE1      TRP  74   8.844   2.921 -14.657
  572    HE3  TRP  74           HE3      TRP  74   5.472   6.708 -13.059
  573    HZ2  TRP  74           HZ2      TRP  74   6.097   2.177 -15.007
  574    HZ3  TRP  74           HZ3      TRP  74   3.502   5.272 -13.539
  575    HH2  TRP  74           HH2      TRP  74   3.766   3.078 -14.614
  576    H    LEU  75           H        LEU  75   7.408  10.383 -14.898
  577    HA   LEU  75           HA       LEU  75   9.511  12.320 -14.112
  578    HB2  LEU  75           HB2      LEU  75   6.663  12.489 -15.154
  579    HB3  LEU  75           HB3      LEU  75   7.285  13.827 -14.213
  580    HG   LEU  75           HG       LEU  75   7.480  14.139 -16.672
  581   HD11  LEU  75          HD11      LEU  75   8.900  15.398 -15.102
  582   HD12  LEU  75          HD12      LEU  75  10.156  14.143 -15.212
  583   HD13  LEU  75          HD13      LEU  75   9.723  15.085 -16.645
  584   HD21  LEU  75          HD21      LEU  75   9.722  12.083 -16.595
  585   HD22  LEU  75          HD22      LEU  75   8.099  11.774 -17.234
  586   HD23  LEU  75          HD23      LEU  75   9.134  13.007 -17.991
  587    H    ARG  76           H        ARG  76   9.487  13.347 -12.052
  588    HA   ARG  76           HA       ARG  76   7.366  12.691 -10.162
  589    HB2  ARG  76           HB2      ARG  76   8.646  11.470  -8.544
  590    HB3  ARG  76           HB3      ARG  76   8.703  10.607 -10.070
  591    HG2  ARG  76           HG2      ARG  76  10.975  11.659 -10.486
  592    HG3  ARG  76           HG3      ARG  76  10.938  12.275  -8.827
  593    HD2  ARG  76           HD2      ARG  76  10.757   9.341  -9.653
  594    HD3  ARG  76           HD3      ARG  76  12.228  10.159  -9.095
  595    HE   ARG  76           HE       ARG  76  10.239  10.503  -7.097
  596   HH11  ARG  76          HH11      ARG  76  12.342   7.906  -8.442
  597   HH12  ARG  76          HH12      ARG  76  12.291   7.004  -6.937
  598   HH21  ARG  76          HH21      ARG  76  10.230   9.114  -5.165
  599   HH22  ARG  76          HH22      ARG  76  11.148   7.635  -5.219
  600    H    TYR  77           H        TYR  77   7.432  13.934  -8.265
  601    HA   TYR  77           HA       TYR  77   9.529  15.910  -7.791
  602    HB2  TYR  77           HB2      TYR  77   7.921  17.819  -7.969
  603    HB3  TYR  77           HB3      TYR  77   8.260  17.082  -9.521
  604    HD1  TYR  77           HD1      TYR  77   6.569  15.751 -10.701
  605    HD2  TYR  77           HD2      TYR  77   5.667  17.655  -6.953
  606    HE1  TYR  77           HE1      TYR  77   4.178  15.210 -11.018
  607    HE2  TYR  77           HE2      TYR  77   3.294  17.045  -7.203
  608    HH   TYR  77           HH       TYR  77   2.111  15.027  -9.952
  609    H    LYS  78           H        LYS  78   8.917  17.124  -5.752
  610    HA   LYS  78           HA       LYS  78   7.244  15.406  -4.016
  611    HB2  LYS  78           HB2      LYS  78   8.243  16.513  -2.068
  612    HB3  LYS  78           HB3      LYS  78   9.272  15.450  -2.996
  613    HG2  LYS  78           HG2      LYS  78  10.585  17.224  -2.248
  614    HG3  LYS  78           HG3      LYS  78  10.432  17.414  -3.994
  615    HD2  LYS  78           HD2      LYS  78   8.838  19.257  -3.675
  616    HD3  LYS  78           HD3      LYS  78   8.814  18.970  -1.915
  617    HE2  LYS  78           HE2      LYS  78  11.251  19.491  -1.825
  618    HE3  LYS  78           HE3      LYS  78  11.268  19.756  -3.572
  619    HZ1  LYS  78           HZ1      LYS  78   9.746  21.389  -1.604
  620    HZ2  LYS  78           HZ2      LYS  78  11.119  21.839  -2.369
  621    HZ3  LYS  78           HZ3      LYS  78   9.750  21.638  -3.230
  622    H    LEU  79           H        LEU  79   5.685  16.284  -2.759
  623    HA   LEU  79           HA       LEU  79   4.087  18.364  -4.024
  624    HB2  LEU  79           HB2      LEU  79   3.803  16.776  -1.426
  625    HB3  LEU  79           HB3      LEU  79   2.548  17.817  -2.068
  626    HG   LEU  79           HG       LEU  79   3.633  15.447  -3.644
  627   HD11  LEU  79          HD11      LEU  79   1.258  15.441  -1.742
  628   HD12  LEU  79          HD12      LEU  79   1.732  14.126  -2.849
  629   HD13  LEU  79          HD13      LEU  79   2.797  14.575  -1.514
  630   HD21  LEU  79          HD21      LEU  79   1.547  15.601  -4.874
  631   HD22  LEU  79          HD22      LEU  79   0.960  16.903  -3.815
  632   HD23  LEU  79          HD23      LEU  79   2.341  17.177  -4.908
  633    HA   PRO  80           HA       PRO  80   5.562  21.660  -1.265
  634    HB2  PRO  80           HB2      PRO  80   3.336  23.234  -0.979
  635    HB3  PRO  80           HB3      PRO  80   4.271  23.168  -2.507
  636    HG2  PRO  80           HG2      PRO  80   1.800  21.563  -1.783
  637    HG3  PRO  80           HG3      PRO  80   2.058  22.575  -3.247
  638    HD2  PRO  80           HD2      PRO  80   2.483  19.911  -3.339
  639    HD3  PRO  80           HD3      PRO  80   3.632  21.010  -4.144
  640    H    LYS  81           H        LYS  81   5.392  22.056   1.063
  641    HA   LYS  81           HA       LYS  81   4.960  19.888   2.523
  642    HB2  LYS  81           HB2      LYS  81   5.932  22.353   3.005
  643    HB3  LYS  81           HB3      LYS  81   4.436  22.534   3.907
  644    HG2  LYS  81           HG2      LYS  81   6.594  20.442   4.264
  645    HG3  LYS  81           HG3      LYS  81   6.285  21.846   5.295
  646    HD2  LYS  81           HD2      LYS  81   3.969  20.809   5.800
  647    HD3  LYS  81           HD3      LYS  81   4.535  19.361   4.960
  648    HE2  LYS  81           HE2      LYS  81   4.859  18.968   7.291
  649    HE3  LYS  81           HE3      LYS  81   6.463  19.216   6.591
  650    HZ1  LYS  81           HZ1      LYS  81   6.435  21.478   7.516
  651    HZ2  LYS  81           HZ2      LYS  81   4.921  21.259   8.116
  652    HZ3  LYS  81           HZ3      LYS  81   6.171  20.390   8.695
  653    H    ARG  82           H        ARG  82   2.534  22.465   2.263
  654    HA   ARG  82           HA       ARG  82   0.679  21.370   4.102
  655    HB2  ARG  82           HB2      ARG  82  -0.857  23.068   3.261
  656    HB3  ARG  82           HB3      ARG  82   0.755  23.719   3.474
  657    HG2  ARG  82           HG2      ARG  82   0.919  23.072   0.808
  658    HG3  ARG  82           HG3      ARG  82  -0.824  23.239   0.953
  659    HD2  ARG  82           HD2      ARG  82   0.084  25.354   0.269
  660    HD3  ARG  82           HD3      ARG  82  -0.459  25.526   1.951
  661    HE   ARG  82           HE       ARG  82   2.328  24.790   1.867
  662   HH11  ARG  82          HH11      ARG  82   0.207  27.579   1.225
  663   HH12  ARG  82          HH12      ARG  82   1.409  28.762   1.584
  664   HH21  ARG  82          HH21      ARG  82   3.945  26.389   2.344
  665   HH22  ARG  82          HH22      ARG  82   3.577  28.067   2.206
  666    H    LEU  83           H        LEU  83   1.370  20.340   0.875
  667    HA   LEU  83           HA       LEU  83  -1.250  19.003   0.603
  668    HB2  LEU  83           HB2      LEU  83  -0.347  20.567  -1.167
  669    HB3  LEU  83           HB3      LEU  83   0.950  19.405  -1.441
  670    HG   LEU  83           HG       LEU  83  -0.709  17.716  -2.192
  671   HD11  LEU  83          HD11      LEU  83  -2.699  18.357  -0.901
  672   HD12  LEU  83          HD12      LEU  83  -2.747  19.941  -1.708
  673   HD13  LEU  83          HD13      LEU  83  -3.066  18.449  -2.623
  674   HD21  LEU  83          HD21      LEU  83  -1.335  18.868  -4.283
  675   HD22  LEU  83          HD22      LEU  83  -0.998  20.443  -3.530
  676   HD23  LEU  83          HD23      LEU  83   0.315  19.283  -3.803
  677    H    VAL  84           H        VAL  84   1.925  18.264   1.776
  678    HA   VAL  84           HA       VAL  84   2.170  15.575   0.826
  679    HB   VAL  84           HB       VAL  84   3.130  16.937   3.368
  680   HG11  VAL  84          HG11      VAL  84   4.671  15.035   3.682
  681   HG12  VAL  84          HG12      VAL  84   3.004  14.476   3.787
  682   HG13  VAL  84          HG13      VAL  84   3.938  14.189   2.315
  683   HG21  VAL  84          HG21      VAL  84   4.153  17.812   1.296
  684   HG22  VAL  84          HG22      VAL  84   5.330  16.912   2.259
  685   HG23  VAL  84          HG23      VAL  84   4.610  16.165   0.820
  686    H    ARG  85           H        ARG  85   1.352  13.713   1.688
  687    HA   ARG  85           HA       ARG  85  -1.386  14.108   2.516
  688    HB2  ARG  85           HB2      ARG  85  -0.018  11.397   2.295
  689    HB3  ARG  85           HB3      ARG  85  -1.731  11.761   2.165
  690    HG2  ARG  85           HG2      ARG  85   0.470  12.320   0.156
  691    HG3  ARG  85           HG3      ARG  85  -0.941  11.289  -0.032
  692    HD2  ARG  85           HD2      ARG  85  -0.847  14.320   0.048
  693    HD3  ARG  85           HD3      ARG  85  -1.184  13.312  -1.353
  694    HE   ARG  85           HE       ARG  85  -3.215  12.498  -0.085
  695   HH11  ARG  85          HH11      ARG  85  -1.985  15.839   0.270
  696   HH12  ARG  85          HH12      ARG  85  -3.518  16.469   0.793
  697   HH21  ARG  85          HH21      ARG  85  -5.226  13.367   0.583
  698   HH22  ARG  85          HH22      ARG  85  -5.399  15.049   0.928
  699    H    TRP  86           H        TRP  86   1.351  12.680   4.205
  700    HA   TRP  86           HA       TRP  86   1.690  11.800   6.243
  701    HB2  TRP  86           HB2      TRP  86  -0.347  13.786   7.207
  702    HB3  TRP  86           HB3      TRP  86   0.936  13.039   8.154
  703    HD1  TRP  86           HD1      TRP  86   0.280  15.752   5.652
  704    HE1  TRP  86           HE1      TRP  86   2.326  17.223   5.276
  705    HE3  TRP  86           HE3      TRP  86   3.676  13.013   8.303
  706    HZ2  TRP  86           HZ2      TRP  86   5.191  17.070   5.849
  707    HZ3  TRP  86           HZ3      TRP  86   6.068  13.658   8.326
  708    HH2  TRP  86           HH2      TRP  86   6.836  15.679   7.096
  709    H    ASP  87           H        ASP  87  -0.859  10.931   4.655
  710    HA   ASP  87           HA       ASP  87  -2.350   9.551   6.833
  711    HB2  ASP  87           HB2      ASP  87  -3.647  10.906   5.247
  712    HB3  ASP  87           HB3      ASP  87  -3.001   9.969   3.895
  713    H    THR  88           H        THR  88  -0.075   8.951   4.205
  714    HA   THR  88           HA       THR  88  -0.782   6.132   4.004
  715    HB   THR  88           HB       THR  88   0.896   6.290   2.142
  716    HG1  THR  88           HG1      THR  88   2.229   7.827   2.585
  717   HG21  THR  88          HG21      THR  88  -1.146   8.550   1.997
  718   HG22  THR  88          HG22      THR  88  -0.361   7.712   0.644
  719   HG23  THR  88          HG23      THR  88  -1.515   6.840   1.677
  720    H    LYS  89           H        LYS  89   1.145   4.587   3.958
  721    HA   LYS  89           HA       LYS  89   3.366   5.354   5.780
  722    HB2  LYS  89           HB2      LYS  89   1.726   2.816   5.915
  723    HB3  LYS  89           HB3      LYS  89   3.333   2.959   6.623
  724    HG2  LYS  89           HG2      LYS  89   1.019   4.811   7.350
  725    HG3  LYS  89           HG3      LYS  89   1.385   3.305   8.199
  726    HD2  LYS  89           HD2      LYS  89   3.653   4.179   8.758
  727    HD3  LYS  89           HD3      LYS  89   3.227   5.730   7.990
  728    HE2  LYS  89           HE2      LYS  89   1.340   6.013   9.555
  729    HE3  LYS  89           HE3      LYS  89   1.686   4.443  10.292
  730    HZ1  LYS  89           HZ1      LYS  89   3.821   5.332  11.045
  731    HZ2  LYS  89           HZ2      LYS  89   3.506   6.791  10.363
  732    HZ3  LYS  89           HZ3      LYS  89   2.597   6.250  11.604
  733    HA   PRO  90           HA       PRO  90   5.458   5.646   5.522
  734    HB2  PRO  90           HB2      PRO  90   7.275   6.737   3.807
  735    HB3  PRO  90           HB3      PRO  90   7.541   5.181   4.644
  736    HG2  PRO  90           HG2      PRO  90   6.495   5.632   1.840
  737    HG3  PRO  90           HG3      PRO  90   7.804   4.521   2.356
  738    HD2  PRO  90           HD2      PRO  90   5.265   3.626   1.977
  739    HD3  PRO  90           HD3      PRO  90   6.269   3.005   3.319
  740    H    VAL  91           H        VAL  91   5.436   8.060   5.401
  741    HA   VAL  91           HA       VAL  91   3.017   9.041   4.344
  742    HB   VAL  91           HB       VAL  91   3.805  11.247   5.084
  743   HG11  VAL  91          HG11      VAL  91   2.702   9.638   6.612
  744   HG12  VAL  91          HG12      VAL  91   4.289   9.052   7.146
  745   HG13  VAL  91          HG13      VAL  91   3.808  10.731   7.462
  746   HG21  VAL  91          HG21      VAL  91   6.399   9.890   5.945
  747   HG22  VAL  91          HG22      VAL  91   6.231  11.111   4.663
  748   HG23  VAL  91          HG23      VAL  91   5.881  11.541   6.336
  749    H    CYS  92           H        CYS  92   2.523  10.053   2.481
  750    HA   CYS  92           HA       CYS  92   4.464   9.605   0.356
  751    HB2  CYS  92           HB2      CYS  92   2.186   8.728   0.337
  752    HB3  CYS  92           HB3      CYS  92   1.540  10.373   0.221
  753    HG   CYS  92           HG       CYS  92   2.728  11.011  -2.046
  754    H    ILE  93           H        ILE  93   5.818  11.096  -0.119
  755    HA   ILE  93           HA       ILE  93   5.321  13.947   0.456
  756    HB   ILE  93           HB       ILE  93   7.779  14.141   0.204
  757   HG12  ILE  93          HG12      ILE  93   7.769  11.093  -0.075
  758   HG13  ILE  93          HG13      ILE  93   8.212  12.244  -1.327
  759   HG21  ILE  93          HG21      ILE  93   6.977  12.023   2.242
  760   HG22  ILE  93          HG22      ILE  93   8.317  13.188   2.354
  761   HG23  ILE  93          HG23      ILE  93   6.651  13.761   2.398
  762   HD11  ILE  93          HD11      ILE  93   9.694  11.632   1.249
  763   HD12  ILE  93          HD12      ILE  93  10.233  11.381  -0.413
  764   HD13  ILE  93          HD13      ILE  93  10.085  13.035   0.213
  765    H    GLY  94           H        GLY  94   5.330  11.764  -2.276
  766    HA2  GLY  94           HA2      GLY  94   5.314  14.074  -4.124
  767    HA3  GLY  94           HA3      GLY  94   6.639  12.923  -4.269
  768    H    GLN  95           H        GLN  95   5.248  13.205  -6.450
  769    HA   GLN  95           HA       GLN  95   3.235  10.991  -6.562
  770    HB2  GLN  95           HB2      GLN  95   2.656  13.642  -6.884
  771    HB3  GLN  95           HB3      GLN  95   3.234  13.296  -8.495
  772    HG2  GLN  95           HG2      GLN  95   0.879  13.097  -8.570
  773    HG3  GLN  95           HG3      GLN  95   1.488  11.456  -8.650
  774   HE21  GLN  95          HE22      GLN  95   0.447  13.878  -6.070
  775   HE22  GLN  95          HE21      GLN  95  -0.404  12.681  -5.118
  776    H    LYS  96           H        LYS  96   4.009   9.356  -7.912
  777    HA   LYS  96           HA       LYS  96   6.315   9.948  -9.745
  778    HB2  LYS  96           HB2      LYS  96   6.960   8.197  -8.268
  779    HB3  LYS  96           HB3      LYS  96   5.375   7.438  -8.273
  780    HG2  LYS  96           HG2      LYS  96   5.690   6.660 -10.588
  781    HG3  LYS  96           HG3      LYS  96   7.229   7.539 -10.697
  782    HD2  LYS  96           HD2      LYS  96   8.235   6.122  -9.020
  783    HD3  LYS  96           HD3      LYS  96   6.689   5.291  -8.716
  784    HE2  LYS  96           HE2      LYS  96   6.664   4.335 -10.974
  785    HE3  LYS  96           HE3      LYS  96   8.020   5.349 -11.468
  786    HZ1  LYS  96           HZ1      LYS  96   8.290   3.272  -9.364
  787    HZ2  LYS  96           HZ2      LYS  96   8.656   3.023 -10.952
  788    HZ3  LYS  96           HZ3      LYS  96   9.498   4.114 -10.071
  789    H    GLN  97           H        GLN  97   5.779   9.875 -11.995
  790    HA   GLN  97           HA       GLN  97   3.406   8.367 -12.717
  791    HB2  GLN  97           HB2      GLN  97   2.262  10.205 -13.919
  792    HB3  GLN  97           HB3      GLN  97   2.201  10.361 -12.183
  793    HG2  GLN  97           HG2      GLN  97   4.276  11.922 -13.725
  794    HG3  GLN  97           HG3      GLN  97   2.592  12.446 -13.661
  795   HE21  GLN  97          HE22      GLN  97   5.578  12.200 -11.806
  796   HE22  GLN  97          HE21      GLN  97   4.929  12.867 -10.322
  797    H    LYS  98           H        LYS  98   3.387   7.584 -14.737
  798    HA   LYS  98           HA       LYS  98   5.508   8.558 -16.622
  799    HB2  LYS  98           HB2      LYS  98   5.704   6.169 -16.199
  800    HB3  LYS  98           HB3      LYS  98   3.979   5.908 -16.501
  801    HG2  LYS  98           HG2      LYS  98   4.262   6.517 -18.856
  802    HG3  LYS  98           HG3      LYS  98   5.959   6.925 -18.595
  803    HD2  LYS  98           HD2      LYS  98   4.814   4.148 -18.099
  804    HD3  LYS  98           HD3      LYS  98   5.460   4.674 -19.665
  805    HE2  LYS  98           HE2      LYS  98   7.653   5.205 -18.578
  806    HE3  LYS  98           HE3      LYS  98   7.035   4.569 -17.048
  807    HZ1  LYS  98           HZ1      LYS  98   7.380   2.993 -19.557
  808    HZ2  LYS  98           HZ2      LYS  98   8.323   2.895 -18.229
  809    HZ3  LYS  98           HZ3      LYS  98   6.773   2.386 -18.158
  810    H    TRP  99           H        TRP  99   4.702   9.646 -18.420
  811    HA   TRP  99           HA       TRP  99   1.727   9.978 -18.523
  812    HB2  TRP  99           HB2      TRP  99   3.954  11.720 -19.606
  813    HB3  TRP  99           HB3      TRP  99   2.244  11.988 -19.838
  814    HD1  TRP  99           HD1      TRP  99   4.888  12.056 -17.033
  815    HE1  TRP  99           HE1      TRP  99   4.235  13.889 -15.380
  816    HE3  TRP  99           HE3      TRP  99   0.137  12.999 -18.688
  817    HZ2  TRP  99           HZ2      TRP  99   2.042  15.748 -15.024
  818    HZ3  TRP  99           HZ3      TRP  99  -1.245  14.755 -17.627
  819    HH2  TRP  99           HH2      TRP  99  -0.307  16.147 -15.801
  820    H    PHE 100           H        PHE 100   0.692   9.193 -20.302
  821    HA   PHE 100           HA       PHE 100   2.372   8.047 -22.501
  822    HB2  PHE 100           HB2      PHE 100  -0.337   7.221 -21.413
  823    HB3  PHE 100           HB3      PHE 100   0.330   6.666 -22.945
  824    HD1  PHE 100           HD2      PHE 100   0.842   6.543 -19.236
  825    HD2  PHE 100           HD1      PHE 100   1.957   4.943 -23.087
  826    HE1  PHE 100           HE2      PHE 100   1.926   4.598 -18.129
  827    HE2  PHE 100           HE1      PHE 100   3.061   3.029 -21.976
  828    HZ   PHE 100           HZ       PHE 100   3.012   2.828 -19.498
  829    H    LEU 101           H        LEU 101   2.056   8.917 -24.471
  830    HA   LEU 101           HA       LEU 101   0.155  11.155 -24.743
  831    HB2  LEU 101           HB2      LEU 101   2.607  11.284 -25.444
  832    HB3  LEU 101           HB3      LEU 101   2.216  10.162 -26.736
  833    HG   LEU 101           HG       LEU 101   2.286  12.467 -27.498
  834   HD11  LEU 101          HD11      LEU 101   0.648  10.907 -28.597
  835   HD12  LEU 101          HD12      LEU 101  -0.638  11.621 -27.598
  836   HD13  LEU 101          HD13      LEU 101   0.256  12.629 -28.740
  837   HD21  LEU 101          HD21      LEU 101   0.809  14.197 -26.770
  838   HD22  LEU 101          HD22      LEU 101  -0.111  13.084 -25.742
  839   HD23  LEU 101          HD23      LEU 101   1.553  13.511 -25.328
  840    H    LEU 102           H        LEU 102  -1.843  10.529 -25.230
  841    HA   LEU 102           HA       LEU 102  -2.241   8.055 -26.830
  842    HB2  LEU 102           HB2      LEU 102  -3.849   9.441 -24.650
  843    HB3  LEU 102           HB3      LEU 102  -4.690   8.510 -25.874
  844    HG   LEU 102           HG       LEU 102  -4.424   7.114 -24.000
  845   HD11  LEU 102          HD11      LEU 102  -3.567   5.207 -25.072
  846   HD12  LEU 102          HD12      LEU 102  -3.824   6.302 -26.473
  847   HD13  LEU 102          HD13      LEU 102  -2.233   6.105 -25.799
  848   HD21  LEU 102          HD21      LEU 102  -1.426   7.631 -24.159
  849   HD22  LEU 102          HD22      LEU 102  -2.525   8.236 -22.900
  850   HD23  LEU 102          HD23      LEU 102  -2.223   6.500 -23.065
  851    H    GLN 103           H        GLN 103  -3.052   8.242 -28.816
  852    HA   GLN 103           HA       GLN 103  -4.180  10.906 -29.584
  853    HB2  GLN 103           HB2      GLN 103  -3.508   8.461 -31.258
  854    HB3  GLN 103           HB3      GLN 103  -4.409   9.851 -31.872
  855    HG2  GLN 103           HG2      GLN 103  -1.590   9.915 -30.731
  856    HG3  GLN 103           HG3      GLN 103  -2.005   9.995 -32.442
  857   HE21  GLN 103          HE22      GLN 103  -0.401  11.982 -31.074
  858   HE22  GLN 103          HE21      GLN 103  -1.287  13.461 -31.070
  859    H    LEU 104           H        LEU 104  -6.343  11.215 -29.619
  860    HA   LEU 104           HA       LEU 104  -8.033   9.193 -28.451
  861    HB2  LEU 104           HB2      LEU 104  -8.366  11.685 -28.302
  862    HB3  LEU 104           HB3      LEU 104  -8.781  11.711 -30.015
  863    HG   LEU 104           HG       LEU 104 -10.790  10.346 -29.570
  864   HD11  LEU 104          HD11      LEU 104 -11.444   9.955 -27.134
  865   HD12  LEU 104          HD12      LEU 104 -10.127   8.944 -27.689
  866   HD13  LEU 104          HD13      LEU 104  -9.795  10.372 -26.669
  867   HD21  LEU 104          HD21      LEU 104 -10.574  12.653 -27.578
  868   HD22  LEU 104          HD22      LEU 104 -10.814  12.867 -29.337
  869   HD23  LEU 104          HD23      LEU 104 -12.051  12.073 -28.364
  870    H    VAL 105           H        VAL 105  -9.057   7.485 -29.505
  871    HA   VAL 105           HA       VAL 105  -8.982   7.460 -32.493
  872    HB   VAL 105           HB       VAL 105  -9.269   5.162 -30.527
  873   HG11  VAL 105          HG11      VAL 105  -9.116   3.696 -32.472
  874   HG12  VAL 105          HG12      VAL 105 -10.570   4.699 -32.528
  875   HG13  VAL 105          HG13      VAL 105  -9.173   5.108 -33.555
  876   HG21  VAL 105          HG21      VAL 105  -7.005   5.831 -32.453
  877   HG22  VAL 105          HG22      VAL 105  -6.940   6.106 -30.702
  878   HG23  VAL 105          HG23      VAL 105  -7.088   4.455 -31.321
  879    H    SER 106           H        SER 106 -10.985   6.795 -29.560
  880    HA   SER 106           HA       SER 106 -13.382   7.707 -31.081
  881    HB2  SER 106           HB2      SER 106 -13.198   5.252 -29.313
  882    HB3  SER 106           HB3      SER 106 -14.653   5.847 -30.138
  883    HG   SER 106           HG       SER 106 -13.671   4.162 -31.342
  884    H    GLY 107           H        GLY 107 -14.332   9.311 -29.981
  885    HA2  GLY 107           HA2      GLY 107 -14.600   9.290 -27.094
  886    HA3  GLY 107           HA3      GLY 107 -13.474  10.524 -27.680
  887    H    ASP 108           H        ASP 108 -15.049  12.025 -26.790
  888    HA   ASP 108           HA       ASP 108 -16.642  13.534 -26.745
  889    HB2  ASP 108           HB2      ASP 108 -16.170  14.441 -28.754
  890    HB3  ASP 108           HB3      ASP 108 -16.593  13.010 -29.676
  891    H    ALA 109           H        ALA 109 -17.864  10.726 -28.537
  892    HA   ALA 109           HA       ALA 109 -20.422  10.803 -27.027
  893    HB1  ALA 109           HB1      ALA 109 -20.545  10.592 -29.481
  894    HB2  ALA 109           HB2      ALA 109 -19.566   9.103 -29.409
  895    HB3  ALA 109           HB3      ALA 109 -21.181   9.147 -28.672
  896    H    GLU 110           H        GLU 110 -17.484   8.794 -27.418
  897    HA   GLU 110           HA       GLU 110 -18.558   6.648 -25.764
  898    HB2  GLU 110           HB2      GLU 110 -15.887   7.134 -27.128
  899    HB3  GLU 110           HB3      GLU 110 -16.103   5.819 -25.979
  900    HG2  GLU 110           HG2      GLU 110 -17.815   6.163 -28.473
  901    HG3  GLU 110           HG3      GLU 110 -16.376   5.158 -28.380
  902    H    ILE 111           H        ILE 111 -16.831   9.618 -25.303
  903    HA   ILE 111           HA       ILE 111 -15.616   8.967 -22.738
  904    HB   ILE 111           HB       ILE 111 -16.127  11.482 -24.334
  905   HG12  ILE 111          HG12      ILE 111 -13.674  10.044 -23.343
  906   HG13  ILE 111          HG13      ILE 111 -14.226  10.252 -25.001
  907   HG21  ILE 111          HG21      ILE 111 -15.076  11.436 -21.474
  908   HG22  ILE 111          HG22      ILE 111 -15.162  12.864 -22.544
  909   HG23  ILE 111          HG23      ILE 111 -16.644  12.114 -22.003
  910   HD11  ILE 111          HD11      ILE 111 -13.801  12.733 -24.760
  911   HD12  ILE 111          HD12      ILE 111 -13.002  12.360 -23.209
  912   HD13  ILE 111          HD13      ILE 111 -12.362  11.691 -24.714
  913    H    ASN 112           H        ASN 112 -16.583   8.964 -20.836
  914    HA   ASN 112           HA       ASN 112 -19.444   9.834 -20.603
  915    HB2  ASN 112           HB2      ASN 112 -19.405   7.415 -21.106
  916    HB3  ASN 112           HB3      ASN 112 -18.328   7.129 -19.743
  917   HD21  ASN 112          HD22      ASN 112 -19.456   6.327 -17.950
  918   HD22  ASN 112          HD21      ASN 112 -21.098   6.785 -17.543
  919    H    MET 113           H        MET 113 -16.390   9.079 -19.042
  920    HA   MET 113           HA       MET 113 -15.314   9.685 -17.235
  921    HB2  MET 113           HB2      MET 113 -17.354  11.917 -16.982
  922    HB3  MET 113           HB3      MET 113 -15.854  11.778 -16.071
  923    HG2  MET 113           HG2      MET 113 -14.526  11.912 -18.087
  924    HG3  MET 113           HG3      MET 113 -15.965  11.910 -19.111
  925    HE1  MET 113           HE1      MET 113 -14.370  13.995 -20.148
  926    HE2  MET 113           HE2      MET 113 -14.089  15.489 -19.221
  927    HE3  MET 113           HE3      MET 113 -13.299  13.977 -18.726
  928    H    GLN 114           H        GLN 114 -18.817   9.645 -16.521
  929    HA   GLN 114           HA       GLN 114 -18.211   8.985 -13.740
  930    HB2  GLN 114           HB2      GLN 114 -20.737   9.742 -15.232
  931    HB3  GLN 114           HB3      GLN 114 -20.727   9.346 -13.497
  932    HG2  GLN 114           HG2      GLN 114 -19.050  11.190 -13.132
  933    HG3  GLN 114           HG3      GLN 114 -19.273  11.679 -14.818
  934   HE21  GLN 114          HE22      GLN 114 -21.866  11.819 -15.373
  935   HE22  GLN 114          HE21      GLN 114 -22.782  12.721 -14.185
  936    H    THR 115           H        THR 115 -17.742   7.011 -15.869
  937    HA   THR 115           HA       THR 115 -19.599   4.884 -15.479
  938    HB   THR 115           HB       THR 115 -16.687   4.458 -16.167
  939    HG1  THR 115           HG1      THR 115 -17.353   5.053 -18.343
  940   HG21  THR 115          HG21      THR 115 -19.276   3.353 -17.365
  941   HG22  THR 115          HG22      THR 115 -17.620   2.802 -17.720
  942   HG23  THR 115          HG23      THR 115 -18.325   2.519 -16.119
  943    H    SER 116           H        SER 116 -16.794   6.015 -13.593
  944    HA   SER 116           HA       SER 116 -17.148   3.872 -11.597
  945    HB2  SER 116           HB2      SER 116 -15.167   6.151 -11.906
  946    HB3  SER 116           HB3      SER 116 -15.126   4.955 -10.594
  947    HG   SER 116           HG       SER 116 -14.831   3.311 -12.127
  948    H    SER 117           H        SER 117 -18.981   6.340 -12.187
  949    HA   SER 117           HA       SER 117 -20.529   7.542 -11.202
  950    HB2  SER 117           HB2      SER 117 -19.979   5.920  -8.700
  951    HB3  SER 117           HB3      SER 117 -21.470   6.783  -9.121
  952    HG   SER 117           HG       SER 117 -21.587   4.522  -9.620
  953    H    THR 118           H        THR 118 -17.622   7.506  -9.128
  954    HA   THR 118           HA       THR 118 -17.981  10.439  -8.730
  955    HB   THR 118           HB       THR 118 -16.828  10.051  -6.492
  956    HG1  THR 118           HG1      THR 118 -16.194   7.902  -6.659
  957   HG21  THR 118          HG21      THR 118 -18.907   9.549  -5.332
  958   HG22  THR 118          HG22      THR 118 -19.242  10.605  -6.714
  959   HG23  THR 118          HG23      THR 118 -19.628   8.876  -6.807
  960    HA   PRO 119           HA       PRO 119 -13.882   9.405 -10.813
  961    HB2  PRO 119           HB2      PRO 119 -14.168  10.732 -13.138
  962    HB3  PRO 119           HB3      PRO 119 -15.006   9.166 -12.907
  963    HG2  PRO 119           HG2      PRO 119 -16.156  11.942 -12.380
  964    HG3  PRO 119           HG3      PRO 119 -16.798  10.708 -13.502
  965    HD2  PRO 119           HD2      PRO 119 -17.697  10.908 -10.946
  966    HD3  PRO 119           HD3      PRO 119 -17.434   9.293 -11.674
  967    H    GLU 120           H        GLU 120 -12.343  11.230 -11.639
  968    HA   GLU 120           HA       GLU 120 -12.676  13.645  -9.980
  969    HB2  GLU 120           HB2      GLU 120 -10.414  12.751 -11.817
  970    HB3  GLU 120           HB3      GLU 120 -10.470  14.304 -10.991
  971    HG2  GLU 120           HG2      GLU 120 -10.858  12.991  -8.804
  972    HG3  GLU 120           HG3      GLU 120 -10.377  11.553  -9.707
  973    H    PHE 121           H        PHE 121 -13.299  12.731 -13.366
  974    HA   PHE 121           HA       PHE 121 -13.385  15.608 -14.023
  975    HB2  PHE 121           HB2      PHE 121 -13.412  13.206 -15.835
  976    HB3  PHE 121           HB3      PHE 121 -13.510  14.886 -16.349
  977    HD1  PHE 121           HD1      PHE 121 -11.477  16.252 -14.617
  978    HD2  PHE 121           HD2      PHE 121 -11.341  12.489 -16.742
  979    HE1  PHE 121           HE1      PHE 121  -9.045  16.499 -14.899
  980    HE2  PHE 121           HE2      PHE 121  -8.887  12.751 -17.008
  981    HZ   PHE 121           HZ       PHE 121  -7.756  14.795 -16.143
  982    H    ASP 122           H        ASP 122 -15.018  16.729 -14.621
  983    HA   ASP 122           HA       ASP 122 -17.757  15.605 -14.293
  984    HB2  ASP 122           HB2      ASP 122 -17.190  17.185 -12.616
  985    HB3  ASP 122           HB3      ASP 122 -16.478  18.297 -13.781
  986    H    GLY 123           H        GLY 123 -15.698  17.515 -16.522
  987    HA2  GLY 123           HA2      GLY 123 -17.343  16.897 -18.772
  988    HA3  GLY 123           HA3      GLY 123 -17.575  18.595 -18.289
  989    H    TRP 124           H        TRP 124 -16.345  17.609 -20.750
  990    HA   TRP 124           HA       TRP 124 -13.464  18.227 -20.362
  991    HB2  TRP 124           HB2      TRP 124 -13.283  17.280 -22.655
  992    HB3  TRP 124           HB3      TRP 124 -13.738  16.141 -21.402
  993    HD1  TRP 124           HD1      TRP 124 -16.155  15.030 -21.566
  994    HE1  TRP 124           HE1      TRP 124 -17.891  14.857 -23.424
  995    HE3  TRP 124           HE3      TRP 124 -14.300  18.608 -24.737
  996    HZ2  TRP 124           HZ2      TRP 124 -18.413  16.104 -25.990
  997    HZ3  TRP 124           HZ3      TRP 124 -15.445  19.099 -26.874
  998    HH2  TRP 124           HH2      TRP 124 -17.505  17.846 -27.511
  999    H    ARG 125           H        ARG 125 -12.390  19.593 -21.719
 1000    HA   ARG 125           HA       ARG 125 -13.741  21.163 -23.798
 1001    HB2  ARG 125           HB2      ARG 125 -14.127  22.537 -21.780
 1002    HB3  ARG 125           HB3      ARG 125 -12.431  22.418 -21.335
 1003    HG2  ARG 125           HG2      ARG 125 -13.035  24.603 -22.218
 1004    HG3  ARG 125           HG3      ARG 125 -11.758  23.855 -23.160
 1005    HD2  ARG 125           HD2      ARG 125 -14.605  23.481 -24.086
 1006    HD3  ARG 125           HD3      ARG 125 -13.885  25.087 -24.253
 1007    HE   ARG 125           HE       ARG 125 -11.921  23.595 -25.324
 1008   HH11  ARG 125          HH11      ARG 125 -15.408  23.765 -26.058
 1009   HH12  ARG 125          HH12      ARG 125 -15.192  23.405 -27.735
 1010   HH21  ARG 125          HH21      ARG 125 -11.644  23.140 -27.476
 1011   HH22  ARG 125          HH22      ARG 125 -12.987  23.040 -28.579
 1012    H    TRP 126           H        TRP 126 -12.283  20.567 -25.488
 1013    HA   TRP 126           HA       TRP 126  -9.532  20.006 -24.848
 1014    HB2  TRP 126           HB2      TRP 126 -10.680  20.512 -27.600
 1015    HB3  TRP 126           HB3      TRP 126  -9.303  19.501 -27.156
 1016    HD1  TRP 126           HD1      TRP 126 -12.369  18.908 -28.585
 1017    HE1  TRP 126           HE1      TRP 126 -13.597  16.793 -27.841
 1018    HE3  TRP 126           HE3      TRP 126  -9.841  17.990 -24.220
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.498  14.924 -25.631
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.526  16.127 -22.752
 1021    HH2  TRP 126           HH2      TRP 126 -12.371  14.623 -23.403
 1022    H    VAL 127           H        VAL 127  -7.702  21.279 -25.112
 1023    HA   VAL 127           HA       VAL 127  -8.064  24.118 -25.934
 1024    HB   VAL 127           HB       VAL 127  -6.708  24.787 -23.973
 1025   HG11  VAL 127          HG11      VAL 127  -8.442  24.730 -22.311
 1026   HG12  VAL 127          HG12      VAL 127  -9.198  24.904 -23.902
 1027   HG13  VAL 127          HG13      VAL 127  -9.218  23.330 -23.071
 1028   HG21  VAL 127          HG21      VAL 127  -5.534  22.714 -23.427
 1029   HG22  VAL 127          HG22      VAL 127  -6.494  23.220 -22.024
 1030   HG23  VAL 127          HG23      VAL 127  -7.064  21.897 -23.056
 1031    H    SER 128           H        SER 128  -5.966  25.176 -26.467
 1032    HA   SER 128           HA       SER 128  -4.236  23.634 -28.067
 1033    HB2  SER 128           HB2      SER 128  -3.557  26.209 -26.598
 1034    HB3  SER 128           HB3      SER 128  -2.809  25.592 -28.081
 1035    HG   SER 128           HG       SER 128  -4.433  27.194 -28.525
 1036    H    TYR 129           H        TYR 129  -2.029  22.961 -27.727
 1037    HA   TYR 129           HA       TYR 129  -1.568  21.961 -25.070
 1038    HB2  TYR 129           HB2      TYR 129  -0.712  21.119 -27.473
 1039    HB3  TYR 129           HB3      TYR 129   0.657  22.149 -27.092
 1040    HD1  TYR 129           HD1      TYR 129  -0.634  20.571 -24.024
 1041    HD2  TYR 129           HD2      TYR 129   1.708  19.836 -27.594
 1042    HE1  TYR 129           HE1      TYR 129   0.189  18.509 -23.049
 1043    HE2  TYR 129           HE2      TYR 129   2.608  17.780 -26.544
 1044    HH   TYR 129           HH       TYR 129   1.583  16.691 -23.264
 1045    H    TRP 130           H        TRP 130   0.664  22.578 -23.976
 1046    HA   TRP 130           HA       TRP 130   1.666  24.065 -22.663
 1047    HB2  TRP 130           HB2      TRP 130   1.304  26.261 -24.672
 1048    HB3  TRP 130           HB3      TRP 130   2.545  26.072 -23.456
 1049    HD1  TRP 130           HD1      TRP 130   1.728  25.256 -26.992
 1050    HE1  TRP 130           HE1      TRP 130   3.599  23.962 -28.119
 1051    HE3  TRP 130           HE3      TRP 130   4.505  24.151 -22.838
 1052    HZ2  TRP 130           HZ2      TRP 130   6.144  22.752 -27.327
 1053    HZ3  TRP 130           HZ3      TRP 130   6.670  22.948 -23.053
 1054    HH2  TRP 130           HH2      TRP 130   7.511  22.296 -25.296
 1055    H    TYR 131           H        TYR 131  -1.560  25.082 -23.790
 1056    HA   TYR 131           HA       TYR 131  -1.878  27.205 -21.978
 1057    HB2  TYR 131           HB2      TYR 131  -3.382  26.884 -23.819
 1058    HB3  TYR 131           HB3      TYR 131  -3.959  25.360 -23.189
 1059    HD1  TYR 131           HD2      TYR 131  -4.102  29.033 -22.799
 1060    HD2  TYR 131           HD1      TYR 131  -5.526  25.234 -21.309
 1061    HE1  TYR 131           HE2      TYR 131  -5.938  30.185 -21.605
 1062    HE2  TYR 131           HE1      TYR 131  -7.362  26.377 -20.126
 1063    HH   TYR 131           HH       TYR 131  -8.426  28.421 -19.681
 1064    HA   PRO 132           HA       PRO 132  -3.424  24.177 -18.588
 1065    HB2  PRO 132           HB2      PRO 132  -1.997  21.630 -19.281
 1066    HB3  PRO 132           HB3      PRO 132  -3.572  21.884 -18.499
 1067    HG2  PRO 132           HG2      PRO 132  -3.443  21.154 -21.114
 1068    HG3  PRO 132           HG3      PRO 132  -4.635  22.370 -20.555
 1069    HD2  PRO 132           HD2      PRO 132  -1.948  22.856 -21.888
 1070    HD3  PRO 132           HD3      PRO 132  -3.535  23.582 -22.235
 1071    H    VAL 133           H        VAL 133  -0.181  23.984 -20.013
 1072    HA   VAL 133           HA       VAL 133   1.296  23.791 -17.557
 1073    HB   VAL 133           HB       VAL 133   1.762  23.914 -20.415
 1074   HG11  VAL 133          HG11      VAL 133   3.856  25.501 -18.905
 1075   HG12  VAL 133          HG12      VAL 133   3.925  24.939 -20.580
 1076   HG13  VAL 133          HG13      VAL 133   2.736  26.165 -20.127
 1077   HG21  VAL 133          HG21      VAL 133   3.616  23.119 -18.169
 1078   HG22  VAL 133          HG22      VAL 133   2.336  22.086 -18.866
 1079   HG23  VAL 133          HG23      VAL 133   3.681  22.615 -19.884
 1080    H    ARG 134           H        ARG 134  -0.598  26.387 -18.766
 1081    HA   ARG 134           HA       ARG 134   0.765  28.215 -16.806
 1082    HB2  ARG 134           HB2      ARG 134  -1.213  28.806 -19.053
 1083    HB3  ARG 134           HB3      ARG 134  -0.503  30.004 -17.981
 1084    HG2  ARG 134           HG2      ARG 134   1.083  28.311 -19.978
 1085    HG3  ARG 134           HG3      ARG 134   0.491  29.937 -20.246
 1086    HD2  ARG 134           HD2      ARG 134   2.704  30.269 -19.694
 1087    HD3  ARG 134           HD3      ARG 134   1.849  30.669 -18.196
 1088    HE   ARG 134           HE       ARG 134   2.574  27.924 -18.071
 1089   HH11  ARG 134          HH22      ARG 134   4.225  31.078 -18.150
 1090   HH12  ARG 134          HH21      ARG 134   5.656  30.499 -17.376
 1091   HH21  ARG 134          HH11      ARG 134   4.464  27.159 -17.057
 1092   HH22  ARG 134          HH12      ARG 134   5.791  28.225 -16.734
 1093    H    GLN 135           H        GLN 135  -2.160  26.309 -17.422
 1094    HA   GLN 135           HA       GLN 135  -3.746  27.871 -15.548
 1095    HB2  GLN 135           HB2      GLN 135  -4.271  25.054 -16.565
 1096    HB3  GLN 135           HB3      GLN 135  -5.400  26.117 -15.733
 1097    HG2  GLN 135           HG2      GLN 135  -4.521  26.172 -18.580
 1098    HG3  GLN 135           HG3      GLN 135  -6.109  26.366 -17.890
 1099   HE21  GLN 135          HE22      GLN 135  -3.478  28.002 -19.292
 1100   HE22  GLN 135          HE21      GLN 135  -3.957  29.645 -18.900
 1101    H    VAL 136           H        VAL 136  -1.714  24.891 -15.268
 1102    HA   VAL 136           HA       VAL 136  -2.817  24.195 -12.752
 1103    HB   VAL 136           HB       VAL 136  -1.031  22.633 -12.556
 1104   HG11  VAL 136          HG11      VAL 136  -2.951  22.089 -13.852
 1105   HG12  VAL 136          HG12      VAL 136  -2.186  22.673 -15.346
 1106   HG13  VAL 136          HG13      VAL 136  -1.506  21.269 -14.490
 1107   HG21  VAL 136          HG21      VAL 136   0.726  22.333 -14.202
 1108   HG22  VAL 136          HG22      VAL 136   0.189  23.783 -15.097
 1109   HG23  VAL 136          HG23      VAL 136   0.856  23.923 -13.454
 1110    H    VAL 137           H        VAL 137  -1.496  24.007 -10.691
 1111    HA   VAL 137           HA       VAL 137  -0.549  26.553  -9.769
 1112    HB   VAL 137           HB       VAL 137   0.093  25.229  -7.726
 1113   HG11  VAL 137          HG11      VAL 137  -2.119  26.315  -7.982
 1114   HG12  VAL 137          HG12      VAL 137  -2.763  24.846  -8.748
 1115   HG13  VAL 137          HG13      VAL 137  -2.236  24.814  -7.055
 1116   HG21  VAL 137          HG21      VAL 137   0.536  23.013  -8.694
 1117   HG22  VAL 137          HG22      VAL 137  -0.760  22.924  -7.502
 1118   HG23  VAL 137          HG23      VAL 137  -1.164  22.858  -9.214
 1119    H    SER 138           H        SER 138   1.547  27.148  -9.013
 1120    HA   SER 138           HA       SER 138   3.351  27.137 -11.086
 1121    HB2  SER 138           HB2      SER 138   4.911  28.043  -9.187
 1122    HB3  SER 138           HB3      SER 138   3.434  28.919  -9.614
 1123    HG   SER 138           HG       SER 138   3.672  28.661  -7.334
 1124    H    PHE 139           H        PHE 139   3.474  25.019  -8.177
 1125    HA   PHE 139           HA       PHE 139   6.084  24.006  -8.869
 1126    HB2  PHE 139           HB2      PHE 139   5.832  22.412  -7.142
 1127    HB3  PHE 139           HB3      PHE 139   5.161  23.928  -6.577
 1128    HD1  PHE 139           HD2      PHE 139   4.386  20.457  -7.646
 1129    HD2  PHE 139           HD1      PHE 139   2.772  24.128  -6.037
 1130    HE1  PHE 139           HE2      PHE 139   2.283  19.284  -7.050
 1131    HE2  PHE 139           HE1      PHE 139   0.679  22.944  -5.453
 1132    HZ   PHE 139           HZ       PHE 139   0.409  20.536  -5.982
 1133    H    LYS 140           H        LYS 140   2.812  23.063  -9.792
 1134    HA   LYS 140           HA       LYS 140   3.585  20.546 -11.031
 1135    HB2  LYS 140           HB2      LYS 140   1.274  21.255 -10.090
 1136    HB3  LYS 140           HB3      LYS 140   1.089  22.220 -11.530
 1137    HG2  LYS 140           HG2      LYS 140  -0.044  20.306 -12.123
 1138    HG3  LYS 140           HG3      LYS 140   1.525  20.010 -12.850
 1139    HD2  LYS 140           HD2      LYS 140   0.695  17.994 -11.809
 1140    HD3  LYS 140           HD3      LYS 140   2.129  18.527 -10.919
 1141    HE2  LYS 140           HE2      LYS 140   0.817  19.297  -9.048
 1142    HE3  LYS 140           HE3      LYS 140  -0.665  19.329 -10.003
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.658  16.887 -10.044
 1144    HZ2  LYS 140           HZ2      LYS 140   0.735  16.832  -9.167
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.637  17.433  -8.499
 1146    H    ARG 141           H        ARG 141   3.140  23.936 -12.146
 1147    HA   ARG 141           HA       ARG 141   3.120  23.575 -14.922
 1148    HB2  ARG 141           HB2      ARG 141   4.579  25.815 -13.424
 1149    HB3  ARG 141           HB3      ARG 141   4.228  25.797 -15.150
 1150    HG2  ARG 141           HG2      ARG 141   1.780  25.755 -14.657
 1151    HG3  ARG 141           HG3      ARG 141   2.164  25.838 -12.935
 1152    HD2  ARG 141           HD2      ARG 141   3.403  27.999 -13.393
 1153    HD3  ARG 141           HD3      ARG 141   2.746  27.938 -15.045
 1154    HE   ARG 141           HE       ARG 141   0.582  27.587 -13.279
 1155   HH11  ARG 141          HH11      ARG 141   2.903  30.212 -13.977
 1156   HH12  ARG 141          HH12      ARG 141   1.830  31.462 -13.464
 1157   HH21  ARG 141          HH21      ARG 141  -0.830  29.239 -12.667
 1158   HH22  ARG 141          HH22      ARG 141  -0.335  30.894 -12.668
 1159    H    ASP 142           H        ASP 142   6.087  23.822 -12.867
 1160    HA   ASP 142           HA       ASP 142   7.818  23.719 -15.127
 1161    HB2  ASP 142           HB2      ASP 142   8.461  24.741 -13.010
 1162    HB3  ASP 142           HB3      ASP 142   8.491  23.146 -12.236
 1163    H    VAL 143           H        VAL 143   6.420  21.083 -13.165
 1164    HA   VAL 143           HA       VAL 143   8.093  19.032 -14.384
 1165    HB   VAL 143           HB       VAL 143   5.390  18.833 -12.993
 1166   HG11  VAL 143          HG11      VAL 143   6.063  16.807 -14.368
 1167   HG12  VAL 143          HG12      VAL 143   7.509  16.662 -13.345
 1168   HG13  VAL 143          HG13      VAL 143   5.876  16.495 -12.655
 1169   HG21  VAL 143          HG21      VAL 143   6.610  18.300 -10.958
 1170   HG22  VAL 143          HG22      VAL 143   8.177  18.490 -11.786
 1171   HG23  VAL 143          HG23      VAL 143   7.110  19.877 -11.499
 1172    H    TYR 144           H        TYR 144   4.796  20.395 -14.917
 1173    HA   TYR 144           HA       TYR 144   4.032  18.537 -16.872
 1174    HB2  TYR 144           HB2      TYR 144   2.696  20.154 -15.399
 1175    HB3  TYR 144           HB3      TYR 144   2.994  21.385 -16.592
 1176    HD1  TYR 144           HD1      TYR 144   2.364  18.090 -18.169
 1177    HD2  TYR 144           HD2      TYR 144   0.474  21.479 -16.248
 1178    HE1  TYR 144           HE1      TYR 144   0.180  17.311 -18.927
 1179    HE2  TYR 144           HE2      TYR 144  -1.732  20.675 -16.979
 1180    HH   TYR 144           HH       TYR 144  -2.150  17.691 -18.960
 1181    H    ARG 145           H        ARG 145   5.706  21.716 -17.307
 1182    HA   ARG 145           HA       ARG 145   5.654  21.667 -20.169
 1183    HB2  ARG 145           HB2      ARG 145   7.574  23.179 -20.120
 1184    HB3  ARG 145           HB3      ARG 145   6.296  23.681 -19.012
 1185    HG2  ARG 145           HG2      ARG 145   7.534  22.885 -17.103
 1186    HG3  ARG 145           HG3      ARG 145   8.796  22.159 -18.100
 1187    HD2  ARG 145           HD2      ARG 145   8.203  25.126 -18.298
 1188    HD3  ARG 145           HD3      ARG 145   9.175  24.507 -16.978
 1189    HE   ARG 145           HE       ARG 145   9.837  24.376 -19.881
 1190   HH11  ARG 145          HH11      ARG 145  10.979  24.018 -16.469
 1191   HH12  ARG 145          HH12      ARG 145  12.624  23.847 -16.951
 1192   HH21  ARG 145          HH21      ARG 145  12.044  24.201 -20.430
 1193   HH22  ARG 145          HH22      ARG 145  13.250  23.989 -19.214
 1194    H    ARG 146           H        ARG 146   7.632  19.693 -17.980
 1195    HA   ARG 146           HA       ARG 146   9.620  19.028 -19.974
 1196    HB2  ARG 146           HB2      ARG 146   8.698  17.309 -17.604
 1197    HB3  ARG 146           HB3      ARG 146  10.203  17.143 -18.502
 1198    HG2  ARG 146           HG2      ARG 146  10.976  19.348 -17.708
 1199    HG3  ARG 146           HG3      ARG 146   9.421  19.627 -16.926
 1200    HD2  ARG 146           HD2      ARG 146   9.876  17.551 -15.509
 1201    HD3  ARG 146           HD3      ARG 146  11.542  17.636 -16.134
 1202    HE   ARG 146           HE       ARG 146  10.481  20.146 -15.017
 1203   HH11  ARG 146          HH11      ARG 146  12.152  17.116 -14.144
 1204   HH12  ARG 146          HH12      ARG 146  12.861  17.763 -12.711
 1205   HH21  ARG 146          HH21      ARG 146  11.464  21.017 -13.125
 1206   HH22  ARG 146          HH22      ARG 146  12.469  20.021 -12.128
 1207    H    VAL 147           H        VAL 147   6.535  17.574 -18.937
 1208    HA   VAL 147           HA       VAL 147   6.446  15.432 -20.808
 1209    HB   VAL 147           HB       VAL 147   4.078  16.965 -19.660
 1210   HG11  VAL 147          HG11      VAL 147   3.497  15.256 -21.328
 1211   HG12  VAL 147          HG12      VAL 147   4.414  14.036 -20.411
 1212   HG13  VAL 147          HG13      VAL 147   2.953  14.775 -19.718
 1213   HG21  VAL 147          HG21      VAL 147   4.106  15.520 -17.728
 1214   HG22  VAL 147          HG22      VAL 147   5.602  14.724 -18.275
 1215   HG23  VAL 147          HG23      VAL 147   5.596  16.424 -17.755
 1216    H    MET 148           H        MET 148   5.085  18.797 -20.974
 1217    HA   MET 148           HA       MET 148   3.947  18.372 -23.524
 1218    HB2  MET 148           HB2      MET 148   4.716  21.036 -22.282
 1219    HB3  MET 148           HB3      MET 148   3.675  20.788 -23.685
 1220    HG2  MET 148           HG2      MET 148   2.307  19.211 -22.110
 1221    HG3  MET 148           HG3      MET 148   3.122  20.062 -20.806
 1222    HE1  MET 148           HE1      MET 148   0.010  19.816 -21.104
 1223    HE2  MET 148           HE2      MET 148   0.723  20.778 -19.791
 1224    HE3  MET 148           HE3      MET 148  -0.539  21.476 -20.823
 1225    H    LYS 149           H        LYS 149   7.228  19.598 -22.676
 1226    HA   LYS 149           HA       LYS 149   7.968  20.177 -25.387
 1227    HB2  LYS 149           HB2      LYS 149   9.199  21.020 -23.458
 1228    HB3  LYS 149           HB3      LYS 149   9.619  19.400 -22.927
 1229    HG2  LYS 149           HG2      LYS 149  10.418  20.298 -25.710
 1230    HG3  LYS 149           HG3      LYS 149  11.284  20.972 -24.336
 1231    HD2  LYS 149           HD2      LYS 149  11.090  17.960 -24.876
 1232    HD3  LYS 149           HD3      LYS 149  12.410  19.005 -25.392
 1233    HE2  LYS 149           HE2      LYS 149  12.808  19.652 -22.993
 1234    HE3  LYS 149           HE3      LYS 149  11.557  18.499 -22.500
 1235    HZ1  LYS 149           HZ1      LYS 149  12.904  16.714 -23.513
 1236    HZ2  LYS 149           HZ2      LYS 149  14.069  17.804 -23.929
 1237    HZ3  LYS 149           HZ3      LYS 149  13.757  17.512 -22.356
 1238    H    GLU 150           H        GLU 150   8.276  17.179 -23.414
 1239    HA   GLU 150           HA       GLU 150   9.702  15.722 -25.380
 1240    HB2  GLU 150           HB2      GLU 150   7.892  14.912 -23.062
 1241    HB3  GLU 150           HB3      GLU 150   8.638  13.705 -24.099
 1242    HG2  GLU 150           HG2      GLU 150  10.193  15.830 -22.559
 1243    HG3  GLU 150           HG3      GLU 150   9.937  14.174 -22.016
 1244    H    PHE 151           H        PHE 151   6.197  16.287 -25.041
 1245    HA   PHE 151           HA       PHE 151   5.719  14.520 -27.381
 1246    HB2  PHE 151           HB2      PHE 151   3.795  15.689 -25.385
 1247    HB3  PHE 151           HB3      PHE 151   3.394  14.545 -26.652
 1248    HD1  PHE 151           HD1      PHE 151   5.829  12.613 -26.258
 1249    HD2  PHE 151           HD2      PHE 151   3.037  14.463 -23.538
 1250    HE1  PHE 151           HE1      PHE 151   6.082  10.718 -24.701
 1251    HE2  PHE 151           HE2      PHE 151   3.251  12.527 -22.011
 1252    HZ   PHE 151           HZ       PHE 151   4.761  10.656 -22.584
 1253    H    ALA 152           H        ALA 152   6.325  17.787 -27.091
 1254    HA   ALA 152           HA       ALA 152   4.170  19.121 -28.057
 1255    HB1  ALA 152           HB1      ALA 152   6.248  20.261 -27.412
 1256    HB2  ALA 152           HB2      ALA 152   7.087  19.626 -28.839
 1257    HB3  ALA 152           HB3      ALA 152   5.750  20.780 -29.029
 1258    H    SER 153           H        SER 153   6.761  17.919 -30.277
 1259    HA   SER 153           HA       SER 153   5.393  18.366 -32.657
 1260    HB2  SER 153           HB2      SER 153   7.254  16.015 -32.217
 1261    HB3  SER 153           HB3      SER 153   7.054  17.011 -33.670
 1262    HG   SER 153           HG       SER 153   8.950  17.610 -32.527
 1263    H    VAL 154           H        VAL 154   4.873  15.752 -30.339
 1264    HA   VAL 154           HA       VAL 154   3.679  13.906 -32.223
 1265    HB   VAL 154           HB       VAL 154   3.491  13.802 -29.182
 1266   HG11  VAL 154          HG11      VAL 154   3.570  11.621 -31.312
 1267   HG12  VAL 154          HG12      VAL 154   3.516  11.348 -29.552
 1268   HG13  VAL 154          HG13      VAL 154   2.146  12.105 -30.364
 1269   HG21  VAL 154          HG21      VAL 154   5.572  12.435 -29.212
 1270   HG22  VAL 154          HG22      VAL 154   5.792  12.818 -30.929
 1271   HG23  VAL 154          HG23      VAL 154   5.898  14.093 -29.693
 1272    H    VAL 155           H        VAL 155   2.555  16.789 -30.767
 1273    HA   VAL 155           HA       VAL 155  -0.230  16.011 -31.547
 1274    HB   VAL 155           HB       VAL 155   0.418  18.305 -29.671
 1275   HG11  VAL 155          HG11      VAL 155  -2.037  16.501 -30.033
 1276   HG12  VAL 155          HG12      VAL 155  -1.908  17.885 -28.922
 1277   HG13  VAL 155          HG13      VAL 155  -1.853  18.151 -30.670
 1278   HG21  VAL 155          HG21      VAL 155   0.057  15.391 -28.885
 1279   HG22  VAL 155          HG22      VAL 155   1.412  16.458 -28.474
 1280   HG23  VAL 155          HG23      VAL 155  -0.167  16.757 -27.755
 1281    H    MET 156           H        MET 156   2.398  18.379 -31.740
 1282    HA   MET 156           HA       MET 156   0.832  20.331 -33.129
 1283    HB2  MET 156           HB2      MET 156   2.749  20.818 -31.642
 1284    HB3  MET 156           HB3      MET 156   3.841  20.013 -32.769
 1285    HG2  MET 156           HG2      MET 156   3.966  22.423 -32.990
 1286    HG3  MET 156           HG3      MET 156   3.411  21.665 -34.478
 1287    HE1  MET 156           HE1      MET 156   2.510  23.954 -31.424
 1288    HE2  MET 156           HE2      MET 156   0.775  24.261 -31.654
 1289    HE3  MET 156           HE3      MET 156   1.327  22.651 -31.146
 1290    H    SER 157           H        SER 157   3.296  17.912 -34.265
 1291    HA   SER 157           HA       SER 157   3.498  18.915 -36.884
 1292    HB2  SER 157           HB2      SER 157   3.803  16.076 -35.841
 1293    HB3  SER 157           HB3      SER 157   4.418  16.672 -37.396
 1294    HG   SER 157           HG       SER 157   6.113  16.838 -35.929
 1295    H    LEU 158           H        LEU 158   1.138  16.753 -35.411
 1296    HA   LEU 158           HA       LEU 158   0.076  15.520 -37.728
 1297    HB2  LEU 158           HB2      LEU 158  -1.141  16.285 -35.041
 1298    HB3  LEU 158           HB3      LEU 158  -2.066  15.463 -36.304
 1299    HG   LEU 158           HG       LEU 158  -0.643  13.509 -36.215
 1300   HD11  LEU 158          HD11      LEU 158   1.546  14.350 -35.558
 1301   HD12  LEU 158          HD12      LEU 158   0.889  14.968 -34.014
 1302   HD13  LEU 158          HD13      LEU 158   0.989  13.224 -34.319
 1303   HD21  LEU 158          HD21      LEU 158  -1.325  12.752 -33.964
 1304   HD22  LEU 158          HD22      LEU 158  -1.616  14.441 -33.468
 1305   HD23  LEU 158          HD23      LEU 158  -2.615  13.690 -34.732
 1306    H    GLN 159           H        GLN 159  -0.476  18.774 -36.348
 1307    HA   GLN 159           HA       GLN 159  -2.537  19.332 -38.411
 1308    HB2  GLN 159           HB2      GLN 159  -1.813  21.156 -36.102
 1309    HB3  GLN 159           HB3      GLN 159  -3.278  21.133 -37.077
 1310    HG2  GLN 159           HG2      GLN 159  -2.431  19.211 -34.905
 1311    HG3  GLN 159           HG3      GLN 159  -3.823  20.284 -34.992
 1312   HE21  GLN 159          HE22      GLN 159  -3.191  17.086 -34.935
 1313   HE22  GLN 159          HE21      GLN 159  -4.619  16.566 -35.820
 1314    H    GLU 160           H        GLU 160   0.762  19.520 -38.257
 1315    HA   GLU 160           HA       GLU 160   0.971  21.998 -39.886
 1316    HB2  GLU 160           HB2      GLU 160   2.594  21.569 -38.019
 1317    HB3  GLU 160           HB3      GLU 160   3.119  20.100 -38.850
 1318    HG2  GLU 160           HG2      GLU 160   3.870  21.440 -40.785
 1319    HG3  GLU 160           HG3      GLU 160   3.252  22.913 -40.028
 1320    H    ASN 161           H        ASN 161   1.140  18.495 -39.954
 1321    HA   ASN 161           HA       ASN 161   2.110  18.038 -42.568
 1322    HB2  ASN 161           HB2      ASN 161   2.165  16.248 -41.023
 1323    HB3  ASN 161           HB3      ASN 161   0.490  16.478 -40.530
 1324   HD21  ASN 161          HD22      ASN 161  -1.205  15.504 -41.690
 1325   HD22  ASN 161          HD21      ASN 161  -0.920  14.413 -43.027
 1326    H    THR 162           H        THR 162  -1.222  18.749 -41.386
 1327    HA   THR 162           HA       THR 162  -2.499  18.005 -43.781
 1328    HB   THR 162           HB       THR 162  -4.274  19.713 -42.687
 1329    HG1  THR 162           HG1      THR 162  -3.999  19.784 -40.494
 1330   HG21  THR 162          HG21      THR 162  -3.570  16.939 -41.613
 1331   HG22  THR 162          HG22      THR 162  -5.129  17.768 -41.420
 1332   HG23  THR 162          HG23      THR 162  -4.587  17.276 -43.032
 1333    HA   PRO 163           HA       PRO 163  -2.169  22.446 -45.378
 1334    HB2  PRO 163           HB2      PRO 163  -0.580  24.304 -44.109
 1335    HB3  PRO 163           HB3      PRO 163  -2.313  24.054 -43.742
 1336    HG2  PRO 163           HG2      PRO 163   0.079  22.915 -42.274
 1337    HG3  PRO 163           HG3      PRO 163  -1.371  23.701 -41.583
 1338    HD2  PRO 163           HD2      PRO 163  -1.173  20.979 -41.734
 1339    HD3  PRO 163           HD3      PRO 163  -2.724  21.799 -42.021
 1340    H    LYS 164           H        LYS 164   0.714  21.061 -43.820
 1341    HA   LYS 164           HA       LYS 164   2.825  20.782 -44.420
 1342    HB2  LYS 164           HB2      LYS 164   1.596  19.210 -46.014
 1343    HB3  LYS 164           HB3      LYS 164   1.887  20.410 -47.274
 1344    HG2  LYS 164           HG2      LYS 164   4.361  20.183 -46.868
 1345    HG3  LYS 164           HG3      LYS 164   4.024  19.039 -45.567
 1346    HD2  LYS 164           HD2      LYS 164   4.686  17.813 -47.526
 1347    HD3  LYS 164           HD3      LYS 164   2.980  17.481 -47.198
 1348    HE2  LYS 164           HE2      LYS 164   2.317  19.101 -48.959
 1349    HE3  LYS 164           HE3      LYS 164   4.014  19.501 -49.249
 1350    HZ1  LYS 164           HZ1      LYS 164   4.369  17.214 -49.986
 1351    HZ2  LYS 164           HZ2      LYS 164   2.799  16.829 -49.707
 1352    HZ3  LYS 164           HZ3      LYS 164   3.189  17.909 -50.869
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  -1.707   0.048  -2.431
    2    H2   MET   1           H2       MET   1  -0.745   1.005  -1.518
    3    H3   MET   1           H3       MET   1  -1.637   1.664  -2.718
    4    HA   MET   1           HA       MET   1   0.601  -0.233  -3.076
    5    HB2  MET   1           HB2      MET   1  -1.229  -0.478  -4.776
    6    HB3  MET   1           HB3      MET   1  -1.003   1.203  -5.253
    7    HG2  MET   1           HG2      MET   1   1.344   0.669  -5.920
    8    HG3  MET   1           HG3      MET   1   1.076  -1.015  -5.443
    9    HE1  MET   1           HE1      MET   1   1.254  -1.430  -9.296
   10    HE2  MET   1           HE2      MET   1   2.241  -0.368  -8.275
   11    HE3  MET   1           HE3      MET   1   1.824  -2.000  -7.713
   12    H    ILE   2           H        ILE   2   2.501   0.848  -2.502
   13    HA   ILE   2           HA       ILE   2   2.923   3.552  -3.618
   14    HB   ILE   2           HB       ILE   2   3.402   2.691  -0.746
   15   HG12  ILE   2          HG12      ILE   2   1.199   3.724  -1.105
   16   HG13  ILE   2          HG13      ILE   2   2.247   4.702  -0.089
   17   HG21  ILE   2          HG21      ILE   2   4.700   4.939  -2.288
   18   HG22  ILE   2          HG22      ILE   2   4.497   5.032  -0.527
   19   HG23  ILE   2          HG23      ILE   2   5.443   3.719  -1.229
   20   HD11  ILE   2          HD11      ILE   2   1.600   5.253  -3.009
   21   HD12  ILE   2          HD12      ILE   2   0.988   6.129  -1.603
   22   HD13  ILE   2          HD13      ILE   2   2.714   6.215  -2.015
   23    H    ASP   3           H        ASP   3   4.841   3.730  -4.563
   24    HA   ASP   3           HA       ASP   3   6.619   1.462  -5.002
   25    HB2  ASP   3           HB2      ASP   3   6.097   3.168  -6.734
   26    HB3  ASP   3           HB3      ASP   3   6.816   4.408  -5.722
   27    H    ASP   4           H        ASP   4   8.663   1.300  -4.093
   28    HA   ASP   4           HA       ASP   4   8.854   1.618  -1.393
   29    HB2  ASP   4           HB2      ASP   4  10.181   0.053  -2.730
   30    HB3  ASP   4           HB3      ASP   4  11.134   1.391  -3.380
   31    H    ASP   5           H        ASP   5   9.913   4.112  -3.690
   32    HA   ASP   5           HA       ASP   5  11.556   5.466  -1.750
   33    HB2  ASP   5           HB2      ASP   5  11.960   5.494  -4.221
   34    HB3  ASP   5           HB3      ASP   5  10.534   6.523  -4.395
   35    H    GLY   6           H        GLY   6   8.226   5.212  -2.032
   36    HA2  GLY   6           HA2      GLY   6   6.747   6.152  -0.466
   37    HA3  GLY   6           HA3      GLY   6   7.725   7.628  -0.380
   38    H    TYR   7           H        TYR   7   6.532   5.820  -3.311
   39    HA   TYR   7           HA       TYR   7   5.294   8.408  -4.172
   40    HB2  TYR   7           HB2      TYR   7   7.270   6.623  -5.574
   41    HB3  TYR   7           HB3      TYR   7   6.061   7.503  -6.500
   42    HD1  TYR   7           HD1      TYR   7   8.778   8.040  -3.952
   43    HD2  TYR   7           HD2      TYR   7   6.325   9.749  -7.034
   44    HE1  TYR   7           HE1      TYR   7  10.023  10.166  -3.762
   45    HE2  TYR   7           HE2      TYR   7   7.529  11.869  -6.844
   46    HH   TYR   7           HH       TYR   7   9.080  13.088  -5.626
   47    H    ARG   8           H        ARG   8   3.320   8.337  -5.177
   48    HA   ARG   8           HA       ARG   8   1.912   5.729  -5.181
   49    HB2  ARG   8           HB2      ARG   8   0.839   7.803  -4.324
   50    HB3  ARG   8           HB3      ARG   8   0.962   8.532  -5.918
   51    HG2  ARG   8           HG2      ARG   8  -1.277   7.805  -5.606
   52    HG3  ARG   8           HG3      ARG   8  -0.571   6.696  -6.785
   53    HD2  ARG   8           HD2      ARG   8  -0.263   5.001  -5.007
   54    HD3  ARG   8           HD3      ARG   8  -0.916   6.102  -3.798
   55    HE   ARG   8           HE       ARG   8  -2.327   4.560  -5.854
   56   HH11  ARG   8          HH11      ARG   8  -2.709   7.244  -3.522
   57   HH12  ARG   8          HH12      ARG   8  -4.428   7.125  -3.483
   58   HH21  ARG   8          HH21      ARG   8  -4.621   4.415  -5.759
   59   HH22  ARG   8          HH22      ARG   8  -5.527   5.499  -4.770
   60    HA   PRO   9           HA       PRO   9   3.158   5.497  -9.532
   61    HB2  PRO   9           HB2      PRO   9   1.632   2.931  -9.589
   62    HB3  PRO   9           HB3      PRO   9   3.336   3.244 -10.043
   63    HG2  PRO   9           HG2      PRO   9   2.713   1.934  -7.744
   64    HG3  PRO   9           HG3      PRO   9   4.026   3.154  -7.773
   65    HD2  PRO   9           HD2      PRO   9   1.141   3.554  -6.911
   66    HD3  PRO   9           HD3      PRO   9   2.648   3.967  -6.042
   67    H    ASN  10           H        ASN  10   2.126   6.254 -11.383
   68    HA   ASN  10           HA       ASN  10  -0.843   6.296 -11.535
   69    HB2  ASN  10           HB2      ASN  10   1.061   8.666 -11.348
   70    HB3  ASN  10           HB3      ASN  10  -0.496   8.803 -12.167
   71   HD21  ASN  10          HD22      ASN  10   1.007   8.170  -8.967
   72   HD22  ASN  10          HD21      ASN  10  -0.479   8.566  -8.103
   73    H    VAL  11           H        VAL  11  -1.659   6.901 -13.546
   74    HA   VAL  11           HA       VAL  11   0.129   6.882 -15.919
   75    HB   VAL  11           HB       VAL  11  -1.885   5.525 -16.877
   76   HG11  VAL  11          HG11      VAL  11   0.123   4.212 -15.012
   77   HG12  VAL  11          HG12      VAL  11  -0.803   3.392 -16.292
   78   HG13  VAL  11          HG13      VAL  11   0.385   4.637 -16.716
   79   HG21  VAL  11          HG21      VAL  11  -3.272   5.696 -14.778
   80   HG22  VAL  11          HG22      VAL  11  -3.064   4.043 -15.373
   81   HG23  VAL  11          HG23      VAL  11  -2.136   4.599 -13.978
   82    H    GLY  12           H        GLY  12  -0.207   9.302 -15.652
   83    HA2  GLY  12           HA2      GLY  12  -2.780  10.509 -15.696
   84    HA3  GLY  12           HA3      GLY  12  -1.274  11.270 -16.220
   85    H    ILE  13           H        ILE  13  -4.266  10.690 -17.273
   86    HA   ILE  13           HA       ILE  13  -3.729   9.698 -19.969
   87    HB   ILE  13           HB       ILE  13  -6.223  10.702 -18.531
   88   HG12  ILE  13          HG12      ILE  13  -5.430   8.585 -17.575
   89   HG13  ILE  13          HG13      ILE  13  -6.941   8.390 -18.431
   90   HG21  ILE  13          HG21      ILE  13  -7.485   9.579 -20.401
   91   HG22  ILE  13          HG22      ILE  13  -6.665  11.085 -20.787
   92   HG23  ILE  13          HG23      ILE  13  -5.959   9.534 -21.319
   93   HD11  ILE  13          HD11      ILE  13  -4.197   7.597 -19.505
   94   HD12  ILE  13          HD12      ILE  13  -5.406   6.514 -18.813
   95   HD13  ILE  13          HD13      ILE  13  -5.753   7.345 -20.336
   96    H    VAL  14           H        VAL  14  -2.691  11.126 -21.348
   97    HA   VAL  14           HA       VAL  14  -2.881  13.962 -20.765
   98    HB   VAL  14           HB       VAL  14  -0.815  12.393 -21.379
   99   HG11  VAL  14          HG11      VAL  14   0.026  12.638 -23.561
  100   HG12  VAL  14          HG12      VAL  14  -1.626  11.984 -23.719
  101   HG13  VAL  14          HG13      VAL  14  -1.301  13.696 -24.069
  102   HG21  VAL  14          HG21      VAL  14  -0.937  15.313 -22.211
  103   HG22  VAL  14          HG22      VAL  14  -0.695  14.725 -20.555
  104   HG23  VAL  14          HG23      VAL  14   0.513  14.372 -21.792
  105    H    ILE  15           H        ILE  15  -4.587  12.019 -22.998
  106    HA   ILE  15           HA       ILE  15  -5.224  12.299 -25.179
  107    HB   ILE  15           HB       ILE  15  -7.032  14.245 -23.728
  108   HG12  ILE  15          HG12      ILE  15  -6.977  12.079 -22.632
  109   HG13  ILE  15          HG13      ILE  15  -8.535  12.443 -23.331
  110   HG21  ILE  15          HG21      ILE  15  -8.740  13.601 -25.431
  111   HG22  ILE  15          HG22      ILE  15  -7.422  14.558 -26.074
  112   HG23  ILE  15          HG23      ILE  15  -7.438  12.815 -26.377
  113   HD11  ILE  15          HD11      ILE  15  -8.200  10.873 -25.158
  114   HD12  ILE  15          HD12      ILE  15  -6.490  10.669 -24.764
  115   HD13  ILE  15          HD13      ILE  15  -7.739  10.031 -23.668
  116    H    CYS  16           H        CYS  16  -4.345  13.020 -26.895
  117    HA   CYS  16           HA       CYS  16  -4.095  15.993 -27.176
  118    HB2  CYS  16           HB2      CYS  16  -2.404  13.816 -28.423
  119    HB3  CYS  16           HB3      CYS  16  -2.521  15.480 -29.069
  120    HG   CYS  16           HG       CYS  16  -1.921  14.657 -25.904
  121    H    ASN  17           H        ASN  17  -5.531  16.837 -28.379
  122    HA   ASN  17           HA       ASN  17  -7.330  15.184 -30.046
  123    HB2  ASN  17           HB2      ASN  17  -8.332  16.975 -28.608
  124    HB3  ASN  17           HB3      ASN  17  -7.357  18.190 -29.441
  125   HD21  ASN  17          HD22      ASN  17 -10.317  16.356 -29.597
  126   HD22  ASN  17          HD21      ASN  17 -10.742  16.758 -31.241
  127    H    ARG  18           H        ARG  18  -7.158  15.269 -32.281
  128    HA   ARG  18           HA       ARG  18  -4.577  15.734 -33.329
  129    HB2  ARG  18           HB2      ARG  18  -7.138  15.295 -34.913
  130    HB3  ARG  18           HB3      ARG  18  -5.480  14.906 -35.406
  131    HG2  ARG  18           HG2      ARG  18  -5.343  13.254 -33.516
  132    HG3  ARG  18           HG3      ARG  18  -7.051  13.595 -33.135
  133    HD2  ARG  18           HD2      ARG  18  -7.610  13.063 -35.528
  134    HD3  ARG  18           HD3      ARG  18  -5.916  12.524 -35.727
  135    HE   ARG  18           HE       ARG  18  -7.382  11.309 -33.470
  136   HH11  ARG  18          HH11      ARG  18  -6.693  10.915 -36.947
  137   HH12  ARG  18          HH12      ARG  18  -7.037   9.222 -36.952
  138   HH21  ARG  18          HH21      ARG  18  -7.847   9.151 -33.477
  139   HH22  ARG  18          HH22      ARG  18  -7.703   8.170 -34.918
  140    H    GLN  19           H        GLN  19  -6.991  18.112 -32.881
  141    HA   GLN  19           HA       GLN  19  -6.130  19.793 -35.123
  142    HB2  GLN  19           HB2      GLN  19  -7.673  20.329 -32.563
  143    HB3  GLN  19           HB3      GLN  19  -7.357  21.555 -33.806
  144    HG2  GLN  19           HG2      GLN  19  -8.658  20.472 -35.439
  145    HG3  GLN  19           HG3      GLN  19  -8.699  18.944 -34.559
  146   HE21  GLN  19          HE22      GLN  19  -9.884  18.847 -32.512
  147   HE22  GLN  19          HE21      GLN  19 -11.285  19.886 -32.258
  148    H    GLY  20           H        GLY  20  -4.562  18.740 -32.264
  149    HA2  GLY  20           HA2      GLY  20  -2.292  19.206 -31.829
  150    HA3  GLY  20           HA3      GLY  20  -2.452  20.831 -32.516
  151    H    GLN  21           H        GLN  21  -4.420  19.120 -30.062
  152    HA   GLN  21           HA       GLN  21  -3.892  21.349 -28.153
  153    HB2  GLN  21           HB2      GLN  21  -6.599  20.715 -29.395
  154    HB3  GLN  21           HB3      GLN  21  -6.450  21.419 -27.795
  155    HG2  GLN  21           HG2      GLN  21  -6.647  23.343 -28.983
  156    HG3  GLN  21           HG3      GLN  21  -4.903  23.219 -28.945
  157   HE21  GLN  21          HE22      GLN  21  -3.785  23.128 -31.028
  158   HE22  GLN  21          HE21      GLN  21  -4.620  22.947 -32.540
  159    H    VAL  22           H        VAL  22  -4.596  20.826 -25.947
  160    HA   VAL  22           HA       VAL  22  -4.218  17.895 -25.500
  161    HB   VAL  22           HB       VAL  22  -3.110  20.280 -23.994
  162   HG11  VAL  22          HG11      VAL  22  -3.351  18.446 -22.397
  163   HG12  VAL  22          HG12      VAL  22  -2.640  17.299 -23.560
  164   HG13  VAL  22          HG13      VAL  22  -1.654  18.583 -22.847
  165   HG21  VAL  22          HG21      VAL  22  -2.009  19.873 -26.208
  166   HG22  VAL  22          HG22      VAL  22  -0.926  19.534 -24.861
  167   HG23  VAL  22          HG23      VAL  22  -1.701  18.197 -25.733
  168    H    MET  23           H        MET  23  -5.040  16.968 -23.597
  169    HA   MET  23           HA       MET  23  -7.682  17.391 -22.893
  170    HB2  MET  23           HB2      MET  23  -5.947  15.455 -22.413
  171    HB3  MET  23           HB3      MET  23  -5.702  16.279 -20.893
  172    HG2  MET  23           HG2      MET  23  -8.359  15.278 -22.000
  173    HG3  MET  23           HG3      MET  23  -7.358  14.439 -20.815
  174    HE1  MET  23           HE1      MET  23  -9.477  14.135 -19.261
  175    HE2  MET  23           HE2      MET  23 -10.577  15.463 -18.831
  176    HE3  MET  23           HE3      MET  23 -10.422  14.946 -20.534
  177    H    TRP  24           H        TRP  24  -8.700  18.812 -21.489
  178    HA   TRP  24           HA       TRP  24  -7.513  19.534 -19.044
  179    HB2  TRP  24           HB2      TRP  24  -6.643  21.337 -20.723
  180    HB3  TRP  24           HB3      TRP  24  -8.280  21.981 -20.662
  181    HD1  TRP  24           HD1      TRP  24  -8.413  23.873 -18.922
  182    HE1  TRP  24           HE1      TRP  24  -7.327  24.459 -16.697
  183    HE3  TRP  24           HE3      TRP  24  -5.275  19.845 -18.466
  184    HZ2  TRP  24           HZ2      TRP  24  -5.316  23.319 -14.910
  185    HZ3  TRP  24           HZ3      TRP  24  -3.772  19.641 -16.529
  186    HH2  TRP  24           HH2      TRP  24  -3.796  21.361 -14.724
  187    H    ALA  25           H        ALA  25  -9.257  19.913 -17.568
  188    HA   ALA  25           HA       ALA  25 -11.989  20.179 -18.586
  189    HB1  ALA  25           HB1      ALA  25 -11.631  17.787 -18.928
  190    HB2  ALA  25           HB2      ALA  25 -11.007  17.616 -17.269
  191    HB3  ALA  25           HB3      ALA  25 -12.709  18.045 -17.539
  192    H    ARG  26           H        ARG  26 -13.405  20.892 -16.981
  193    HA   ARG  26           HA       ARG  26 -12.157  22.054 -14.636
  194    HB2  ARG  26           HB2      ARG  26 -14.052  23.073 -15.916
  195    HB3  ARG  26           HB3      ARG  26 -15.104  21.754 -15.388
  196    HG2  ARG  26           HG2      ARG  26 -14.795  22.476 -13.013
  197    HG3  ARG  26           HG3      ARG  26 -13.680  23.748 -13.556
  198    HD2  ARG  26           HD2      ARG  26 -15.896  24.686 -13.119
  199    HD3  ARG  26           HD3      ARG  26 -15.473  24.830 -14.834
  200    HE   ARG  26           HE       ARG  26 -16.953  22.415 -14.444
  201   HH11  ARG  26          HH11      ARG  26 -17.510  25.929 -14.400
  202   HH12  ARG  26          HH12      ARG  26 -19.146  25.808 -14.942
  203   HH21  ARG  26          HH21      ARG  26 -19.070  22.246 -15.227
  204   HH22  ARG  26          HH22      ARG  26 -20.067  23.663 -15.397
  205    H    ARG  27           H        ARG  27 -12.262  21.288 -12.483
  206    HA   ARG  27           HA       ARG  27 -12.669  18.405 -12.314
  207    HB2  ARG  27           HB2      ARG  27 -10.633  19.742 -11.535
  208    HB3  ARG  27           HB3      ARG  27 -11.580  20.244 -10.156
  209    HG2  ARG  27           HG2      ARG  27 -10.833  17.378 -10.902
  210    HG3  ARG  27           HG3      ARG  27 -10.064  18.395  -9.686
  211    HD2  ARG  27           HD2      ARG  27 -12.123  18.421  -8.345
  212    HD3  ARG  27           HD3      ARG  27 -12.840  17.265  -9.484
  213    HE   ARG  27           HE       ARG  27 -10.280  16.349  -8.574
  214   HH11  ARG  27          HH11      ARG  27 -13.643  16.739  -7.406
  215   HH12  ARG  27          HH12      ARG  27 -13.515  15.454  -6.252
  216   HH21  ARG  27          HH21      ARG  27 -10.237  14.470  -7.264
  217   HH22  ARG  27          HH22      ARG  27 -11.505  14.190  -6.109
  218    H    PHE  28           H        PHE  28 -14.290  17.458 -11.416
  219    HA   PHE  28           HA       PHE  28 -16.771  18.678 -10.736
  220    HB2  PHE  28           HB2      PHE  28 -16.757  16.542 -11.710
  221    HB3  PHE  28           HB3      PHE  28 -15.460  15.958 -10.695
  222    HD1  PHE  28           HD2      PHE  28 -19.108  16.818 -10.589
  223    HD2  PHE  28           HD1      PHE  28 -15.809  14.660  -8.833
  224    HE1  PHE  28           HE2      PHE  28 -20.699  15.455  -9.274
  225    HE2  PHE  28           HE1      PHE  28 -17.417  13.211  -7.590
  226    HZ   PHE  28           HZ       PHE  28 -19.863  13.639  -7.775
  227    H    GLY  29           H        GLY  29 -17.674  19.177  -8.745
  228    HA2  GLY  29           HA2      GLY  29 -17.916  19.458  -6.496
  229    HA3  GLY  29           HA3      GLY  29 -16.562  18.356  -6.213
  230    H    GLN  30           H        GLN  30 -14.644  19.917  -7.828
  231    HA   GLN  30           HA       GLN  30 -13.879  21.890  -5.816
  232    HB2  GLN  30           HB2      GLN  30 -12.420  20.135  -6.997
  233    HB3  GLN  30           HB3      GLN  30 -12.520  21.176  -8.428
  234    HG2  GLN  30           HG2      GLN  30 -11.543  23.021  -6.909
  235    HG3  GLN  30           HG3      GLN  30 -11.212  21.734  -5.748
  236   HE21  GLN  30          HE22      GLN  30 -10.099  23.345  -8.571
  237   HE22  GLN  30          HE21      GLN  30  -8.857  22.222  -9.097
  238    H    HIS  31           H        HIS  31 -15.041  21.826  -9.181
  239    HA   HIS  31           HA       HIS  31 -15.686  23.329 -10.660
  240    HB2  HIS  31           HB2      HIS  31 -16.398  25.088  -8.299
  241    HB3  HIS  31           HB3      HIS  31 -16.987  25.268  -9.951
  242    HD1  HIS  31           HD1      HIS  31 -18.705  23.264 -10.835
  243    HD2  HIS  31           HD2      HIS  31 -17.592  23.266  -6.768
  244    HE1  HIS  31           HE1      HIS  31 -20.303  21.673  -9.650
  245    H    SER  32           H        SER  32 -12.921  23.215 -10.080
  246    HA   SER  32           HA       SER  32 -12.127  25.489 -11.662
  247    HB2  SER  32           HB2      SER  32 -10.146  26.008 -10.146
  248    HB3  SER  32           HB3      SER  32 -11.723  26.563  -9.598
  249    HG   SER  32           HG       SER  32 -10.755  25.642  -7.849
  250    H    TRP  33           H        TRP  33  -9.457  24.942 -11.968
  251    HA   TRP  33           HA       TRP  33  -9.739  22.470 -13.430
  252    HB2  TRP  33           HB2      TRP  33  -7.343  24.316 -13.221
  253    HB3  TRP  33           HB3      TRP  33  -7.711  23.147 -14.494
  254    HD1  TRP  33           HD1      TRP  33  -8.362  26.700 -13.464
  255    HE1  TRP  33           HE1      TRP  33 -10.020  27.848 -15.024
  256    HE3  TRP  33           HE3      TRP  33  -9.794  22.649 -16.233
  257    HZ2  TRP  33           HZ2      TRP  33 -11.696  27.128 -17.288
  258    HZ3  TRP  33           HZ3      TRP  33 -11.403  22.909 -18.092
  259    HH2  TRP  33           HH2      TRP  33 -12.363  25.144 -18.633
  260    H    GLN  34           H        GLN  34  -8.061  20.759 -13.540
  261    HA   GLN  34           HA       GLN  34  -6.224  20.493 -11.309
  262    HB2  GLN  34           HB2      GLN  34  -8.402  19.500 -10.487
  263    HB3  GLN  34           HB3      GLN  34  -8.294  18.309 -11.787
  264    HG2  GLN  34           HG2      GLN  34  -5.906  17.837 -10.616
  265    HG3  GLN  34           HG3      GLN  34  -6.700  18.567  -9.237
  266   HE21  GLN  34          HE22      GLN  34  -6.583  15.776 -11.409
  267   HE22  GLN  34          HE21      GLN  34  -7.683  14.757 -10.476
  268    H    PHE  35           H        PHE  35  -4.579  19.075 -11.807
  269    HA   PHE  35           HA       PHE  35  -3.882  18.473 -14.511
  270    HB2  PHE  35           HB2      PHE  35  -2.183  16.963 -13.206
  271    HB3  PHE  35           HB3      PHE  35  -2.068  18.701 -13.053
  272    HD1  PHE  35           HD1      PHE  35  -3.141  15.599 -11.287
  273    HD2  PHE  35           HD2      PHE  35  -2.554  19.864 -10.946
  274    HE1  PHE  35           HE1      PHE  35  -3.650  15.490  -8.865
  275    HE2  PHE  35           HE2      PHE  35  -3.077  19.741  -8.534
  276    HZ   PHE  35           HZ       PHE  35  -3.671  17.565  -7.489
  277    HA   PRO  36           HA       PRO  36  -6.020  14.471 -14.886
  278    HB2  PRO  36           HB2      PRO  36  -3.544  13.849 -16.475
  279    HB3  PRO  36           HB3      PRO  36  -5.231  13.432 -16.870
  280    HG2  PRO  36           HG2      PRO  36  -4.094  15.549 -18.116
  281    HG3  PRO  36           HG3      PRO  36  -5.743  15.730 -17.431
  282    HD2  PRO  36           HD2      PRO  36  -3.105  16.631 -16.225
  283    HD3  PRO  36           HD3      PRO  36  -4.676  17.490 -16.323
  284    H    GLN  37           H        GLN  37  -5.619  12.272 -14.206
  285    HA   GLN  37           HA       GLN  37  -3.205  11.260 -13.245
  286    HB2  GLN  37           HB2      GLN  37  -3.598  11.188 -10.810
  287    HB3  GLN  37           HB3      GLN  37  -3.216  12.800 -11.388
  288    HG2  GLN  37           HG2      GLN  37  -5.628  13.423 -11.277
  289    HG3  GLN  37           HG3      GLN  37  -6.014  11.793 -10.720
  290   HE21  GLN  37          HE22      GLN  37  -6.999  13.460  -9.103
  291   HE22  GLN  37          HE21      GLN  37  -6.037  13.721  -7.650
  292    H    GLY  38           H        GLY  38  -3.458   9.046 -12.676
  293    HA2  GLY  38           HA2      GLY  38  -5.933   8.026 -11.627
  294    HA3  GLY  38           HA3      GLY  38  -5.607   7.466 -13.282
  295    H    GLY  39           H        GLY  39  -5.354   6.207 -10.375
  296    HA2  GLY  39           HA2      GLY  39  -2.527   5.745  -9.999
  297    HA3  GLY  39           HA3      GLY  39  -3.864   5.053  -9.083
  298    H    ILE  40           H        ILE  40  -1.855   3.422  -9.603
  299    HA   ILE  40           HA       ILE  40  -2.647   1.706 -11.907
  300    HB   ILE  40           HB       ILE  40  -0.149   1.806 -10.215
  301   HG12  ILE  40          HG12      ILE  40  -0.825   2.404 -13.137
  302   HG13  ILE  40          HG13      ILE  40  -0.281   3.542 -11.913
  303   HG21  ILE  40          HG21      ILE  40  -0.731  -0.215 -12.416
  304   HG22  ILE  40          HG22      ILE  40   0.793  -0.026 -11.535
  305   HG23  ILE  40          HG23      ILE  40  -0.629  -0.568 -10.676
  306   HD11  ILE  40          HD11      ILE  40   1.368   1.412 -13.311
  307   HD12  ILE  40          HD12      ILE  40   1.540   3.172 -13.379
  308   HD13  ILE  40          HD13      ILE  40   1.948   2.307 -11.888
  309    H    ASN  41           H        ASN  41  -3.202  -0.418 -11.643
  310    HA   ASN  41           HA       ASN  41  -4.535  -1.123  -9.107
  311    HB2  ASN  41           HB2      ASN  41  -5.868  -1.315 -11.113
  312    HB3  ASN  41           HB3      ASN  41  -4.553  -2.105 -11.970
  313   HD21  ASN  41          HD22      ASN  41  -5.925  -3.782 -12.602
  314   HD22  ASN  41          HD21      ASN  41  -6.448  -5.046 -11.480
  315    HA   PRO  42           HA       PRO  42  -0.931  -3.208  -7.873
  316    HB2  PRO  42           HB2      PRO  42  -2.827  -5.170  -6.541
  317    HB3  PRO  42           HB3      PRO  42  -1.297  -4.480  -5.897
  318    HG2  PRO  42           HG2      PRO  42  -3.664  -3.385  -5.187
  319    HG3  PRO  42           HG3      PRO  42  -2.300  -2.320  -5.656
  320    HD2  PRO  42           HD2      PRO  42  -4.697  -3.135  -7.289
  321    HD3  PRO  42           HD3      PRO  42  -3.882  -1.546  -7.170
  322    H    GLY  43           H        GLY  43   0.257  -4.147  -9.235
  323    HA2  GLY  43           HA2      GLY  43   1.376  -5.944 -10.197
  324    HA3  GLY  43           HA3      GLY  43   0.010  -7.013  -9.824
  325    H    GLU  44           H        GLU  44  -1.181  -4.225 -11.318
  326    HA   GLU  44           HA       GLU  44  -1.385  -5.524 -13.988
  327    HB2  GLU  44           HB2      GLU  44  -3.374  -4.630 -12.796
  328    HB3  GLU  44           HB3      GLU  44  -2.688  -2.996 -12.945
  329    HG2  GLU  44           HG2      GLU  44  -2.908  -2.958 -15.236
  330    HG3  GLU  44           HG3      GLU  44  -2.907  -4.718 -15.394
  331    H    SER  45           H        SER  45  -0.184  -4.900 -15.673
  332    HA   SER  45           HA       SER  45   2.074  -3.214 -15.269
  333    HB2  SER  45           HB2      SER  45   2.222  -3.806 -17.865
  334    HB3  SER  45           HB3      SER  45   2.603  -4.959 -16.578
  335    HG   SER  45           HG       SER  45   1.231  -6.105 -17.767
  336    H    ALA  46           H        ALA  46   2.690  -1.492 -16.753
  337    HA   ALA  46           HA       ALA  46   1.247   0.745 -16.131
  338    HB1  ALA  46           HB1      ALA  46   3.622   0.673 -16.826
  339    HB2  ALA  46           HB2      ALA  46   3.127   0.318 -18.501
  340    HB3  ALA  46           HB3      ALA  46   2.722   1.893 -17.745
  341    H    GLU  47           H        GLU  47   1.066  -1.040 -19.263
  342    HA   GLU  47           HA       GLU  47  -0.668   1.001 -20.444
  343    HB2  GLU  47           HB2      GLU  47   0.046  -1.838 -21.290
  344    HB3  GLU  47           HB3      GLU  47  -1.072  -0.813 -22.194
  345    HG2  GLU  47           HG2      GLU  47   0.636   0.830 -22.622
  346    HG3  GLU  47           HG3      GLU  47   1.797  -0.003 -21.573
  347    H    GLN  48           H        GLN  48  -1.125  -2.252 -19.067
  348    HA   GLN  48           HA       GLN  48  -3.894  -2.481 -19.443
  349    HB2  GLN  48           HB2      GLN  48  -1.999  -3.731 -17.396
  350    HB3  GLN  48           HB3      GLN  48  -3.700  -4.137 -17.525
  351    HG2  GLN  48           HG2      GLN  48  -2.205  -5.727 -18.727
  352    HG3  GLN  48           HG3      GLN  48  -3.501  -5.044 -19.699
  353   HE21  GLN  48          HE22      GLN  48   0.027  -4.488 -18.956
  354   HE22  GLN  48          HE21      GLN  48   0.428  -3.948 -20.570
  355    H    ALA  49           H        ALA  49  -2.072  -0.998 -16.728
  356    HA   ALA  49           HA       ALA  49  -4.420  -0.262 -15.224
  357    HB1  ALA  49           HB1      ALA  49  -2.849   1.138 -13.951
  358    HB2  ALA  49           HB2      ALA  49  -2.258  -0.532 -14.131
  359    HB3  ALA  49           HB3      ALA  49  -1.564   0.786 -15.120
  360    H    MET  50           H        MET  50  -2.465   1.377 -17.772
  361    HA   MET  50           HA       MET  50  -3.604   3.951 -17.426
  362    HB2  MET  50           HB2      MET  50  -1.572   3.620 -18.668
  363    HB3  MET  50           HB3      MET  50  -2.380   2.620 -19.865
  364    HG2  MET  50           HG2      MET  50  -3.168   5.498 -19.327
  365    HG3  MET  50           HG3      MET  50  -1.896   5.071 -20.450
  366    HE1  MET  50           HE1      MET  50  -3.652   3.393 -23.441
  367    HE2  MET  50           HE2      MET  50  -2.133   4.038 -22.782
  368    HE3  MET  50           HE3      MET  50  -2.845   2.550 -22.107
  369    H    TYR  51           H        TYR  51  -4.837   1.149 -19.350
  370    HA   TYR  51           HA       TYR  51  -7.094   2.603 -20.188
  371    HB2  TYR  51           HB2      TYR  51  -6.863  -0.376 -19.697
  372    HB3  TYR  51           HB3      TYR  51  -8.124   0.418 -20.630
  373    HD1  TYR  51           HD2      TYR  51  -7.418   1.747 -22.771
  374    HD2  TYR  51           HD1      TYR  51  -4.797  -0.910 -20.654
  375    HE1  TYR  51           HE2      TYR  51  -6.034   1.499 -24.816
  376    HE2  TYR  51           HE1      TYR  51  -3.396  -1.187 -22.670
  377    HH   TYR  51           HH       TYR  51  -3.181  -0.690 -24.968
  378    H    ARG  52           H        ARG  52  -6.508   1.132 -16.987
  379    HA   ARG  52           HA       ARG  52  -9.292   1.296 -16.107
  380    HB2  ARG  52           HB2      ARG  52  -6.816   1.639 -14.350
  381    HB3  ARG  52           HB3      ARG  52  -8.436   1.253 -13.829
  382    HG2  ARG  52           HG2      ARG  52  -6.656  -0.561 -15.505
  383    HG3  ARG  52           HG3      ARG  52  -6.847  -0.643 -13.756
  384    HD2  ARG  52           HD2      ARG  52  -9.228  -1.199 -14.001
  385    HD3  ARG  52           HD3      ARG  52  -9.087  -1.093 -15.773
  386    HE   ARG  52           HE       ARG  52  -7.066  -2.821 -14.785
  387   HH11  ARG  52          HH21      ARG  52 -10.635  -2.917 -14.891
  388   HH12  ARG  52          HH22      ARG  52 -10.706  -4.628 -15.122
  389   HH21  ARG  52          HH11      ARG  52  -7.146  -4.996 -15.228
  390   HH22  ARG  52          HH12      ARG  52  -8.657  -5.869 -15.273
  391    H    ALA  53           H        ALA  53  -6.429   3.483 -15.904
  392    HA   ALA  53           HA       ALA  53  -7.838   5.623 -14.659
  393    HB1  ALA  53           HB1      ALA  53  -5.941   7.010 -15.485
  394    HB2  ALA  53           HB2      ALA  53  -5.435   5.522 -14.650
  395    HB3  ALA  53           HB3      ALA  53  -5.370   5.635 -16.433
  396    H    LEU  54           H        LEU  54  -7.481   4.715 -18.068
  397    HA   LEU  54           HA       LEU  54  -8.336   7.062 -19.360
  398    HB2  LEU  54           HB2      LEU  54  -7.358   4.995 -20.348
  399    HB3  LEU  54           HB3      LEU  54  -8.862   4.153 -19.944
  400    HG   LEU  54           HG       LEU  54 -10.103   5.480 -21.541
  401   HD11  LEU  54          HD11      LEU  54  -7.410   6.730 -22.153
  402   HD12  LEU  54          HD12      LEU  54  -8.880   6.901 -23.157
  403   HD13  LEU  54          HD13      LEU  54  -8.842   7.566 -21.518
  404   HD21  LEU  54          HD21      LEU  54  -9.111   3.351 -22.065
  405   HD22  LEU  54          HD22      LEU  54  -9.159   4.410 -23.484
  406   HD23  LEU  54          HD23      LEU  54  -7.612   4.154 -22.617
  407    H    PHE  55           H        PHE  55 -10.159   4.272 -18.172
  408    HA   PHE  55           HA       PHE  55 -12.758   5.337 -18.609
  409    HB2  PHE  55           HB2      PHE  55 -12.814   3.076 -18.333
  410    HB3  PHE  55           HB3      PHE  55 -11.551   3.054 -17.124
  411    HD1  PHE  55           HD1      PHE  55 -15.184   3.560 -17.656
  412    HD2  PHE  55           HD2      PHE  55 -11.970   3.277 -14.800
  413    HE1  PHE  55           HE1      PHE  55 -16.847   3.482 -15.797
  414    HE2  PHE  55           HE2      PHE  55 -13.633   3.147 -12.937
  415    HZ   PHE  55           HZ       PHE  55 -16.069   3.265 -13.439
  416    H    GLU  56           H        GLU  56 -10.700   5.474 -15.592
  417    HA   GLU  56           HA       GLU  56 -12.636   6.869 -14.075
  418    HB2  GLU  56           HB2      GLU  56  -9.593   6.908 -13.877
  419    HB3  GLU  56           HB3      GLU  56 -10.674   7.610 -12.678
  420    HG2  GLU  56           HG2      GLU  56 -11.701   5.397 -12.277
  421    HG3  GLU  56           HG3      GLU  56 -10.586   4.660 -13.428
  422    H    GLU  57           H        GLU  57 -10.097   8.177 -16.237
  423    HA   GLU  57           HA       GLU  57 -10.448  10.903 -15.371
  424    HB2  GLU  57           HB2      GLU  57  -8.868   9.727 -17.711
  425    HB3  GLU  57           HB3      GLU  57  -8.805  11.395 -17.174
  426    HG2  GLU  57           HG2      GLU  57  -8.305   9.852 -14.838
  427    HG3  GLU  57           HG3      GLU  57  -7.405   9.066 -16.130
  428    H    VAL  58           H        VAL  58 -11.287   9.120 -18.427
  429    HA   VAL  58           HA       VAL  58 -13.035  11.378 -19.205
  430    HB   VAL  58           HB       VAL  58 -12.210  10.904 -21.519
  431   HG11  VAL  58          HG11      VAL  58 -10.102  11.915 -19.581
  432   HG12  VAL  58          HG12      VAL  58 -10.243  12.311 -21.309
  433   HG13  VAL  58          HG13      VAL  58 -11.498  12.844 -20.176
  434   HG21  VAL  58          HG21      VAL  58 -11.115   8.713 -21.158
  435   HG22  VAL  58          HG22      VAL  58 -10.033   9.914 -21.888
  436   HG23  VAL  58          HG23      VAL  58  -9.873   9.507 -20.168
  437    H    GLY  59           H        GLY  59 -13.226   8.202 -18.291
  438    HA2  GLY  59           HA2      GLY  59 -14.807   6.583 -18.628
  439    HA3  GLY  59           HA3      GLY  59 -15.859   7.836 -19.305
  440    H    LEU  60           H        LEU  60 -12.699   6.797 -20.542
  441    HA   LEU  60           HA       LEU  60 -14.007   5.776 -23.021
  442    HB2  LEU  60           HB2      LEU  60 -11.250   6.982 -22.575
  443    HB3  LEU  60           HB3      LEU  60 -11.757   6.188 -24.049
  444    HG   LEU  60           HG       LEU  60 -12.852   8.741 -22.833
  445   HD11  LEU  60          HD11      LEU  60 -10.686   8.926 -24.029
  446   HD12  LEU  60          HD12      LEU  60 -11.451   8.254 -25.497
  447   HD13  LEU  60          HD13      LEU  60 -11.970   9.814 -24.853
  448   HD21  LEU  60          HD21      LEU  60 -14.251   8.961 -24.922
  449   HD22  LEU  60          HD22      LEU  60 -13.909   7.262 -25.274
  450   HD23  LEU  60          HD23      LEU  60 -14.798   7.714 -23.809
  451    H    SER  61           H        SER  61 -13.155   3.762 -23.812
  452    HA   SER  61           HA       SER  61 -11.941   2.091 -21.650
  453    HB2  SER  61           HB2      SER  61 -13.940   1.293 -23.788
  454    HB3  SER  61           HB3      SER  61 -13.340   0.285 -22.456
  455    HG   SER  61           HG       SER  61 -15.397   1.213 -21.977
  456    H    ARG  62           H        ARG  62 -11.088  -0.072 -22.856
  457    HA   ARG  62           HA       ARG  62  -8.754   0.912 -24.156
  458    HB2  ARG  62           HB2      ARG  62  -7.864  -1.328 -23.865
  459    HB3  ARG  62           HB3      ARG  62  -8.689  -0.778 -22.419
  460    HG2  ARG  62           HG2      ARG  62 -10.691  -2.189 -23.071
  461    HG3  ARG  62           HG3      ARG  62  -9.728  -2.829 -24.405
  462    HD2  ARG  62           HD2      ARG  62  -9.490  -4.412 -22.645
  463    HD3  ARG  62           HD3      ARG  62  -7.973  -3.538 -22.732
  464    HE   ARG  62           HE       ARG  62  -8.323  -2.645 -20.633
  465   HH11  ARG  62          HH11      ARG  62 -11.337  -4.221 -21.681
  466   HH12  ARG  62          HH12      ARG  62 -12.092  -4.129 -20.131
  467   HH21  ARG  62          HH21      ARG  62  -9.327  -2.548 -18.553
  468   HH22  ARG  62          HH22      ARG  62 -10.926  -3.159 -18.328
  469    H    LYS  63           H        LYS  63 -10.383   1.693 -25.849
  470    HA   LYS  63           HA       LYS  63  -9.830   0.365 -28.386
  471    HB2  LYS  63           HB2      LYS  63 -12.115  -0.221 -28.927
  472    HB3  LYS  63           HB3      LYS  63 -11.647  -1.020 -27.419
  473    HG2  LYS  63           HG2      LYS  63 -12.888   0.704 -26.114
  474    HG3  LYS  63           HG3      LYS  63 -13.392   1.479 -27.627
  475    HD2  LYS  63           HD2      LYS  63 -14.574  -0.564 -28.315
  476    HD3  LYS  63           HD3      LYS  63 -14.058  -1.383 -26.820
  477    HE2  LYS  63           HE2      LYS  63 -15.237   0.320 -25.465
  478    HE3  LYS  63           HE3      LYS  63 -15.719   1.179 -26.934
  479    HZ1  LYS  63           HZ1      LYS  63 -16.579  -1.582 -26.214
  480    HZ2  LYS  63           HZ2      LYS  63 -17.507  -0.242 -26.114
  481    HZ3  LYS  63           HZ3      LYS  63 -17.026  -0.781 -27.574
  482    H    ASP  64           H        ASP  64 -11.110   2.980 -26.449
  483    HA   ASP  64           HA       ASP  64 -12.252   4.493 -28.654
  484    HB2  ASP  64           HB2      ASP  64 -11.901   4.833 -25.659
  485    HB3  ASP  64           HB3      ASP  64 -12.599   6.113 -26.641
  486    H    VAL  65           H        VAL  65  -9.102   4.076 -27.965
  487    HA   VAL  65           HA       VAL  65  -8.248   6.786 -28.665
  488    HB   VAL  65           HB       VAL  65  -6.722   6.885 -26.714
  489   HG11  VAL  65          HG11      VAL  65  -8.971   8.050 -26.771
  490   HG12  VAL  65          HG12      VAL  65  -9.583   6.743 -25.736
  491   HG13  VAL  65          HG13      VAL  65  -8.272   7.797 -25.169
  492   HG21  VAL  65          HG21      VAL  65  -8.357   4.527 -25.640
  493   HG22  VAL  65          HG22      VAL  65  -6.638   4.494 -26.076
  494   HG23  VAL  65          HG23      VAL  65  -7.184   5.464 -24.712
  495    H    ARG  66           H        ARG  66  -5.751   6.750 -28.836
  496    HA   ARG  66           HA       ARG  66  -4.748   4.144 -29.923
  497    HB2  ARG  66           HB2      ARG  66  -5.719   5.342 -31.778
  498    HB3  ARG  66           HB3      ARG  66  -5.137   6.893 -31.189
  499    HG2  ARG  66           HG2      ARG  66  -3.908   6.343 -33.109
  500    HG3  ARG  66           HG3      ARG  66  -2.826   6.279 -31.732
  501    HD2  ARG  66           HD2      ARG  66  -4.155   3.701 -32.602
  502    HD3  ARG  66           HD3      ARG  66  -2.952   4.388 -33.701
  503    HE   ARG  66           HE       ARG  66  -1.589   4.425 -31.337
  504   HH11  ARG  66          HH21      ARG  66  -3.224   1.831 -33.154
  505   HH12  ARG  66          HH22      ARG  66  -2.078   0.621 -32.698
  506   HH21  ARG  66          HH11      ARG  66  -0.082   2.885 -30.789
  507   HH22  ARG  66          HH12      ARG  66  -0.241   1.230 -31.293
  508    H    ILE  67           H        ILE  67  -2.748   3.818 -28.770
  509    HA   ILE  67           HA       ILE  67  -1.460   6.099 -27.495
  510    HB   ILE  67           HB       ILE  67  -0.556   3.223 -27.879
  511   HG12  ILE  67          HG12      ILE  67  -1.691   4.352 -25.294
  512   HG13  ILE  67          HG13      ILE  67  -2.787   3.717 -26.514
  513   HG21  ILE  67          HG21      ILE  67   0.941   3.694 -25.942
  514   HG22  ILE  67          HG22      ILE  67   1.317   4.701 -27.335
  515   HG23  ILE  67          HG23      ILE  67   0.414   5.394 -25.958
  516   HD11  ILE  67          HD11      ILE  67  -0.515   2.137 -25.220
  517   HD12  ILE  67          HD12      ILE  67  -2.242   2.000 -24.873
  518   HD13  ILE  67          HD13      ILE  67  -1.634   1.549 -26.480
  519    H    LEU  68           H        LEU  68   0.002   7.452 -28.424
  520    HA   LEU  68           HA       LEU  68   1.343   6.587 -30.951
  521    HB2  LEU  68           HB2      LEU  68   0.267   9.164 -29.980
  522    HB3  LEU  68           HB3      LEU  68   1.920   9.303 -30.536
  523    HG   LEU  68           HG       LEU  68   0.238   9.832 -32.263
  524   HD11  LEU  68          HD11      LEU  68   2.005   7.438 -32.962
  525   HD12  LEU  68          HD12      LEU  68   1.304   8.603 -34.099
  526   HD13  LEU  68          HD13      LEU  68   2.513   9.140 -32.918
  527   HD21  LEU  68          HD21      LEU  68  -1.105   8.145 -33.316
  528   HD22  LEU  68          HD22      LEU  68  -0.371   6.843 -32.366
  529   HD23  LEU  68          HD23      LEU  68  -1.408   8.045 -31.569
  530    H    ALA  69           H        ALA  69   1.954   7.622 -27.595
  531    HA   ALA  69           HA       ALA  69   4.735   6.808 -27.687
  532    HB1  ALA  69           HB1      ALA  69   4.083   9.800 -27.329
  533    HB2  ALA  69           HB2      ALA  69   5.679   9.044 -27.175
  534    HB3  ALA  69           HB3      ALA  69   4.868   9.106 -28.747
  535    H    SER  70           H        SER  70   5.706   7.411 -25.371
  536    HA   SER  70           HA       SER  70   3.757   8.139 -23.356
  537    HB2  SER  70           HB2      SER  70   4.123   6.177 -21.928
  538    HB3  SER  70           HB3      SER  70   3.322   5.743 -23.439
  539    HG   SER  70           HG       SER  70   5.230   4.860 -24.218
  540    H    THR  71           H        THR  71   4.937   8.638 -21.235
  541    HA   THR  71           HA       THR  71   7.309  10.064 -21.684
  542    HB   THR  71           HB       THR  71   6.611   8.853 -19.001
  543    HG1  THR  71           HG1      THR  71   5.223  11.001 -20.269
  544   HG21  THR  71          HG21      THR  71   7.423  11.684 -19.803
  545   HG22  THR  71          HG22      THR  71   7.086  11.091 -18.164
  546   HG23  THR  71          HG23      THR  71   8.494  10.479 -19.056
  547    H    ARG  72           H        ARG  72   9.477   9.505 -21.690
  548    HA   ARG  72           HA       ARG  72  10.029   6.794 -22.324
  549    HB2  ARG  72           HB2      ARG  72  11.796   9.202 -21.783
  550    HB3  ARG  72           HB3      ARG  72  12.457   7.632 -22.277
  551    HG2  ARG  72           HG2      ARG  72  11.084   7.655 -24.324
  552    HG3  ARG  72           HG3      ARG  72  10.407   9.227 -23.892
  553    HD2  ARG  72           HD2      ARG  72  13.372   8.692 -24.318
  554    HD3  ARG  72           HD3      ARG  72  12.279   9.286 -25.578
  555    HE   ARG  72           HE       ARG  72  11.823  11.148 -23.690
  556   HH11  ARG  72          HH11      ARG  72  14.956   9.930 -24.921
  557   HH12  ARG  72          HH12      ARG  72  15.769  11.426 -24.630
  558   HH21  ARG  72          HH21      ARG  72  12.809  12.998 -23.378
  559   HH22  ARG  72          HH22      ARG  72  14.519  13.273 -23.700
  560    H    ASN  73           H        ASN  73  10.203   8.401 -19.206
  561    HA   ASN  73           HA       ASN  73  10.503   5.825 -17.966
  562    HB2  ASN  73           HB2      ASN  73  12.283   6.369 -16.445
  563    HB3  ASN  73           HB3      ASN  73  12.899   6.577 -18.072
  564   HD21  ASN  73          HD22      ASN  73  13.258   8.829 -18.867
  565   HD22  ASN  73          HD21      ASN  73  13.396  10.140 -17.721
  566    H    TRP  74           H        TRP  74  10.124   6.146 -15.496
  567    HA   TRP  74           HA       TRP  74   7.664   7.595 -15.263
  568    HB2  TRP  74           HB2      TRP  74   9.377   6.267 -13.114
  569    HB3  TRP  74           HB3      TRP  74   7.713   6.823 -12.939
  570    HD1  TRP  74           HD1      TRP  74   9.792   4.077 -14.627
  571    HE1  TRP  74           HE1      TRP  74   8.280   2.205 -15.457
  572    HE3  TRP  74           HE3      TRP  74   5.249   6.081 -13.370
  573    HZ2  TRP  74           HZ2      TRP  74   5.472   1.645 -15.609
  574    HZ3  TRP  74           HZ3      TRP  74   3.161   4.838 -13.858
  575    HH2  TRP  74           HH2      TRP  74   3.242   2.654 -15.022
  576    H    LEU  75           H        LEU  75   7.445   9.701 -14.869
  577    HA   LEU  75           HA       LEU  75   9.687  11.323 -13.858
  578    HB2  LEU  75           HB2      LEU  75   6.870  11.937 -14.835
  579    HB3  LEU  75           HB3      LEU  75   7.847  13.164 -14.031
  580    HG   LEU  75           HG       LEU  75   8.652  11.709 -16.580
  581   HD11  LEU  75          HD11      LEU  75   8.149  13.845 -17.691
  582   HD12  LEU  75          HD12      LEU  75   6.717  13.232 -16.849
  583   HD13  LEU  75          HD13      LEU  75   7.642  14.562 -16.133
  584   HD21  LEU  75          HD21      LEU  75   9.977  14.017 -15.084
  585   HD22  LEU  75          HD22      LEU  75  10.671  12.409 -15.419
  586   HD23  LEU  75          HD23      LEU  75  10.378  13.522 -16.748
  587    H    ARG  76           H        ARG  76   9.442  12.675 -11.991
  588    HA   ARG  76           HA       ARG  76   7.534  11.826  -9.891
  589    HB2  ARG  76           HB2      ARG  76  10.580  11.658  -9.784
  590    HB3  ARG  76           HB3      ARG  76   9.623  11.812  -8.316
  591    HG2  ARG  76           HG2      ARG  76   8.542   9.696  -8.638
  592    HG3  ARG  76           HG3      ARG  76   9.119   9.564 -10.298
  593    HD2  ARG  76           HD2      ARG  76  10.351   8.086  -8.846
  594    HD3  ARG  76           HD3      ARG  76  11.392   9.273  -9.616
  595    HE   ARG  76           HE       ARG  76  10.592   9.122  -6.738
  596   HH11  ARG  76          HH21      ARG  76  12.623  10.762  -9.177
  597   HH12  ARG  76          HH22      ARG  76  13.714  11.415  -8.014
  598   HH21  ARG  76          HH11      ARG  76  12.229   9.757  -5.247
  599   HH22  ARG  76          HH12      ARG  76  13.434  10.902  -5.733
  600    H    TYR  77           H        TYR  77   7.358  13.468  -8.254
  601    HA   TYR  77           HA       TYR  77   9.003  15.874  -8.357
  602    HB2  TYR  77           HB2      TYR  77   6.990  17.354  -8.330
  603    HB3  TYR  77           HB3      TYR  77   7.297  16.572  -9.858
  604    HD1  TYR  77           HD2      TYR  77   5.015  16.613  -6.895
  605    HD2  TYR  77           HD1      TYR  77   5.691  15.050 -10.855
  606    HE1  TYR  77           HE2      TYR  77   2.655  15.928  -7.029
  607    HE2  TYR  77           HE1      TYR  77   3.319  14.451 -11.045
  608    HH   TYR  77           HH       TYR  77   1.225  14.428  -9.999
  609    H    LYS  78           H        LYS  78   8.188  17.271  -6.320
  610    HA   LYS  78           HA       LYS  78   7.471  15.337  -4.149
  611    HB2  LYS  78           HB2      LYS  78   9.060  17.926  -3.979
  612    HB3  LYS  78           HB3      LYS  78   8.409  17.088  -2.575
  613    HG2  LYS  78           HG2      LYS  78  10.339  15.775  -4.531
  614    HG3  LYS  78           HG3      LYS  78  10.841  16.666  -3.089
  615    HD2  LYS  78           HD2      LYS  78   9.638  15.083  -1.630
  616    HD3  LYS  78           HD3      LYS  78   9.029  14.218  -3.044
  617    HE2  LYS  78           HE2      LYS  78  10.886  12.947  -2.243
  618    HE3  LYS  78           HE3      LYS  78  11.365  13.697  -3.760
  619    HZ1  LYS  78           HZ1      LYS  78  13.096  13.867  -2.044
  620    HZ2  LYS  78           HZ2      LYS  78  12.621  15.357  -2.493
  621    HZ3  LYS  78           HZ3      LYS  78  12.123  14.728  -1.062
  622    H    LEU  79           H        LEU  79   5.657  15.689  -3.112
  623    HA   LEU  79           HA       LEU  79   3.796  17.816  -3.868
  624    HB2  LEU  79           HB2      LEU  79   3.900  15.762  -1.606
  625    HB3  LEU  79           HB3      LEU  79   2.592  16.917  -1.762
  626    HG   LEU  79           HG       LEU  79   3.287  15.043  -4.049
  627   HD11  LEU  79          HD11      LEU  79   2.845  13.656  -2.032
  628   HD12  LEU  79          HD12      LEU  79   1.283  14.474  -1.824
  629   HD13  LEU  79          HD13      LEU  79   1.594  13.474  -3.263
  630   HD21  LEU  79          HD21      LEU  79   0.935  15.430  -4.687
  631   HD22  LEU  79          HD22      LEU  79   0.702  16.474  -3.276
  632   HD23  LEU  79          HD23      LEU  79   1.809  16.961  -4.578
  633    HA   PRO  80           HA       PRO  80   5.487  20.890  -0.974
  634    HB2  PRO  80           HB2      PRO  80   2.543  21.303  -0.337
  635    HB3  PRO  80           HB3      PRO  80   3.822  22.539  -0.580
  636    HG2  PRO  80           HG2      PRO  80   2.104  21.988  -2.588
  637    HG3  PRO  80           HG3      PRO  80   3.854  22.135  -2.949
  638    HD2  PRO  80           HD2      PRO  80   2.224  19.612  -2.593
  639    HD3  PRO  80           HD3      PRO  80   3.477  19.997  -3.816
  640    H    LYS  81           H        LYS  81   5.948  20.782   1.361
  641    HA   LYS  81           HA       LYS  81   5.829  18.240   2.290
  642    HB2  LYS  81           HB2      LYS  81   6.979  20.603   3.204
  643    HB3  LYS  81           HB3      LYS  81   5.904  20.205   4.546
  644    HG2  LYS  81           HG2      LYS  81   8.050  18.453   3.320
  645    HG3  LYS  81           HG3      LYS  81   8.114  19.308   4.868
  646    HD2  LYS  81           HD2      LYS  81   6.247  17.850   5.724
  647    HD3  LYS  81           HD3      LYS  81   6.197  17.004   4.180
  648    HE2  LYS  81           HE2      LYS  81   7.472  15.623   5.654
  649    HE3  LYS  81           HE3      LYS  81   8.606  16.322   4.502
  650    HZ1  LYS  81           HZ1      LYS  81   8.194  17.314   7.280
  651    HZ2  LYS  81           HZ2      LYS  81   9.444  16.387   6.787
  652    HZ3  LYS  81           HZ3      LYS  81   9.298  17.902   6.215
  653    H    ARG  82           H        ARG  82   3.646  20.842   3.296
  654    HA   ARG  82           HA       ARG  82   2.122  19.376   5.188
  655    HB2  ARG  82           HB2      ARG  82   0.561  21.261   5.080
  656    HB3  ARG  82           HB3      ARG  82   2.226  21.796   5.120
  657    HG2  ARG  82           HG2      ARG  82   1.842  21.791   2.391
  658    HG3  ARG  82           HG3      ARG  82   0.178  21.996   2.923
  659    HD2  ARG  82           HD2      ARG  82   1.135  24.167   2.557
  660    HD3  ARG  82           HD3      ARG  82   0.911  23.958   4.307
  661    HE   ARG  82           HE       ARG  82   3.576  23.164   3.488
  662   HH11  ARG  82          HH11      ARG  82   1.603  26.079   4.031
  663   HH12  ARG  82          HH12      ARG  82   2.949  27.089   4.418
  664   HH21  ARG  82          HH21      ARG  82   5.373  24.516   4.032
  665   HH22  ARG  82          HH22      ARG  82   5.129  26.181   4.410
  666    H    LEU  83           H        LEU  83   2.158  19.044   1.785
  667    HA   LEU  83           HA       LEU  83  -0.520  17.825   1.703
  668    HB2  LEU  83           HB2      LEU  83   0.198  19.740   0.131
  669    HB3  LEU  83           HB3      LEU  83   1.264  18.565  -0.635
  670    HG   LEU  83           HG       LEU  83  -0.720  17.198  -1.287
  671   HD11  LEU  83          HD11      LEU  83  -3.005  18.202  -1.023
  672   HD12  LEU  83          HD12      LEU  83  -2.309  17.695   0.510
  673   HD13  LEU  83          HD13      LEU  83  -2.315  19.419   0.078
  674   HD21  LEU  83          HD21      LEU  83  -0.913  20.149  -2.027
  675   HD22  LEU  83          HD22      LEU  83   0.100  18.926  -2.819
  676   HD23  LEU  83          HD23      LEU  83  -1.654  18.803  -2.922
  677    H    VAL  84           H        VAL  84   2.657  16.767   2.375
  678    HA   VAL  84           HA       VAL  84   2.781  14.366   0.832
  679    HB   VAL  84           HB       VAL  84   3.755  15.176   3.609
  680   HG11  VAL  84          HG11      VAL  84   4.366  12.538   2.219
  681   HG12  VAL  84          HG12      VAL  84   5.174  13.167   3.665
  682   HG13  VAL  84          HG13      VAL  84   3.466  12.747   3.732
  683   HG21  VAL  84          HG21      VAL  84   5.973  15.173   2.515
  684   HG22  VAL  84          HG22      VAL  84   5.230  14.675   0.982
  685   HG23  VAL  84          HG23      VAL  84   4.863  16.261   1.662
  686    H    ARG  85           H        ARG  85   1.854  12.385   1.256
  687    HA   ARG  85           HA       ARG  85  -0.619  12.505   2.918
  688    HB2  ARG  85           HB2      ARG  85   0.158  10.086   1.308
  689    HB3  ARG  85           HB3      ARG  85  -1.416  10.541   1.926
  690    HG2  ARG  85           HG2      ARG  85   0.126  11.954  -0.267
  691    HG3  ARG  85           HG3      ARG  85  -1.252  10.867  -0.496
  692    HD2  ARG  85           HD2      ARG  85  -1.357  13.552   0.935
  693    HD3  ARG  85           HD3      ARG  85  -1.814  13.290  -0.744
  694    HE   ARG  85           HE       ARG  85  -3.456  11.572   0.143
  695   HH11  ARG  85          HH12      ARG  85  -2.709  14.603   1.864
  696   HH12  ARG  85          HH11      ARG  85  -4.221  14.660   2.698
  697   HH21  ARG  85          HH21      ARG  85  -5.455  11.643   1.277
  698   HH22  ARG  85          HH22      ARG  85  -5.815  12.955   2.338
  699    H    TRP  86           H        TRP  86  -0.697  11.688   4.756
  700    HA   TRP  86           HA       TRP  86   1.687  10.290   5.893
  701    HB2  TRP  86           HB2      TRP  86  -0.373  12.088   7.204
  702    HB3  TRP  86           HB3      TRP  86   0.899  11.230   8.064
  703    HD1  TRP  86           HD1      TRP  86   0.324  14.341   6.015
  704    HE1  TRP  86           HE1      TRP  86   2.473  15.711   5.808
  705    HE3  TRP  86           HE3      TRP  86   3.604  10.983   8.054
  706    HZ2  TRP  86           HZ2      TRP  86   5.274  15.384   6.433
  707    HZ3  TRP  86           HZ3      TRP  86   6.020  11.530   8.217
  708    HH2  TRP  86           HH2      TRP  86   6.870  13.718   7.409
  709    H    ASP  87           H        ASP  87  -1.298   9.473   4.751
  710    HA   ASP  87           HA       ASP  87  -1.850   7.419   6.849
  711    HB2  ASP  87           HB2      ASP  87  -3.642   9.036   6.288
  712    HB3  ASP  87           HB3      ASP  87  -3.582   8.509   4.608
  713    H    THR  88           H        THR  88  -0.358   7.766   3.728
  714    HA   THR  88           HA       THR  88  -1.477   5.422   2.513
  715    HB   THR  88           HB       THR  88   0.524   5.899   0.937
  716    HG1  THR  88           HG1      THR  88   1.878   7.135   1.968
  717   HG21  THR  88          HG21      THR  88  -1.532   8.083   1.474
  718   HG22  THR  88          HG22      THR  88  -0.567   7.903  -0.010
  719   HG23  THR  88          HG23      THR  88  -1.758   6.664   0.422
  720    H    LYS  89           H        LYS  89   1.437   6.080   4.348
  721    HA   LYS  89           HA       LYS  89   3.159   4.806   5.190
  722    HB2  LYS  89           HB2      LYS  89   0.746   3.155   5.958
  723    HB3  LYS  89           HB3      LYS  89   2.366   3.026   6.670
  724    HG2  LYS  89           HG2      LYS  89   2.239   5.487   7.263
  725    HG3  LYS  89           HG3      LYS  89   0.554   5.483   6.715
  726    HD2  LYS  89           HD2      LYS  89   0.036   3.717   8.394
  727    HD3  LYS  89           HD3      LYS  89   1.728   3.783   8.950
  728    HE2  LYS  89           HE2      LYS  89   1.434   6.197   9.514
  729    HE3  LYS  89           HE3      LYS  89  -0.247   6.121   8.970
  730    HZ1  LYS  89           HZ1      LYS  89   0.878   4.584  11.252
  731    HZ2  LYS  89           HZ2      LYS  89  -0.086   5.895  11.372
  732    HZ3  LYS  89           HZ3      LYS  89  -0.681   4.510  10.740
  733    HA   PRO  90           HA       PRO  90   5.273   4.447   4.261
  734    HB2  PRO  90           HB2      PRO  90   5.789   4.485   1.295
  735    HB3  PRO  90           HB3      PRO  90   6.961   4.470   2.645
  736    HG2  PRO  90           HG2      PRO  90   6.423   2.188   1.300
  737    HG3  PRO  90           HG3      PRO  90   6.535   2.158   3.093
  738    HD2  PRO  90           HD2      PRO  90   4.042   2.274   1.376
  739    HD3  PRO  90           HD3      PRO  90   4.387   1.242   2.785
  740    H    VAL  91           H        VAL  91   5.437   6.681   4.231
  741    HA   VAL  91           HA       VAL  91   3.067   8.145   3.590
  742    HB   VAL  91           HB       VAL  91   4.291  10.090   4.407
  743   HG11  VAL  91          HG11      VAL  91   4.536   9.334   6.711
  744   HG12  VAL  91          HG12      VAL  91   3.156   8.513   5.964
  745   HG13  VAL  91          HG13      VAL  91   4.691   7.650   6.202
  746   HG21  VAL  91          HG21      VAL  91   6.530   9.943   5.373
  747   HG22  VAL  91          HG22      VAL  91   6.723   8.284   4.777
  748   HG23  VAL  91          HG23      VAL  91   6.591   9.638   3.637
  749    H    CYS  92           H        CYS  92   2.605   9.391   1.880
  750    HA   CYS  92           HA       CYS  92   4.249   8.731  -0.479
  751    HB2  CYS  92           HB2      CYS  92   1.887   8.115  -0.405
  752    HB3  CYS  92           HB3      CYS  92   1.454   9.844  -0.316
  753    HG   CYS  92           HG       CYS  92   1.021   9.177  -2.737
  754    H    ILE  93           H        ILE  93   5.720  10.147  -1.048
  755    HA   ILE  93           HA       ILE  93   5.347  13.012  -0.401
  756    HB   ILE  93           HB       ILE  93   7.743  13.239  -0.663
  757   HG12  ILE  93          HG12      ILE  93   7.704  10.299  -1.425
  758   HG13  ILE  93          HG13      ILE  93   8.319  11.662  -2.348
  759   HG21  ILE  93          HG21      ILE  93   8.378  12.135   1.373
  760   HG22  ILE  93          HG22      ILE  93   6.698  12.626   1.516
  761   HG23  ILE  93          HG23      ILE  93   7.092  10.919   1.194
  762   HD11  ILE  93          HD11      ILE  93  10.093  11.923  -0.522
  763   HD12  ILE  93          HD12      ILE  93   9.498  10.379   0.145
  764   HD13  ILE  93          HD13      ILE  93  10.181  10.426  -1.479
  765    H    GLY  94           H        GLY  94   4.911  10.983  -3.137
  766    HA2  GLY  94           HA2      GLY  94   4.281  13.245  -4.730
  767    HA3  GLY  94           HA3      GLY  94   5.871  12.647  -5.194
  768    H    GLN  95           H        GLN  95   4.139  12.596  -7.137
  769    HA   GLN  95           HA       GLN  95   2.851   9.911  -7.276
  770    HB2  GLN  95           HB2      GLN  95   2.558  12.490  -8.852
  771    HB3  GLN  95           HB3      GLN  95   1.921  10.965  -9.423
  772    HG2  GLN  95           HG2      GLN  95   0.155  12.239  -8.458
  773    HG3  GLN  95           HG3      GLN  95   0.416  10.758  -7.557
  774   HE21  GLN  95          HE22      GLN  95  -0.892  11.730  -5.812
  775   HE22  GLN  95          HE21      GLN  95  -0.160  12.892  -4.745
  776    H    LYS  96           H        LYS  96   3.931   8.356  -8.318
  777    HA   LYS  96           HA       LYS  96   6.279   8.941 -10.076
  778    HB2  LYS  96           HB2      LYS  96   6.691   7.117  -8.576
  779    HB3  LYS  96           HB3      LYS  96   5.059   6.481  -8.723
  780    HG2  LYS  96           HG2      LYS  96   5.609   5.804 -11.104
  781    HG3  LYS  96           HG3      LYS  96   7.277   6.335 -10.805
  782    HD2  LYS  96           HD2      LYS  96   7.462   4.680  -8.983
  783    HD3  LYS  96           HD3      LYS  96   5.775   4.191  -9.241
  784    HE2  LYS  96           HE2      LYS  96   6.361   3.477 -11.589
  785    HE3  LYS  96           HE3      LYS  96   8.038   3.955 -11.285
  786    HZ1  LYS  96           HZ1      LYS  96   7.970   2.284  -9.370
  787    HZ2  LYS  96           HZ2      LYS  96   6.573   1.718 -10.007
  788    HZ3  LYS  96           HZ3      LYS  96   7.941   1.649 -10.894
  789    H    GLN  97           H        GLN  97   5.555   9.504 -12.210
  790    HA   GLN  97           HA       GLN  97   3.145   8.038 -13.135
  791    HB2  GLN  97           HB2      GLN  97   2.870  10.499 -14.405
  792    HB3  GLN  97           HB3      GLN  97   1.852   9.775 -13.199
  793    HG2  GLN  97           HG2      GLN  97   2.212  11.947 -12.442
  794    HG3  GLN  97           HG3      GLN  97   3.204  10.957 -11.401
  795   HE21  GLN  97          HE22      GLN  97   5.214  11.923 -11.002
  796   HE22  GLN  97          HE21      GLN  97   6.032  12.966 -12.151
  797    H    LYS  98           H        LYS  98   3.037   7.320 -15.139
  798    HA   LYS  98           HA       LYS  98   5.081   8.223 -17.131
  799    HB2  LYS  98           HB2      LYS  98   5.577   5.893 -16.503
  800    HB3  LYS  98           HB3      LYS  98   3.876   5.444 -16.751
  801    HG2  LYS  98           HG2      LYS  98   4.132   6.120 -19.184
  802    HG3  LYS  98           HG3      LYS  98   5.854   6.397 -18.875
  803    HD2  LYS  98           HD2      LYS  98   6.108   4.009 -18.203
  804    HD3  LYS  98           HD3      LYS  98   4.363   3.788 -18.368
  805    HE2  LYS  98           HE2      LYS  98   5.314   2.844 -20.337
  806    HE3  LYS  98           HE3      LYS  98   4.537   4.351 -20.811
  807    HZ1  LYS  98           HZ1      LYS  98   6.871   5.361 -20.687
  808    HZ2  LYS  98           HZ2      LYS  98   7.447   3.822 -20.537
  809    HZ3  LYS  98           HZ3      LYS  98   6.608   4.284 -21.877
  810    H    TRP  99           H        TRP  99   3.952   9.443 -18.587
  811    HA   TRP  99           HA       TRP  99   1.004   9.251 -18.588
  812    HB2  TRP  99           HB2      TRP  99   2.919  11.227 -19.903
  813    HB3  TRP  99           HB3      TRP  99   1.168  11.300 -19.957
  814    HD1  TRP  99           HD1      TRP  99   3.917  11.322 -17.176
  815    HE1  TRP  99           HE1      TRP  99   3.217  12.931 -15.346
  816    HE3  TRP  99           HE3      TRP  99  -0.587  12.771 -19.104
  817    HZ2  TRP  99           HZ2      TRP  99   0.949  14.690 -14.784
  818    HZ3  TRP  99           HZ3      TRP  99  -1.974  14.447 -17.939
  819    HH2  TRP  99           HH2      TRP  99  -1.259  15.356 -15.728
  820    H    PHE 100           H        PHE 100  -0.106   8.849 -20.555
  821    HA   PHE 100           HA       PHE 100   1.573   7.597 -22.691
  822    HB2  PHE 100           HB2      PHE 100  -1.151   6.793 -21.661
  823    HB3  PHE 100           HB3      PHE 100  -0.578   6.363 -23.269
  824    HD1  PHE 100           HD2      PHE 100   0.326   6.024 -19.616
  825    HD2  PHE 100           HD1      PHE 100   0.919   4.549 -23.631
  826    HE1  PHE 100           HE2      PHE 100   1.577   4.082 -18.728
  827    HE2  PHE 100           HE1      PHE 100   2.205   2.642 -22.737
  828    HZ   PHE 100           HZ       PHE 100   2.514   2.379 -20.284
  829    H    LEU 101           H        LEU 101   1.405   8.476 -24.633
  830    HA   LEU 101           HA       LEU 101  -0.138  10.942 -24.944
  831    HB2  LEU 101           HB2      LEU 101   2.141  11.021 -25.740
  832    HB3  LEU 101           HB3      LEU 101   1.880   9.588 -26.740
  833    HG   LEU 101           HG       LEU 101   0.237  10.810 -28.131
  834   HD11  LEU 101          HD11      LEU 101   0.919  13.207 -26.388
  835   HD12  LEU 101          HD12      LEU 101  -0.022  13.231 -27.897
  836   HD13  LEU 101          HD13      LEU 101  -0.669  12.400 -26.505
  837   HD21  LEU 101          HD21      LEU 101   1.816  12.341 -29.244
  838   HD22  LEU 101          HD22      LEU 101   2.915  12.204 -27.848
  839   HD23  LEU 101          HD23      LEU 101   2.558  10.789 -28.842
  840    H    LEU 102           H        LEU 102  -2.207  10.082 -24.876
  841    HA   LEU 102           HA       LEU 102  -2.958   8.144 -26.934
  842    HB2  LEU 102           HB2      LEU 102  -4.400   9.553 -24.639
  843    HB3  LEU 102           HB3      LEU 102  -5.297   8.673 -25.884
  844    HG   LEU 102           HG       LEU 102  -3.141   7.475 -24.076
  845   HD11  LEU 102          HD11      LEU 102  -5.073   7.866 -22.799
  846   HD12  LEU 102          HD12      LEU 102  -6.171   7.388 -24.112
  847   HD13  LEU 102          HD13      LEU 102  -5.179   6.165 -23.274
  848   HD21  LEU 102          HD21      LEU 102  -2.894   6.197 -25.920
  849   HD22  LEU 102          HD22      LEU 102  -4.280   5.327 -25.245
  850   HD23  LEU 102          HD23      LEU 102  -4.484   6.512 -26.593
  851    H    GLN 103           H        GLN 103  -3.592   8.580 -28.835
  852    HA   GLN 103           HA       GLN 103  -4.330  11.391 -29.528
  853    HB2  GLN 103           HB2      GLN 103  -3.703   8.914 -31.163
  854    HB3  GLN 103           HB3      GLN 103  -4.559  10.285 -31.875
  855    HG2  GLN 103           HG2      GLN 103  -1.817  10.428 -30.540
  856    HG3  GLN 103           HG3      GLN 103  -2.107  10.385 -32.285
  857   HE21  GLN 103          HE22      GLN 103  -0.627  12.492 -31.013
  858   HE22  GLN 103          HE21      GLN 103  -1.591  13.952 -31.255
  859    H    LEU 104           H        LEU 104  -6.427  11.915 -29.829
  860    HA   LEU 104           HA       LEU 104  -8.389  10.239 -28.602
  861    HB2  LEU 104           HB2      LEU 104  -8.281  12.794 -28.772
  862    HB3  LEU 104           HB3      LEU 104  -8.878  12.640 -30.425
  863    HG   LEU 104           HG       LEU 104 -10.992  11.654 -29.572
  864   HD11  LEU 104          HD11      LEU 104 -11.436  11.815 -27.076
  865   HD12  LEU 104          HD12      LEU 104 -10.325  10.525 -27.513
  866   HD13  LEU 104          HD13      LEU 104  -9.701  12.041 -26.822
  867   HD21  LEU 104          HD21      LEU 104 -10.808  14.065 -29.875
  868   HD22  LEU 104          HD22      LEU 104 -11.778  13.763 -28.429
  869   HD23  LEU 104          HD23      LEU 104 -10.093  14.262 -28.248
  870    H    VAL 105           H        VAL 105 -10.010   8.893 -29.498
  871    HA   VAL 105           HA       VAL 105 -10.149   8.687 -32.467
  872    HB   VAL 105           HB       VAL 105 -10.240   6.337 -30.551
  873   HG11  VAL 105          HG11      VAL 105 -10.467   6.383 -33.570
  874   HG12  VAL 105          HG12      VAL 105 -10.380   4.933 -32.536
  875   HG13  VAL 105          HG13      VAL 105 -11.769   6.010 -32.409
  876   HG21  VAL 105          HG21      VAL 105  -7.885   7.124 -30.912
  877   HG22  VAL 105          HG22      VAL 105  -8.211   5.526 -31.591
  878   HG23  VAL 105          HG23      VAL 105  -8.139   6.934 -32.658
  879    H    SER 106           H        SER 106 -11.856   7.735 -29.367
  880    HA   SER 106           HA       SER 106 -14.419   8.540 -30.623
  881    HB2  SER 106           HB2      SER 106 -13.878   7.391 -27.870
  882    HB3  SER 106           HB3      SER 106 -15.434   7.528 -28.693
  883    HG   SER 106           HG       SER 106 -14.430   5.439 -28.758
  884    H    GLY 107           H        GLY 107 -15.181  10.594 -30.344
  885    HA2  GLY 107           HA2      GLY 107 -13.488  12.515 -29.035
  886    HA3  GLY 107           HA3      GLY 107 -14.957  12.831 -29.942
  887    H    ASP 108           H        ASP 108 -14.902  14.510 -28.097
  888    HA   ASP 108           HA       ASP 108 -15.584  14.173 -25.477
  889    HB2  ASP 108           HB2      ASP 108 -15.260  16.330 -26.514
  890    HB3  ASP 108           HB3      ASP 108 -16.699  16.110 -27.518
  891    H    ALA 109           H        ALA 109 -17.750  13.654 -28.283
  892    HA   ALA 109           HA       ALA 109 -20.184  13.532 -26.815
  893    HB1  ALA 109           HB1      ALA 109 -20.070  13.883 -29.261
  894    HB2  ALA 109           HB2      ALA 109 -19.438  12.227 -29.471
  895    HB3  ALA 109           HB3      ALA 109 -21.081  12.482 -28.858
  896    H    GLU 110           H        GLU 110 -17.623  11.154 -27.224
  897    HA   GLU 110           HA       GLU 110 -19.317   8.961 -26.224
  898    HB2  GLU 110           HB2      GLU 110 -16.558   8.947 -27.483
  899    HB3  GLU 110           HB3      GLU 110 -17.449   7.520 -26.963
  900    HG2  GLU 110           HG2      GLU 110 -18.178   9.420 -29.230
  901    HG3  GLU 110           HG3      GLU 110 -17.635   7.759 -29.381
  902    H    ILE 111           H        ILE 111 -16.657  11.091 -25.407
  903    HA   ILE 111           HA       ILE 111 -15.600   9.773 -23.110
  904    HB   ILE 111           HB       ILE 111 -15.801  12.557 -24.178
  905   HG12  ILE 111          HG12      ILE 111 -13.485  10.825 -23.377
  906   HG13  ILE 111          HG13      ILE 111 -14.065  11.159 -25.017
  907   HG21  ILE 111          HG21      ILE 111 -14.680  12.142 -21.391
  908   HG22  ILE 111          HG22      ILE 111 -14.733  13.653 -22.325
  909   HG23  ILE 111          HG23      ILE 111 -16.225  12.957 -21.765
  910   HD11  ILE 111          HD11      ILE 111 -12.083  12.431 -24.679
  911   HD12  ILE 111          HD12      ILE 111 -13.444  13.571 -24.684
  912   HD13  ILE 111          HD13      ILE 111 -12.659  13.099 -23.150
  913    H    ASN 112           H        ASN 112 -16.294   9.693 -21.024
  914    HA   ASN 112           HA       ASN 112 -18.602  11.283 -20.181
  915    HB2  ASN 112           HB2      ASN 112 -19.774   9.240 -20.812
  916    HB3  ASN 112           HB3      ASN 112 -18.663   8.275 -19.814
  917   HD21  ASN 112          HD22      ASN 112 -20.814   7.658 -18.650
  918   HD22  ASN 112          HD21      ASN 112 -21.324   8.761 -17.379
  919    H    MET 113           H        MET 113 -16.941  12.357 -19.150
  920    HA   MET 113           HA       MET 113 -15.098  11.288 -17.296
  921    HB2  MET 113           HB2      MET 113 -16.407  14.038 -17.124
  922    HB3  MET 113           HB3      MET 113 -14.831  13.532 -16.502
  923    HG2  MET 113           HG2      MET 113 -14.153  13.070 -18.904
  924    HG3  MET 113           HG3      MET 113 -15.649  13.869 -19.399
  925    HE1  MET 113           HE1      MET 113 -13.061  16.546 -20.465
  926    HE2  MET 113           HE2      MET 113 -13.034  14.780 -20.666
  927    HE3  MET 113           HE3      MET 113 -14.546  15.687 -20.921
  928    H    GLN 114           H        GLN 114 -18.559  11.299 -16.939
  929    HA   GLN 114           HA       GLN 114 -18.338  11.302 -13.981
  930    HB2  GLN 114           HB2      GLN 114 -20.599  12.138 -15.847
  931    HB3  GLN 114           HB3      GLN 114 -20.823  11.924 -14.118
  932    HG2  GLN 114           HG2      GLN 114 -18.725  13.846 -15.215
  933    HG3  GLN 114           HG3      GLN 114 -20.410  14.310 -15.012
  934   HE21  GLN 114          HE22      GLN 114 -17.446  14.463 -13.457
  935   HE22  GLN 114          HE21      GLN 114 -18.049  14.570 -11.805
  936    H    THR 115           H        THR 115 -17.712   9.097 -15.776
  937    HA   THR 115           HA       THR 115 -19.929   7.261 -15.653
  938    HB   THR 115           HB       THR 115 -18.207   7.270 -17.431
  939    HG1  THR 115           HG1      THR 115 -19.379   5.388 -17.194
  940   HG21  THR 115          HG21      THR 115 -16.148   7.677 -16.219
  941   HG22  THR 115          HG22      THR 115 -16.349   6.191 -15.263
  942   HG23  THR 115          HG23      THR 115 -16.045   6.092 -16.991
  943    H    SER 116           H        SER 116 -17.237   8.053 -13.495
  944    HA   SER 116           HA       SER 116 -17.544   5.644 -11.875
  945    HB2  SER 116           HB2      SER 116 -15.324   6.629 -12.249
  946    HB3  SER 116           HB3      SER 116 -15.853   8.152 -11.515
  947    HG   SER 116           HG       SER 116 -14.662   6.613 -10.119
  948    H    SER 117           H        SER 117 -17.832   5.979  -9.514
  949    HA   SER 117           HA       SER 117 -20.221   7.510  -8.873
  950    HB2  SER 117           HB2      SER 117 -18.472   5.751  -7.116
  951    HB3  SER 117           HB3      SER 117 -20.116   6.305  -6.749
  952    HG   SER 117           HG       SER 117 -20.098   4.145  -7.571
  953    H    THR 118           H        THR 118 -16.739   7.654  -8.401
  954    HA   THR 118           HA       THR 118 -16.944  10.312  -7.121
  955    HB   THR 118           HB       THR 118 -14.829   9.603  -5.833
  956    HG1  THR 118           HG1      THR 118 -14.427   7.589  -6.758
  957   HG21  THR 118          HG21      THR 118 -17.023  10.011  -4.757
  958   HG22  THR 118          HG22      THR 118 -17.478   8.313  -5.044
  959   HG23  THR 118          HG23      THR 118 -16.120   8.709  -3.968
  960    HA   PRO 119           HA       PRO 119 -14.388  10.169 -11.062
  961    HB2  PRO 119           HB2      PRO 119 -15.749  12.100 -12.447
  962    HB3  PRO 119           HB3      PRO 119 -16.259  10.384 -12.420
  963    HG2  PRO 119           HG2      PRO 119 -17.306  12.685 -10.752
  964    HG3  PRO 119           HG3      PRO 119 -18.249  11.436 -11.643
  965    HD2  PRO 119           HD2      PRO 119 -17.752  11.242  -8.982
  966    HD3  PRO 119           HD3      PRO 119 -17.819   9.823 -10.057
  967    H    GLU 120           H        GLU 120 -13.248  12.193 -12.051
  968    HA   GLU 120           HA       GLU 120 -12.942  14.333  -9.966
  969    HB2  GLU 120           HB2      GLU 120 -10.885  13.315 -11.965
  970    HB3  GLU 120           HB3      GLU 120 -10.705  14.727 -10.919
  971    HG2  GLU 120           HG2      GLU 120 -11.372  13.002  -8.993
  972    HG3  GLU 120           HG3      GLU 120 -10.760  11.812 -10.143
  973    H    PHE 121           H        PHE 121 -13.897  13.807 -13.353
  974    HA   PHE 121           HA       PHE 121 -13.577  16.762 -13.690
  975    HB2  PHE 121           HB2      PHE 121 -13.012  14.557 -15.666
  976    HB3  PHE 121           HB3      PHE 121 -13.104  16.278 -16.053
  977    HD1  PHE 121           HD1      PHE 121 -11.598  17.906 -14.725
  978    HD2  PHE 121           HD2      PHE 121 -10.929  13.648 -14.879
  979    HE1  PHE 121           HE1      PHE 121  -9.255  18.258 -14.037
  980    HE2  PHE 121           HE2      PHE 121  -8.589  14.003 -14.136
  981    HZ   PHE 121           HZ       PHE 121  -7.747  16.302 -13.726
  982    H    ASP 122           H        ASP 122 -15.052  17.910 -14.723
  983    HA   ASP 122           HA       ASP 122 -17.767  16.699 -15.021
  984    HB2  ASP 122           HB2      ASP 122 -17.696  18.422 -13.383
  985    HB3  ASP 122           HB3      ASP 122 -16.748  19.487 -14.430
  986    H    GLY 123           H        GLY 123 -15.377  18.870 -16.648
  987    HA2  GLY 123           HA2      GLY 123 -15.191  17.872 -19.084
  988    HA3  GLY 123           HA3      GLY 123 -16.802  18.577 -19.228
  989    H    TRP 124           H        TRP 124 -14.974  19.490 -20.928
  990    HA   TRP 124           HA       TRP 124 -15.253  22.225 -20.644
  991    HB2  TRP 124           HB2      TRP 124 -13.366  22.257 -19.081
  992    HB3  TRP 124           HB3      TRP 124 -12.365  21.418 -20.261
  993    HD1  TRP 124           HD1      TRP 124 -10.583  23.047 -20.909
  994    HE1  TRP 124           HE1      TRP 124 -10.421  25.476 -21.661
  995    HE3  TRP 124           HE3      TRP 124 -15.527  24.391 -20.422
  996    HZ2  TRP 124           HZ2      TRP 124 -12.196  27.729 -22.021
  997    HZ3  TRP 124           HZ3      TRP 124 -16.249  26.680 -21.002
  998    HH2  TRP 124           HH2      TRP 124 -14.596  28.361 -21.791
  999    H    ARG 125           H        ARG 125 -12.372  22.014 -22.271
 1000    HA   ARG 125           HA       ARG 125 -13.336  21.145 -24.887
 1001    HB2  ARG 125           HB2      ARG 125 -13.839  23.229 -25.651
 1002    HB3  ARG 125           HB3      ARG 125 -13.930  23.715 -23.963
 1003    HG2  ARG 125           HG2      ARG 125 -11.478  24.390 -24.109
 1004    HG3  ARG 125           HG3      ARG 125 -11.615  24.140 -25.868
 1005    HD2  ARG 125           HD2      ARG 125 -13.509  25.755 -25.921
 1006    HD3  ARG 125           HD3      ARG 125 -13.323  25.992 -24.167
 1007    HE   ARG 125           HE       ARG 125 -10.850  26.474 -25.565
 1008   HH11  ARG 125          HH11      ARG 125 -13.993  27.998 -24.903
 1009   HH12  ARG 125          HH12      ARG 125 -13.419  29.612 -25.118
 1010   HH21  ARG 125          HH21      ARG 125 -10.072  28.632 -25.827
 1011   HH22  ARG 125          HH22      ARG 125 -11.133  29.978 -25.631
 1012    H    TRP 126           H        TRP 126 -11.378  21.211 -26.435
 1013    HA   TRP 126           HA       TRP 126  -8.966  20.629 -24.885
 1014    HB2  TRP 126           HB2      TRP 126  -9.201  20.617 -27.890
 1015    HB3  TRP 126           HB3      TRP 126  -8.083  19.712 -26.865
 1016    HD1  TRP 126           HD1      TRP 126 -10.924  19.072 -28.898
 1017    HE1  TRP 126           HE1      TRP 126 -12.473  17.208 -28.109
 1018    HE3  TRP 126           HE3      TRP 126  -9.215  18.588 -24.095
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.996  15.758 -25.665
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.358  17.049 -22.514
 1021    HH2  TRP 126           HH2      TRP 126 -12.273  15.662 -23.282
 1022    H    VAL 127           H        VAL 127  -7.030  21.775 -24.899
 1023    HA   VAL 127           HA       VAL 127  -7.314  24.639 -25.721
 1024    HB   VAL 127           HB       VAL 127  -6.007  25.100 -23.644
 1025   HG11  VAL 127          HG11      VAL 127  -7.887  24.891 -22.110
 1026   HG12  VAL 127          HG12      VAL 127  -8.473  25.351 -23.713
 1027   HG13  VAL 127          HG13      VAL 127  -8.660  23.673 -23.147
 1028   HG21  VAL 127          HG21      VAL 127  -6.630  22.194 -22.911
 1029   HG22  VAL 127          HG22      VAL 127  -5.018  22.822 -23.304
 1030   HG23  VAL 127          HG23      VAL 127  -5.886  23.406 -21.870
 1031    H    SER 128           H        SER 128  -5.228  25.836 -25.977
 1032    HA   SER 128           HA       SER 128  -3.551  24.703 -27.855
 1033    HB2  SER 128           HB2      SER 128  -2.712  26.861 -25.887
 1034    HB3  SER 128           HB3      SER 128  -2.094  26.591 -27.520
 1035    HG   SER 128           HG       SER 128  -3.689  28.270 -27.478
 1036    H    TYR 129           H        TYR 129  -1.379  23.957 -27.812
 1037    HA   TYR 129           HA       TYR 129  -1.089  21.819 -26.148
 1038    HB2  TYR 129           HB2      TYR 129  -0.030  22.295 -28.401
 1039    HB3  TYR 129           HB3      TYR 129   1.203  23.230 -27.561
 1040    HD1  TYR 129           HD1      TYR 129  -0.345  19.849 -27.960
 1041    HD2  TYR 129           HD2      TYR 129   2.979  22.093 -26.383
 1042    HE1  TYR 129           HE1      TYR 129   0.772  17.738 -27.277
 1043    HE2  TYR 129           HE2      TYR 129   4.159  20.002 -25.836
 1044    HH   TYR 129           HH       TYR 129   4.006  17.713 -25.739
 1045    H    TRP 130           H        TRP 130   0.475  25.004 -25.627
 1046    HA   TRP 130           HA       TRP 130   1.727  23.981 -23.161
 1047    HB2  TRP 130           HB2      TRP 130   2.044  26.678 -24.504
 1048    HB3  TRP 130           HB3      TRP 130   3.032  26.014 -23.203
 1049    HD1  TRP 130           HD1      TRP 130   2.585  25.951 -26.928
 1050    HE1  TRP 130           HE1      TRP 130   4.215  24.401 -28.064
 1051    HE3  TRP 130           HE3      TRP 130   4.655  23.825 -22.755
 1052    HZ2  TRP 130           HZ2      TRP 130   6.227  22.407 -27.264
 1053    HZ3  TRP 130           HZ3      TRP 130   6.420  22.088 -22.972
 1054    HH2  TRP 130           HH2      TRP 130   7.165  21.328 -25.207
 1055    H    TYR 131           H        TYR 131  -1.333  24.941 -23.658
 1056    HA   TYR 131           HA       TYR 131  -1.566  27.114 -21.760
 1057    HB2  TYR 131           HB2      TYR 131  -3.102  26.842 -23.618
 1058    HB3  TYR 131           HB3      TYR 131  -3.683  25.318 -22.982
 1059    HD1  TYR 131           HD2      TYR 131  -5.064  25.239 -20.910
 1060    HD2  TYR 131           HD1      TYR 131  -3.855  28.966 -22.718
 1061    HE1  TYR 131           HE2      TYR 131  -6.926  26.382 -19.766
 1062    HE2  TYR 131           HE1      TYR 131  -5.694  30.137 -21.532
 1063    HH   TYR 131           HH       TYR 131  -8.034  28.425 -19.402
 1064    HA   PRO 132           HA       PRO 132  -3.255  23.689 -18.801
 1065    HB2  PRO 132           HB2      PRO 132  -1.528  21.357 -19.603
 1066    HB3  PRO 132           HB3      PRO 132  -3.163  21.351 -18.913
 1067    HG2  PRO 132           HG2      PRO 132  -2.851  20.941 -21.555
 1068    HG3  PRO 132           HG3      PRO 132  -4.133  22.054 -20.979
 1069    HD2  PRO 132           HD2      PRO 132  -1.361  22.758 -22.011
 1070    HD3  PRO 132           HD3      PRO 132  -2.933  23.461 -22.450
 1071    H    VAL 133           H        VAL 133   0.255  23.540 -19.759
 1072    HA   VAL 133           HA       VAL 133   1.142  23.123 -17.067
 1073    HB   VAL 133           HB       VAL 133   3.353  23.918 -17.977
 1074   HG11  VAL 133          HG11      VAL 133   2.815  21.585 -17.891
 1075   HG12  VAL 133          HG12      VAL 133   1.875  21.668 -19.383
 1076   HG13  VAL 133          HG13      VAL 133   3.635  21.906 -19.418
 1077   HG21  VAL 133          HG21      VAL 133   2.535  25.369 -19.838
 1078   HG22  VAL 133          HG22      VAL 133   3.707  24.159 -20.347
 1079   HG23  VAL 133          HG23      VAL 133   1.990  23.899 -20.694
 1080    H    ARG 134           H        ARG 134   0.053  26.054 -18.745
 1081    HA   ARG 134           HA       ARG 134   1.113  27.667 -16.495
 1082    HB2  ARG 134           HB2      ARG 134  -0.598  28.535 -18.862
 1083    HB3  ARG 134           HB3      ARG 134   0.161  29.583 -17.672
 1084    HG2  ARG 134           HG2      ARG 134   1.501  27.946 -19.845
 1085    HG3  ARG 134           HG3      ARG 134   1.483  29.689 -19.644
 1086    HD2  ARG 134           HD2      ARG 134   3.015  27.628 -18.012
 1087    HD3  ARG 134           HD3      ARG 134   3.689  28.867 -19.056
 1088    HE   ARG 134           HE       ARG 134   2.863  29.109 -16.291
 1089   HH11  ARG 134          HH21      ARG 134   3.441  31.009 -19.245
 1090   HH12  ARG 134          HH22      ARG 134   3.567  32.521 -18.418
 1091   HH21  ARG 134          HH11      ARG 134   2.955  31.147 -15.202
 1092   HH22  ARG 134          HH12      ARG 134   3.308  32.588 -16.078
 1093    H    GLN 135           H        GLN 135  -1.763  25.810 -17.228
 1094    HA   GLN 135           HA       GLN 135  -3.373  27.415 -15.337
 1095    HB2  GLN 135           HB2      GLN 135  -3.974  24.706 -16.541
 1096    HB3  GLN 135           HB3      GLN 135  -5.079  25.753 -15.646
 1097    HG2  GLN 135           HG2      GLN 135  -4.170  25.911 -18.468
 1098    HG3  GLN 135           HG3      GLN 135  -5.757  26.155 -17.777
 1099   HE21  GLN 135          HE22      GLN 135  -3.021  27.714 -19.088
 1100   HE22  GLN 135          HE21      GLN 135  -3.421  29.363 -18.627
 1101    H    VAL 136           H        VAL 136  -1.357  24.491 -15.296
 1102    HA   VAL 136           HA       VAL 136  -2.366  23.546 -12.799
 1103    HB   VAL 136           HB       VAL 136  -0.996  22.425 -14.792
 1104   HG11  VAL 136          HG11      VAL 136   1.094  23.649 -14.393
 1105   HG12  VAL 136          HG12      VAL 136   1.195  22.917 -12.779
 1106   HG13  VAL 136          HG13      VAL 136   1.302  21.888 -14.207
 1107   HG21  VAL 136          HG21      VAL 136  -0.697  21.405 -11.953
 1108   HG22  VAL 136          HG22      VAL 136  -2.125  21.185 -12.999
 1109   HG23  VAL 136          HG23      VAL 136  -0.572  20.475 -13.462
 1110    H    VAL 137           H        VAL 137  -1.019  23.368 -10.755
 1111    HA   VAL 137           HA       VAL 137  -0.265  25.937  -9.816
 1112    HB   VAL 137           HB       VAL 137   0.622  24.615  -7.829
 1113   HG11  VAL 137          HG11      VAL 137  -1.637  25.621  -7.927
 1114   HG12  VAL 137          HG12      VAL 137  -2.274  24.153  -8.705
 1115   HG13  VAL 137          HG13      VAL 137  -1.655  24.090  -7.041
 1116   HG21  VAL 137          HG21      VAL 137   1.076  22.449  -8.930
 1117   HG22  VAL 137          HG22      VAL 137  -0.063  22.281  -7.593
 1118   HG23  VAL 137          HG23      VAL 137  -0.662  22.222  -9.251
 1119    H    SER 138           H        SER 138   1.705  26.843  -9.197
 1120    HA   SER 138           HA       SER 138   3.560  26.897 -11.153
 1121    HB2  SER 138           HB2      SER 138   4.078  27.672  -8.257
 1122    HB3  SER 138           HB3      SER 138   4.743  28.424  -9.721
 1123    HG   SER 138           HG       SER 138   2.956  29.617  -8.839
 1124    H    PHE 139           H        PHE 139   3.807  24.731  -8.291
 1125    HA   PHE 139           HA       PHE 139   6.583  24.077  -8.930
 1126    HB2  PHE 139           HB2      PHE 139   6.480  22.486  -7.153
 1127    HB3  PHE 139           HB3      PHE 139   5.752  23.988  -6.622
 1128    HD1  PHE 139           HD2      PHE 139   5.163  20.427  -7.420
 1129    HD2  PHE 139           HD1      PHE 139   3.336  24.103  -6.064
 1130    HE1  PHE 139           HE2      PHE 139   3.155  19.171  -6.696
 1131    HE2  PHE 139           HE1      PHE 139   1.334  22.835  -5.350
 1132    HZ   PHE 139           HZ       PHE 139   1.223  20.374  -5.677
 1133    H    LYS 140           H        LYS 140   3.384  22.552  -9.499
 1134    HA   LYS 140           HA       LYS 140   4.577  20.195 -10.662
 1135    HB2  LYS 140           HB2      LYS 140   2.350  20.401  -9.448
 1136    HB3  LYS 140           HB3      LYS 140   1.659  21.002 -10.967
 1137    HG2  LYS 140           HG2      LYS 140   2.348  18.921 -12.110
 1138    HG3  LYS 140           HG3      LYS 140   3.174  18.360 -10.651
 1139    HD2  LYS 140           HD2      LYS 140   0.166  18.755 -10.980
 1140    HD3  LYS 140           HD3      LYS 140   1.048  17.218 -10.935
 1141    HE2  LYS 140           HE2      LYS 140   1.869  17.944  -8.575
 1142    HE3  LYS 140           HE3      LYS 140   0.639  19.215  -8.654
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.021  17.368  -9.007
 1144    HZ2  LYS 140           HZ2      LYS 140   0.174  16.272  -8.705
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.288  17.327  -7.543
 1146    H    ARG 141           H        ARG 141   3.383  23.243 -11.987
 1147    HA   ARG 141           HA       ARG 141   3.403  22.971 -14.721
 1148    HB2  ARG 141           HB2      ARG 141   3.148  25.115 -13.655
 1149    HB3  ARG 141           HB3      ARG 141   4.693  24.949 -12.844
 1150    HG2  ARG 141           HG2      ARG 141   5.835  25.204 -15.125
 1151    HG3  ARG 141           HG3      ARG 141   4.238  25.621 -15.770
 1152    HD2  ARG 141           HD2      ARG 141   5.514  27.625 -15.226
 1153    HD3  ARG 141           HD3      ARG 141   4.102  27.508 -14.164
 1154    HE   ARG 141           HE       ARG 141   5.932  26.324 -12.591
 1155   HH11  ARG 141          HH11      ARG 141   6.270  29.368 -14.420
 1156   HH12  ARG 141          HH12      ARG 141   7.364  30.066 -13.283
 1157   HH21  ARG 141          HH21      ARG 141   7.347  27.238 -11.113
 1158   HH22  ARG 141          HH22      ARG 141   8.011  28.818 -11.367
 1159    H    ASP 142           H        ASP 142   6.436  22.963 -12.711
 1160    HA   ASP 142           HA       ASP 142   8.132  22.983 -14.999
 1161    HB2  ASP 142           HB2      ASP 142   8.917  23.638 -12.786
 1162    HB3  ASP 142           HB3      ASP 142   8.681  21.991 -12.184
 1163    H    VAL 143           H        VAL 143   6.903  20.211 -13.019
 1164    HA   VAL 143           HA       VAL 143   8.360  18.315 -14.673
 1165    HB   VAL 143           HB       VAL 143   8.019  17.848 -12.360
 1166   HG11  VAL 143          HG11      VAL 143   5.013  17.847 -12.878
 1167   HG12  VAL 143          HG12      VAL 143   5.796  17.309 -11.396
 1168   HG13  VAL 143          HG13      VAL 143   5.946  18.981 -11.863
 1169   HG21  VAL 143          HG21      VAL 143   8.149  15.944 -13.951
 1170   HG22  VAL 143          HG22      VAL 143   7.292  15.560 -12.460
 1171   HG23  VAL 143          HG23      VAL 143   6.371  15.843 -13.956
 1172    H    TYR 144           H        TYR 144   5.026  19.658 -14.662
 1173    HA   TYR 144           HA       TYR 144   4.055  17.817 -16.619
 1174    HB2  TYR 144           HB2      TYR 144   2.702  19.150 -15.015
 1175    HB3  TYR 144           HB3      TYR 144   3.045  20.589 -15.937
 1176    HD1  TYR 144           HD1      TYR 144   2.295  17.359 -17.761
 1177    HD2  TYR 144           HD2      TYR 144   0.640  21.000 -16.113
 1178    HE1  TYR 144           HE1      TYR 144   0.147  16.836 -18.770
 1179    HE2  TYR 144           HE2      TYR 144  -1.520  20.497 -17.173
 1180    HH   TYR 144           HH       TYR 144  -2.083  17.532 -19.138
 1181    H    ARG 145           H        ARG 145   5.817  20.959 -16.916
 1182    HA   ARG 145           HA       ARG 145   5.677  21.157 -19.768
 1183    HB2  ARG 145           HB2      ARG 145   7.770  21.987 -17.724
 1184    HB3  ARG 145           HB3      ARG 145   8.088  22.118 -19.450
 1185    HG2  ARG 145           HG2      ARG 145   6.053  23.542 -19.724
 1186    HG3  ARG 145           HG3      ARG 145   5.786  23.447 -17.975
 1187    HD2  ARG 145           HD2      ARG 145   6.898  25.544 -18.501
 1188    HD3  ARG 145           HD3      ARG 145   8.009  24.505 -17.589
 1189    HE   ARG 145           HE       ARG 145   8.406  24.092 -20.398
 1190   HH11  ARG 145          HH11      ARG 145   9.005  26.592 -17.927
 1191   HH12  ARG 145          HH12      ARG 145  10.352  27.281 -18.757
 1192   HH21  ARG 145          HH21      ARG 145  10.208  25.020 -21.495
 1193   HH22  ARG 145          HH22      ARG 145  11.047  26.367 -20.822
 1194    H    ARG 146           H        ARG 146   7.705  18.994 -17.726
 1195    HA   ARG 146           HA       ARG 146   9.337  18.146 -19.938
 1196    HB2  ARG 146           HB2      ARG 146   8.654  16.486 -17.471
 1197    HB3  ARG 146           HB3      ARG 146   9.996  16.241 -18.586
 1198    HG2  ARG 146           HG2      ARG 146  10.964  18.444 -17.920
 1199    HG3  ARG 146           HG3      ARG 146   9.601  18.698 -16.831
 1200    HD2  ARG 146           HD2      ARG 146  10.306  16.505 -15.671
 1201    HD3  ARG 146           HD3      ARG 146  11.831  16.691 -16.571
 1202    HE   ARG 146           HE       ARG 146  10.936  19.081 -15.114
 1203   HH11  ARG 146          HH21      ARG 146  12.979  16.163 -14.867
 1204   HH12  ARG 146          HH22      ARG 146  13.825  16.730 -13.475
 1205   HH21  ARG 146          HH11      ARG 146  11.979  19.784 -13.268
 1206   HH22  ARG 146          HH12      ARG 146  13.287  18.869 -12.566
 1207    H    VAL 147           H        VAL 147   6.238  16.842 -18.590
 1208    HA   VAL 147           HA       VAL 147   5.922  14.727 -20.458
 1209    HB   VAL 147           HB       VAL 147   3.722  16.471 -19.274
 1210   HG11  VAL 147          HG11      VAL 147   3.664  13.590 -20.235
 1211   HG12  VAL 147          HG12      VAL 147   2.316  14.464 -19.469
 1212   HG13  VAL 147          HG13      VAL 147   2.913  14.978 -21.048
 1213   HG21  VAL 147          HG21      VAL 147   4.922  13.945 -18.075
 1214   HG22  VAL 147          HG22      VAL 147   5.192  15.585 -17.443
 1215   HG23  VAL 147          HG23      VAL 147   3.574  14.903 -17.426
 1216    H    MET 148           H        MET 148   4.900  18.215 -20.689
 1217    HA   MET 148           HA       MET 148   3.708  17.928 -23.223
 1218    HB2  MET 148           HB2      MET 148   5.096  20.361 -22.049
 1219    HB3  MET 148           HB3      MET 148   4.109  20.384 -23.504
 1220    HG2  MET 148           HG2      MET 148   3.156  19.750 -20.698
 1221    HG3  MET 148           HG3      MET 148   2.877  21.227 -21.623
 1222    HE1  MET 148           HE1      MET 148  -0.707  19.946 -21.355
 1223    HE2  MET 148           HE2      MET 148   0.573  19.961 -20.132
 1224    HE3  MET 148           HE3      MET 148   0.378  21.341 -21.232
 1225    H    LYS 149           H        LYS 149   7.100  18.751 -22.340
 1226    HA   LYS 149           HA       LYS 149   8.065  19.193 -24.971
 1227    HB2  LYS 149           HB2      LYS 149   9.097  19.957 -22.860
 1228    HB3  LYS 149           HB3      LYS 149   9.511  18.312 -22.417
 1229    HG2  LYS 149           HG2      LYS 149  10.525  19.476 -25.022
 1230    HG3  LYS 149           HG3      LYS 149  11.246  19.977 -23.494
 1231    HD2  LYS 149           HD2      LYS 149  11.866  17.643 -22.945
 1232    HD3  LYS 149           HD3      LYS 149  11.082  17.057 -24.402
 1233    HE2  LYS 149           HE2      LYS 149  13.409  17.127 -24.870
 1234    HE3  LYS 149           HE3      LYS 149  12.637  18.403 -25.811
 1235    HZ1  LYS 149           HZ1      LYS 149  13.463  20.019 -24.190
 1236    HZ2  LYS 149           HZ2      LYS 149  14.105  18.831 -23.257
 1237    HZ3  LYS 149           HZ3      LYS 149  14.704  19.125 -24.747
 1238    H    GLU 150           H        GLU 150   7.896  16.235 -23.008
 1239    HA   GLU 150           HA       GLU 150   9.399  14.466 -24.628
 1240    HB2  GLU 150           HB2      GLU 150   7.030  14.102 -22.753
 1241    HB3  GLU 150           HB3      GLU 150   7.712  12.736 -23.605
 1242    HG2  GLU 150           HG2      GLU 150   9.524  14.521 -21.961
 1243    HG3  GLU 150           HG3      GLU 150   8.497  13.322 -21.174
 1244    H    PHE 151           H        PHE 151   5.945  15.438 -24.837
 1245    HA   PHE 151           HA       PHE 151   5.553  13.697 -27.195
 1246    HB2  PHE 151           HB2      PHE 151   3.617  15.279 -25.486
 1247    HB3  PHE 151           HB3      PHE 151   3.151  14.214 -26.795
 1248    HD1  PHE 151           HD1      PHE 151   5.256  11.942 -25.993
 1249    HD2  PHE 151           HD2      PHE 151   2.338  14.246 -23.796
 1250    HE1  PHE 151           HE1      PHE 151   5.118  10.178 -24.326
 1251    HE2  PHE 151           HE2      PHE 151   2.179  12.426 -22.117
 1252    HZ   PHE 151           HZ       PHE 151   3.573  10.384 -22.358
 1253    H    ALA 152           H        ALA 152   6.322  17.017 -26.724
 1254    HA   ALA 152           HA       ALA 152   4.599  18.366 -28.336
 1255    HB1  ALA 152           HB1      ALA 152   7.607  18.842 -28.099
 1256    HB2  ALA 152           HB2      ALA 152   6.428  20.004 -28.733
 1257    HB3  ALA 152           HB3      ALA 152   6.338  19.496 -27.037
 1258    H    SER 153           H        SER 153   7.749  17.091 -29.616
 1259    HA   SER 153           HA       SER 153   6.855  17.553 -32.279
 1260    HB2  SER 153           HB2      SER 153   9.315  15.971 -31.596
 1261    HB3  SER 153           HB3      SER 153   8.990  17.029 -32.993
 1262    HG   SER 153           HG       SER 153  10.360  18.039 -31.423
 1263    H    VAL 154           H        VAL 154   5.472  15.367 -30.513
 1264    HA   VAL 154           HA       VAL 154   5.293  13.380 -32.727
 1265    HB   VAL 154           HB       VAL 154   4.393  12.979 -29.852
 1266   HG11  VAL 154          HG11      VAL 154   4.881  11.038 -32.161
 1267   HG12  VAL 154          HG12      VAL 154   4.403  10.577 -30.516
 1268   HG13  VAL 154          HG13      VAL 154   3.294  11.519 -31.520
 1269   HG21  VAL 154          HG21      VAL 154   6.836  13.207 -29.755
 1270   HG22  VAL 154          HG22      VAL 154   6.383  11.515 -29.545
 1271   HG23  VAL 154          HG23      VAL 154   7.023  12.070 -31.110
 1272    H    VAL 155           H        VAL 155   3.703  15.796 -30.677
 1273    HA   VAL 155           HA       VAL 155   1.072  15.257 -31.885
 1274    HB   VAL 155           HB       VAL 155   1.991  17.211 -29.735
 1275   HG11  VAL 155          HG11      VAL 155  -0.472  17.442 -29.267
 1276   HG12  VAL 155          HG12      VAL 155  -0.024  18.097 -30.846
 1277   HG13  VAL 155          HG13      VAL 155  -0.823  16.511 -30.738
 1278   HG21  VAL 155          HG21      VAL 155   2.094  14.785 -29.080
 1279   HG22  VAL 155          HG22      VAL 155   0.887  15.683 -28.192
 1280   HG23  VAL 155          HG23      VAL 155   0.385  14.631 -29.542
 1281    H    MET 156           H        MET 156   3.197  18.159 -31.486
 1282    HA   MET 156           HA       MET 156   1.601  19.817 -33.133
 1283    HB2  MET 156           HB2      MET 156   4.562  19.960 -32.395
 1284    HB3  MET 156           HB3      MET 156   3.608  21.283 -33.087
 1285    HG2  MET 156           HG2      MET 156   2.179  21.385 -31.136
 1286    HG3  MET 156           HG3      MET 156   2.861  19.909 -30.470
 1287    HE1  MET 156           HE1      MET 156   5.179  23.912 -30.662
 1288    HE2  MET 156           HE2      MET 156   4.992  22.873 -32.092
 1289    HE3  MET 156           HE3      MET 156   3.563  23.647 -31.362
 1290    H    SER 157           H        SER 157   4.279  17.584 -34.030
 1291    HA   SER 157           HA       SER 157   4.781  18.462 -36.616
 1292    HB2  SER 157           HB2      SER 157   4.632  15.599 -35.604
 1293    HB3  SER 157           HB3      SER 157   5.608  16.195 -36.971
 1294    HG   SER 157           HG       SER 157   6.835  16.014 -35.001
 1295    H    LEU 158           H        LEU 158   1.929  16.750 -35.419
 1296    HA   LEU 158           HA       LEU 158   0.923  15.778 -37.952
 1297    HB2  LEU 158           HB2      LEU 158  -0.480  16.602 -35.411
 1298    HB3  LEU 158           HB3      LEU 158  -1.260  15.728 -36.714
 1299    HG   LEU 158           HG       LEU 158   1.044  14.631 -35.032
 1300   HD11  LEU 158          HD11      LEU 158  -0.903  15.147 -33.581
 1301   HD12  LEU 158          HD12      LEU 158  -1.980  14.273 -34.685
 1302   HD13  LEU 158          HD13      LEU 158  -0.719  13.390 -33.792
 1303   HD21  LEU 158          HD21      LEU 158   0.753  13.486 -37.195
 1304   HD22  LEU 158          HD22      LEU 158   0.267  12.442 -35.847
 1305   HD23  LEU 158          HD23      LEU 158  -0.974  13.233 -36.846
 1306    H    GLN 159           H        GLN 159   0.640  18.839 -36.087
 1307    HA   GLN 159           HA       GLN 159  -1.275  20.014 -37.987
 1308    HB2  GLN 159           HB2      GLN 159   0.075  21.179 -35.493
 1309    HB3  GLN 159           HB3      GLN 159  -1.143  21.991 -36.463
 1310    HG2  GLN 159           HG2      GLN 159  -2.160  21.158 -34.579
 1311    HG3  GLN 159           HG3      GLN 159  -2.784  20.218 -35.949
 1312   HE21  GLN 159          HE22      GLN 159  -3.131  18.016 -35.223
 1313   HE22  GLN 159          HE21      GLN 159  -2.007  17.218 -34.153
 1314    H    GLU 160           H        GLU 160   2.201  20.179 -37.236
 1315    HA   GLU 160           HA       GLU 160   2.852  22.417 -38.843
 1316    HB2  GLU 160           HB2      GLU 160   4.206  21.226 -36.987
 1317    HB3  GLU 160           HB3      GLU 160   4.630  20.025 -38.194
 1318    HG2  GLU 160           HG2      GLU 160   6.428  21.596 -37.965
 1319    HG3  GLU 160           HG3      GLU 160   5.733  21.807 -39.555
 1320    H    ASN 161           H        ASN 161   1.798  19.291 -39.821
 1321    HA   ASN 161           HA       ASN 161   2.912  19.488 -42.553
 1322    HB2  ASN 161           HB2      ASN 161   3.269  17.266 -41.626
 1323    HB3  ASN 161           HB3      ASN 161   1.639  17.238 -40.942
 1324   HD21  ASN 161          HD21      ASN 161   1.218  15.225 -42.120
 1325   HD22  ASN 161          HD22      ASN 161   0.631  15.387 -43.767
 1326    H    THR 162           H        THR 162   1.597  21.471 -42.667
 1327    HA   THR 162           HA       THR 162  -1.113  21.566 -42.113
 1328    HB   THR 162           HB       THR 162  -0.904  23.398 -44.116
 1329    HG1  THR 162           HG1      THR 162   1.194  24.167 -44.181
 1330   HG21  THR 162          HG21      THR 162  -1.459  23.859 -41.753
 1331   HG22  THR 162          HG22      THR 162   0.241  23.641 -41.294
 1332   HG23  THR 162          HG23      THR 162  -0.234  24.996 -42.341
 1333    HA   PRO 163           HA       PRO 163  -2.099  19.797 -46.482
 1334    HB2  PRO 163           HB2      PRO 163   0.280  17.930 -46.604
 1335    HB3  PRO 163           HB3      PRO 163  -0.675  18.612 -47.952
 1336    HG2  PRO 163           HG2      PRO 163   1.708  19.714 -47.297
 1337    HG3  PRO 163           HG3      PRO 163   0.307  20.784 -47.640
 1338    HD2  PRO 163           HD2      PRO 163   1.410  19.946 -44.942
 1339    HD3  PRO 163           HD3      PRO 163   0.829  21.543 -45.473
 1340    H    LYS 164           H        LYS 164  -0.900  18.218 -43.560
 1341    HA   LYS 164           HA       LYS 164  -1.392  16.320 -42.500
 1342    HB2  LYS 164           HB2      LYS 164  -4.170  16.900 -43.555
 1343    HB3  LYS 164           HB3      LYS 164  -3.785  15.774 -42.253
 1344    HG2  LYS 164           HG2      LYS 164  -2.840  17.583 -40.888
 1345    HG3  LYS 164           HG3      LYS 164  -3.181  18.765 -42.155
 1346    HD2  LYS 164           HD2      LYS 164  -5.285  17.113 -40.694
 1347    HD3  LYS 164           HD3      LYS 164  -4.843  18.782 -40.308
 1348    HE2  LYS 164           HE2      LYS 164  -5.510  19.491 -42.608
 1349    HE3  LYS 164           HE3      LYS 164  -6.016  17.835 -42.967
 1350    HZ1  LYS 164           HZ1      LYS 164  -7.208  19.559 -40.865
 1351    HZ2  LYS 164           HZ2      LYS 164  -7.884  19.204 -42.307
 1352    HZ3  LYS 164           HZ3      LYS 164  -7.676  18.023 -41.202
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  -0.304  -0.339  -0.756
    2    H2   MET   1           H2       MET   1   0.064   1.111  -0.096
    3    H3   MET   1           H3       MET   1  -0.695   1.046  -1.542
    4    HA   MET   1           HA       MET   1   2.047   0.107  -0.995
    5    HB2  MET   1           HB2      MET   1   0.940  -1.281  -2.716
    6    HB3  MET   1           HB3      MET   1   0.548   0.161  -3.657
    7    HG2  MET   1           HG2      MET   1   2.988   0.607  -3.958
    8    HG3  MET   1           HG3      MET   1   3.351  -0.852  -3.023
    9    HE1  MET   1           HE1      MET   1   4.939  -1.662  -5.015
   10    HE2  MET   1           HE2      MET   1   4.405  -1.776  -6.709
   11    HE3  MET   1           HE3      MET   1   4.539  -0.184  -5.927
   12    H    ILE   2           H        ILE   2   3.606   1.686  -1.055
   13    HA   ILE   2           HA       ILE   2   3.280   4.073  -2.735
   14    HB   ILE   2           HB       ILE   2   4.358   4.151   0.113
   15   HG12  ILE   2          HG12      ILE   2   1.899   3.998   0.257
   16   HG13  ILE   2          HG13      ILE   2   2.548   5.512   0.853
   17   HG21  ILE   2          HG21      ILE   2   3.911   6.409  -1.885
   18   HG22  ILE   2          HG22      ILE   2   4.420   6.616  -0.198
   19   HG23  ILE   2          HG23      ILE   2   5.466   5.775  -1.335
   20   HD11  ILE   2          HD11      ILE   2   1.760   6.729  -1.091
   21   HD12  ILE   2          HD12      ILE   2   1.287   5.225  -1.899
   22   HD13  ILE   2          HD13      ILE   2   0.432   5.764  -0.439
   23    H    ASP   3           H        ASP   3   5.406   4.648  -3.518
   24    HA   ASP   3           HA       ASP   3   7.341   2.533  -3.839
   25    HB2  ASP   3           HB2      ASP   3   6.988   4.343  -5.488
   26    HB3  ASP   3           HB3      ASP   3   7.455   5.531  -4.278
   27    H    ASP   4           H        ASP   4   9.521   2.562  -2.973
   28    HA   ASP   4           HA       ASP   4   9.521   2.723  -0.161
   29    HB2  ASP   4           HB2      ASP   4  10.949   1.190  -1.428
   30    HB3  ASP   4           HB3      ASP   4  11.847   2.554  -2.112
   31    H    ASP   5           H        ASP   5  10.525   5.167  -2.530
   32    HA   ASP   5           HA       ASP   5  11.818   6.751  -0.457
   33    HB2  ASP   5           HB2      ASP   5  12.826   6.452  -2.738
   34    HB3  ASP   5           HB3      ASP   5  11.534   7.476  -3.372
   35    H    GLY   6           H        GLY   6   8.710   6.245  -1.030
   36    HA2  GLY   6           HA2      GLY   6   7.014   7.329   0.089
   37    HA3  GLY   6           HA3      GLY   6   7.936   8.830   0.122
   38    H    TYR   7           H        TYR   7   7.523   7.102  -2.954
   39    HA   TYR   7           HA       TYR   7   5.854   9.389  -3.897
   40    HB2  TYR   7           HB2      TYR   7   7.803   7.528  -5.298
   41    HB3  TYR   7           HB3      TYR   7   6.614   8.498  -6.174
   42    HD1  TYR   7           HD1      TYR   7   9.545   8.712  -3.876
   43    HD2  TYR   7           HD2      TYR   7   6.816  10.871  -6.420
   44    HE1  TYR   7           HE1      TYR   7  10.887  10.748  -3.570
   45    HE2  TYR   7           HE2      TYR   7   8.115  12.924  -6.081
   46    HH   TYR   7           HH       TYR   7  11.161  13.006  -4.135
   47    H    ARG   8           H        ARG   8   3.893   9.041  -4.966
   48    HA   ARG   8           HA       ARG   8   2.810   6.259  -4.627
   49    HB2  ARG   8           HB2      ARG   8   1.634   8.461  -3.972
   50    HB3  ARG   8           HB3      ARG   8   1.225   8.635  -5.665
   51    HG2  ARG   8           HG2      ARG   8   0.508   6.344  -3.774
   52    HG3  ARG   8           HG3      ARG   8  -0.577   7.614  -4.315
   53    HD2  ARG   8           HD2      ARG   8  -0.567   6.710  -6.603
   54    HD3  ARG   8           HD3      ARG   8   0.649   5.503  -6.115
   55    HE   ARG   8           HE       ARG   8  -1.872   5.523  -4.598
   56   HH11  ARG   8          HH22      ARG   8  -0.103   4.041  -7.321
   57   HH12  ARG   8          HH21      ARG   8  -0.968   2.527  -7.219
   58   HH21  ARG   8          HH11      ARG   8  -3.060   3.556  -4.544
   59   HH22  ARG   8          HH12      ARG   8  -2.715   2.288  -5.661
   60    HA   PRO   9           HA       PRO   9   3.896   5.803  -9.041
   61    HB2  PRO   9           HB2      PRO   9   2.553   3.124  -8.715
   62    HB3  PRO   9           HB3      PRO   9   4.134   3.521  -9.457
   63    HG2  PRO   9           HG2      PRO   9   4.034   2.416  -6.988
   64    HG3  PRO   9           HG3      PRO   9   5.155   3.782  -7.311
   65    HD2  PRO   9           HD2      PRO   9   2.392   3.890  -6.053
   66    HD3  PRO   9           HD3      PRO   9   3.930   4.582  -5.463
   67    H    ASN  10           H        ASN  10   2.693   6.662 -10.666
   68    HA   ASN  10           HA       ASN  10  -0.233   6.180 -10.849
   69    HB2  ASN  10           HB2      ASN  10   1.211   8.883 -10.842
   70    HB3  ASN  10           HB3      ASN  10  -0.411   8.672 -11.480
   71   HD21  ASN  10          HD22      ASN  10   1.549   8.396  -8.495
   72   HD22  ASN  10          HD21      ASN  10   0.156   8.705  -7.445
   73    H    VAL  11           H        VAL  11  -1.083   6.759 -12.962
   74    HA   VAL  11           HA       VAL  11   0.886   6.945 -15.198
   75    HB   VAL  11           HB       VAL  11  -1.113   6.009 -16.544
   76   HG11  VAL  11          HG11      VAL  11  -0.412   3.675 -16.096
   77   HG12  VAL  11          HG12      VAL  11   0.975   4.775 -16.197
   78   HG13  VAL  11          HG13      VAL  11   0.412   4.209 -14.614
   79   HG21  VAL  11          HG21      VAL  11  -2.831   6.139 -14.705
   80   HG22  VAL  11          HG22      VAL  11  -2.676   4.519 -15.373
   81   HG23  VAL  11          HG23      VAL  11  -1.947   4.867 -13.819
   82    H    GLY  12           H        GLY  12   0.573   8.704 -16.577
   83    HA2  GLY  12           HA2      GLY  12  -1.805  10.455 -16.077
   84    HA3  GLY  12           HA3      GLY  12  -0.205  11.066 -16.499
   85    H    ILE  13           H        ILE  13  -3.167  10.469 -17.856
   86    HA   ILE  13           HA       ILE  13  -2.064   9.542 -20.480
   87    HB   ILE  13           HB       ILE  13  -4.941   9.863 -19.528
   88   HG12  ILE  13          HG12      ILE  13  -5.087   7.426 -20.177
   89   HG13  ILE  13          HG13      ILE  13  -3.344   7.419 -20.396
   90   HG21  ILE  13          HG21      ILE  13  -4.705  10.495 -21.938
   91   HG22  ILE  13          HG22      ILE  13  -3.983   8.906 -22.252
   92   HG23  ILE  13          HG23      ILE  13  -5.658   9.040 -21.685
   93   HD11  ILE  13          HD11      ILE  13  -4.123   6.392 -18.294
   94   HD12  ILE  13          HD12      ILE  13  -3.030   7.732 -17.974
   95   HD13  ILE  13          HD13      ILE  13  -4.792   7.949 -17.763
   96    H    VAL  14           H        VAL  14  -1.218  11.209 -21.680
   97    HA   VAL  14           HA       VAL  14  -2.431  13.917 -21.495
   98    HB   VAL  14           HB       VAL  14  -0.162  12.998 -23.317
   99   HG11  VAL  14          HG11      VAL  14  -1.371  15.063 -24.025
  100   HG12  VAL  14          HG12      VAL  14  -1.038  15.789 -22.438
  101   HG13  VAL  14          HG13      VAL  14   0.294  15.388 -23.552
  102   HG21  VAL  14          HG21      VAL  14   1.387  14.156 -21.830
  103   HG22  VAL  14          HG22      VAL  14   0.102  14.332 -20.622
  104   HG23  VAL  14          HG23      VAL  14   0.692  12.706 -21.122
  105    H    ILE  15           H        ILE  15  -4.607  13.152 -22.283
  106    HA   ILE  15           HA       ILE  15  -4.813  11.985 -24.946
  107    HB   ILE  15           HB       ILE  15  -6.794  13.823 -23.535
  108   HG12  ILE  15          HG12      ILE  15  -6.560  11.691 -22.328
  109   HG13  ILE  15          HG13      ILE  15  -8.147  11.926 -23.025
  110   HG21  ILE  15          HG21      ILE  15  -7.082  12.279 -26.107
  111   HG22  ILE  15          HG22      ILE  15  -8.461  12.925 -25.175
  112   HG23  ILE  15          HG23      ILE  15  -7.273  14.035 -25.839
  113   HD11  ILE  15          HD11      ILE  15  -7.670  10.404 -24.873
  114   HD12  ILE  15          HD12      ILE  15  -5.975  10.258 -24.394
  115   HD13  ILE  15          HD13      ILE  15  -7.262   9.589 -23.356
  116    H    CYS  16           H        CYS  16  -4.663  12.985 -26.900
  117    HA   CYS  16           HA       CYS  16  -4.443  15.969 -26.893
  118    HB2  CYS  16           HB2      CYS  16  -2.781  13.986 -28.511
  119    HB3  CYS  16           HB3      CYS  16  -2.982  15.712 -28.942
  120    HG   CYS  16           HG       CYS  16  -2.048  14.433 -26.041
  121    H    ASN  17           H        ASN  17  -5.999  16.824 -28.144
  122    HA   ASN  17           HA       ASN  17  -7.807  14.959 -29.545
  123    HB2  ASN  17           HB2      ASN  17  -8.881  16.902 -28.376
  124    HB3  ASN  17           HB3      ASN  17  -7.935  18.016 -29.389
  125   HD21  ASN  17          HD22      ASN  17 -10.768  15.982 -29.307
  126   HD22  ASN  17          HD21      ASN  17 -11.110  16.008 -31.026
  127    H    ARG  18           H        ARG  18  -7.204  14.473 -31.531
  128    HA   ARG  18           HA       ARG  18  -4.851  14.909 -32.745
  129    HB2  ARG  18           HB2      ARG  18  -6.074  14.291 -34.859
  130    HB3  ARG  18           HB3      ARG  18  -6.282  13.191 -33.448
  131    HG2  ARG  18           HG2      ARG  18  -8.494  14.191 -32.981
  132    HG3  ARG  18           HG3      ARG  18  -8.283  15.301 -34.353
  133    HD2  ARG  18           HD2      ARG  18  -8.168  13.425 -35.909
  134    HD3  ARG  18           HD3      ARG  18  -8.276  12.248 -34.593
  135    HE   ARG  18           HE       ARG  18 -10.420  13.851 -35.786
  136   HH11  ARG  18          HH21      ARG  18  -9.613  11.713 -32.979
  137   HH12  ARG  18          HH22      ARG  18 -11.279  11.463 -32.588
  138   HH21  ARG  18          HH11      ARG  18 -12.591  13.426 -35.210
  139   HH22  ARG  18          HH12      ARG  18 -12.970  12.420 -33.861
  140    H    GLN  19           H        GLN  19  -7.394  17.359 -32.791
  141    HA   GLN  19           HA       GLN  19  -6.264  18.714 -35.071
  142    HB2  GLN  19           HB2      GLN  19  -7.819  20.425 -34.711
  143    HB3  GLN  19           HB3      GLN  19  -8.640  18.942 -34.260
  144    HG2  GLN  19           HG2      GLN  19  -7.809  19.590 -31.805
  145    HG3  GLN  19           HG3      GLN  19  -7.639  21.195 -32.530
  146   HE21  GLN  19          HE22      GLN  19 -10.030  18.525 -32.144
  147   HE22  GLN  19          HE21      GLN  19 -11.385  19.607 -31.797
  148    H    GLY  20           H        GLY  20  -4.706  18.030 -32.315
  149    HA2  GLY  20           HA2      GLY  20  -2.495  18.644 -32.087
  150    HA3  GLY  20           HA3      GLY  20  -2.812  20.237 -32.782
  151    H    GLN  21           H        GLN  21  -4.931  19.036 -30.210
  152    HA   GLN  21           HA       GLN  21  -3.849  21.184 -28.464
  153    HB2  GLN  21           HB2      GLN  21  -6.796  20.684 -28.894
  154    HB3  GLN  21           HB3      GLN  21  -6.017  22.057 -28.122
  155    HG2  GLN  21           HG2      GLN  21  -6.093  21.397 -31.058
  156    HG3  GLN  21           HG3      GLN  21  -6.819  22.778 -30.262
  157   HE21  GLN  21          HE22      GLN  21  -4.699  22.393 -32.563
  158   HE22  GLN  21          HE21      GLN  21  -3.423  23.481 -32.081
  159    H    VAL  22           H        VAL  22  -4.758  20.862 -26.117
  160    HA   VAL  22           HA       VAL  22  -4.152  17.991 -25.593
  161    HB   VAL  22           HB       VAL  22  -3.166  18.806 -23.465
  162   HG11  VAL  22          HG11      VAL  22  -1.114  19.635 -24.519
  163   HG12  VAL  22          HG12      VAL  22  -1.808  18.319 -25.479
  164   HG13  VAL  22          HG13      VAL  22  -2.000  19.999 -26.012
  165   HG21  VAL  22          HG21      VAL  22  -3.459  21.585 -24.693
  166   HG22  VAL  22          HG22      VAL  22  -4.368  20.985 -23.296
  167   HG23  VAL  22          HG23      VAL  22  -2.603  21.160 -23.205
  168    H    MET  23           H        MET  23  -4.802  16.974 -23.717
  169    HA   MET  23           HA       MET  23  -7.483  16.925 -22.994
  170    HB2  MET  23           HB2      MET  23  -5.660  15.204 -22.503
  171    HB3  MET  23           HB3      MET  23  -5.091  16.223 -21.220
  172    HG2  MET  23           HG2      MET  23  -6.533  14.459 -20.370
  173    HG3  MET  23           HG3      MET  23  -7.245  16.045 -20.060
  174    HE1  MET  23           HE1      MET  23  -9.361  13.753 -19.631
  175    HE2  MET  23           HE2      MET  23  -9.625  15.516 -19.620
  176    HE3  MET  23           HE3      MET  23 -10.665  14.459 -20.607
  177    H    TRP  24           H        TRP  24  -8.714  18.288 -21.696
  178    HA   TRP  24           HA       TRP  24  -7.696  19.094 -19.169
  179    HB2  TRP  24           HB2      TRP  24  -7.011  20.971 -20.876
  180    HB3  TRP  24           HB3      TRP  24  -8.711  21.410 -20.827
  181    HD1  TRP  24           HD1      TRP  24  -8.751  23.512 -19.422
  182    HE1  TRP  24           HE1      TRP  24  -7.822  24.329 -17.185
  183    HE3  TRP  24           HE3      TRP  24  -5.800  19.483 -18.272
  184    HZ2  TRP  24           HZ2      TRP  24  -6.076  23.262 -15.047
  185    HZ3  TRP  24           HZ3      TRP  24  -4.663  19.366 -16.093
  186    HH2  TRP  24           HH2      TRP  24  -4.900  21.215 -14.448
  187    H    ALA  25           H        ALA  25  -9.420  18.975 -17.748
  188    HA   ALA  25           HA       ALA  25 -12.136  19.208 -18.817
  189    HB1  ALA  25           HB1      ALA  25 -12.748  16.955 -17.849
  190    HB2  ALA  25           HB2      ALA  25 -11.678  16.865 -19.266
  191    HB3  ALA  25           HB3      ALA  25 -11.017  16.628 -17.629
  192    H    ARG  26           H        ARG  26 -13.653  19.682 -17.271
  193    HA   ARG  26           HA       ARG  26 -12.659  21.064 -14.910
  194    HB2  ARG  26           HB2      ARG  26 -14.586  21.825 -16.299
  195    HB3  ARG  26           HB3      ARG  26 -15.503  20.397 -15.803
  196    HG2  ARG  26           HG2      ARG  26 -15.260  21.167 -13.393
  197    HG3  ARG  26           HG3      ARG  26 -14.500  22.650 -13.998
  198    HD2  ARG  26           HD2      ARG  26 -17.315  21.652 -14.615
  199    HD3  ARG  26           HD3      ARG  26 -16.913  22.948 -13.499
  200    HE   ARG  26           HE       ARG  26 -16.038  24.262 -15.366
  201   HH11  ARG  26          HH11      ARG  26 -18.350  21.627 -16.243
  202   HH12  ARG  26          HH12      ARG  26 -18.832  22.422 -17.695
  203   HH21  ARG  26          HH21      ARG  26 -16.750  25.257 -17.292
  204   HH22  ARG  26          HH22      ARG  26 -17.913  24.495 -18.307
  205    H    ARG  27           H        ARG  27 -12.491  20.136 -12.837
  206    HA   ARG  27           HA       ARG  27 -12.888  17.281 -12.650
  207    HB2  ARG  27           HB2      ARG  27 -10.999  18.616 -11.586
  208    HB3  ARG  27           HB3      ARG  27 -12.147  19.175 -10.392
  209    HG2  ARG  27           HG2      ARG  27 -11.302  16.284 -10.884
  210    HG3  ARG  27           HG3      ARG  27 -10.715  17.333  -9.600
  211    HD2  ARG  27           HD2      ARG  27 -13.017  17.437  -8.650
  212    HD3  ARG  27           HD3      ARG  27 -13.539  16.262  -9.868
  213    HE   ARG  27           HE       ARG  27 -11.517  14.927  -8.746
  214   HH11  ARG  27          HH21      ARG  27 -14.496  16.446  -7.460
  215   HH12  ARG  27          HH22      ARG  27 -14.539  15.446  -6.045
  216   HH21  ARG  27          HH11      ARG  27 -11.799  13.420  -7.075
  217   HH22  ARG  27          HH12      ARG  27 -12.963  13.683  -5.813
  218    H    PHE  28           H        PHE  28 -14.585  16.282 -11.859
  219    HA   PHE  28           HA       PHE  28 -17.195  17.097 -11.533
  220    HB2  PHE  28           HB2      PHE  28 -16.462  14.812 -11.738
  221    HB3  PHE  28           HB3      PHE  28 -15.483  14.919 -10.287
  222    HD1  PHE  28           HD1      PHE  28 -19.133  15.597 -11.060
  223    HD2  PHE  28           HD2      PHE  28 -16.227  13.420  -8.725
  224    HE1  PHE  28           HE1      PHE  28 -20.967  14.451  -9.843
  225    HE2  PHE  28           HE2      PHE  28 -18.065  12.210  -7.571
  226    HZ   PHE  28           HZ       PHE  28 -20.441  12.757  -8.097
  227    H    GLY  29           H        GLY  29 -18.169  18.471 -10.125
  228    HA2  GLY  29           HA2      GLY  29 -18.877  19.395  -8.192
  229    HA3  GLY  29           HA3      GLY  29 -17.950  18.169  -7.322
  230    H    GLN  30           H        GLN  30 -15.658  19.785  -9.171
  231    HA   GLN  30           HA       GLN  30 -14.809  21.209  -6.735
  232    HB2  GLN  30           HB2      GLN  30 -13.561  19.396  -8.192
  233    HB3  GLN  30           HB3      GLN  30 -13.095  20.794  -9.170
  234    HG2  GLN  30           HG2      GLN  30 -12.081  21.813  -7.128
  235    HG3  GLN  30           HG3      GLN  30 -12.626  20.427  -6.178
  236   HE21  GLN  30          HE22      GLN  30 -10.474  21.360  -8.917
  237   HE22  GLN  30          HE21      GLN  30  -9.384  19.994  -8.747
  238    H    HIS  31           H        HIS  31 -15.907  21.955  -9.982
  239    HA   HIS  31           HA       HIS  31 -15.923  23.781 -11.277
  240    HB2  HIS  31           HB2      HIS  31 -16.102  25.300  -8.661
  241    HB3  HIS  31           HB3      HIS  31 -16.510  25.921 -10.257
  242    HD1  HIS  31           HD1      HIS  31 -18.893  25.190 -11.255
  243    HD2  HIS  31           HD2      HIS  31 -17.778  23.370  -7.620
  244    HE1  HIS  31           HE1      HIS  31 -20.954  23.963 -10.403
  245    H    SER  32           H        SER  32 -13.390  22.678 -10.831
  246    HA   SER  32           HA       SER  32 -11.804  24.823 -11.944
  247    HB2  SER  32           HB2      SER  32  -9.826  24.280 -10.467
  248    HB3  SER  32           HB3      SER  32 -11.144  25.155  -9.686
  249    HG   SER  32           HG       SER  32 -10.611  23.576  -8.288
  250    H    TRP  33           H        TRP  33  -9.493  23.458 -12.512
  251    HA   TRP  33           HA       TRP  33 -10.578  21.144 -14.061
  252    HB2  TRP  33           HB2      TRP  33  -8.576  23.243 -14.875
  253    HB3  TRP  33           HB3      TRP  33  -9.111  21.870 -15.848
  254    HD1  TRP  33           HD1      TRP  33 -10.619  25.079 -14.264
  255    HE1  TRP  33           HE1      TRP  33 -12.570  25.892 -15.682
  256    HE3  TRP  33           HE3      TRP  33 -10.474  21.527 -17.910
  257    HZ2  TRP  33           HZ2      TRP  33 -14.042  24.985 -18.024
  258    HZ3  TRP  33           HZ3      TRP  33 -12.189  21.484 -19.716
  259    HH2  TRP  33           HH2      TRP  33 -14.005  23.191 -19.747
  260    H    GLN  34           H        GLN  34  -9.006  19.514 -14.761
  261    HA   GLN  34           HA       GLN  34  -6.570  19.178 -13.160
  262    HB2  GLN  34           HB2      GLN  34  -8.427  18.532 -11.636
  263    HB3  GLN  34           HB3      GLN  34  -9.043  17.402 -12.820
  264    HG2  GLN  34           HG2      GLN  34  -6.969  16.036 -12.560
  265    HG3  GLN  34           HG3      GLN  34  -6.372  17.201 -11.370
  266   HE21  GLN  34          HE22      GLN  34  -8.995  14.807 -12.087
  267   HE22  GLN  34          HE21      GLN  34  -9.438  14.528 -10.421
  268    H    PHE  35           H        PHE  35  -5.469  17.047 -13.856
  269    HA   PHE  35           HA       PHE  35  -6.174  16.346 -16.645
  270    HB2  PHE  35           HB2      PHE  35  -3.767  15.622 -16.830
  271    HB3  PHE  35           HB3      PHE  35  -4.093  17.324 -16.754
  272    HD1  PHE  35           HD1      PHE  35  -3.363  14.550 -14.228
  273    HD2  PHE  35           HD2      PHE  35  -2.462  18.530 -15.641
  274    HE1  PHE  35           HE1      PHE  35  -1.499  14.725 -12.612
  275    HE2  PHE  35           HE2      PHE  35  -0.546  18.636 -14.075
  276    HZ   PHE  35           HZ       PHE  35  -0.048  16.721 -12.582
  277    HA   PRO  36           HA       PRO  36  -6.918  12.244 -15.304
  278    HB2  PRO  36           HB2      PRO  36  -5.696  11.187 -17.849
  279    HB3  PRO  36           HB3      PRO  36  -7.320  10.903 -17.162
  280    HG2  PRO  36           HG2      PRO  36  -6.975  12.602 -19.213
  281    HG3  PRO  36           HG3      PRO  36  -8.024  13.110 -17.837
  282    HD2  PRO  36           HD2      PRO  36  -5.069  13.759 -18.243
  283    HD3  PRO  36           HD3      PRO  36  -6.435  14.878 -17.974
  284    H    GLN  37           H        GLN  37  -5.142  12.599 -13.677
  285    HA   GLN  37           HA       GLN  37  -2.854  10.680 -13.843
  286    HB2  GLN  37           HB2      GLN  37  -2.350  11.333 -11.585
  287    HB3  GLN  37           HB3      GLN  37  -2.244  12.629 -12.759
  288    HG2  GLN  37           HG2      GLN  37  -4.271  13.682 -11.923
  289    HG3  GLN  37           HG3      GLN  37  -4.672  12.271 -10.939
  290   HE21  GLN  37          HE22      GLN  37  -3.119  11.692  -9.121
  291   HE22  GLN  37          HE21      GLN  37  -2.207  12.969  -8.358
  292    H    GLY  38           H        GLY  38  -2.941   8.621 -12.749
  293    HA2  GLY  38           HA2      GLY  38  -5.100   8.080 -10.836
  294    HA3  GLY  38           HA3      GLY  38  -5.212   7.171 -12.351
  295    H    GLY  39           H        GLY  39  -4.696   6.146  -9.599
  296    HA2  GLY  39           HA2      GLY  39  -1.914   5.574  -9.280
  297    HA3  GLY  39           HA3      GLY  39  -3.254   4.914  -8.346
  298    H    ILE  40           H        ILE  40  -0.830   3.727  -9.628
  299    HA   ILE  40           HA       ILE  40  -1.855   1.659 -11.462
  300    HB   ILE  40           HB       ILE  40   0.828   1.975 -10.036
  301   HG12  ILE  40          HG12      ILE  40   0.008   2.680 -12.887
  302   HG13  ILE  40          HG13      ILE  40   0.339   3.835 -11.608
  303   HG21  ILE  40          HG21      ILE  40   0.168   0.143 -12.390
  304   HG22  ILE  40          HG22      ILE  40   1.740   0.325 -11.591
  305   HG23  ILE  40          HG23      ILE  40   0.409  -0.384 -10.707
  306   HD11  ILE  40          HD11      ILE  40   2.708   2.938 -11.491
  307   HD12  ILE  40          HD12      ILE  40   2.347   2.039 -12.991
  308   HD13  ILE  40          HD13      ILE  40   2.253   3.807 -12.968
  309    H    ASN  41           H        ASN  41  -2.510  -0.434 -10.815
  310    HA   ASN  41           HA       ASN  41  -2.832  -0.831  -7.913
  311    HB2  ASN  41           HB2      ASN  41  -4.769  -1.680  -8.544
  312    HB3  ASN  41           HB3      ASN  41  -4.336  -1.644 -10.224
  313   HD21  ASN  41          HD22      ASN  41  -4.384  -3.617 -11.266
  314   HD22  ASN  41          HD21      ASN  41  -4.245  -5.166 -10.445
  315    HA   PRO  42           HA       PRO  42   0.837  -2.884  -7.277
  316    HB2  PRO  42           HB2      PRO  42  -0.702  -5.035  -5.779
  317    HB3  PRO  42           HB3      PRO  42   0.831  -4.220  -5.312
  318    HG2  PRO  42           HG2      PRO  42  -1.525  -3.386  -4.259
  319    HG3  PRO  42           HG3      PRO  42  -0.322  -2.185  -4.816
  320    HD2  PRO  42           HD2      PRO  42  -2.838  -3.092  -6.198
  321    HD3  PRO  42           HD3      PRO  42  -2.095  -1.466  -6.111
  322    H    GLY  43           H        GLY  43   1.918  -3.748  -8.798
  323    HA2  GLY  43           HA2      GLY  43   2.961  -5.470  -9.975
  324    HA3  GLY  43           HA3      GLY  43   1.668  -6.584  -9.518
  325    H    GLU  44           H        GLU  44   0.307  -3.729 -10.728
  326    HA   GLU  44           HA       GLU  44  -0.817  -5.044 -13.022
  327    HB2  GLU  44           HB2      GLU  44  -1.912  -3.437 -11.570
  328    HB3  GLU  44           HB3      GLU  44  -0.795  -2.155 -12.075
  329    HG2  GLU  44           HG2      GLU  44  -1.715  -1.970 -14.169
  330    HG3  GLU  44           HG3      GLU  44  -2.531  -3.554 -14.083
  331    H    SER  45           H        SER  45   1.675  -2.563 -12.698
  332    HA   SER  45           HA       SER  45   3.157  -1.627 -14.099
  333    HB2  SER  45           HB2      SER  45   2.696  -3.879 -16.047
  334    HB3  SER  45           HB3      SER  45   3.985  -2.675 -16.097
  335    HG   SER  45           HG       SER  45   3.491  -4.601 -14.036
  336    H    ALA  46           H        ALA  46   3.412  -0.237 -15.803
  337    HA   ALA  46           HA       ALA  46   1.357   1.586 -15.759
  338    HB1  ALA  46           HB1      ALA  46   2.728   2.838 -17.326
  339    HB2  ALA  46           HB2      ALA  46   3.793   1.985 -16.193
  340    HB3  ALA  46           HB3      ALA  46   3.574   1.348 -17.828
  341    H    GLU  47           H        GLU  47   2.124  -0.621 -18.542
  342    HA   GLU  47           HA       GLU  47   0.146   0.675 -20.163
  343    HB2  GLU  47           HB2      GLU  47   1.673  -1.925 -20.650
  344    HB3  GLU  47           HB3      GLU  47   0.758  -1.011 -21.838
  345    HG2  GLU  47           HG2      GLU  47   2.964  -0.389 -22.258
  346    HG3  GLU  47           HG3      GLU  47   2.240   0.973 -21.404
  347    H    GLN  48           H        GLN  48  -0.420  -1.272 -17.604
  348    HA   GLN  48           HA       GLN  48  -2.977  -2.344 -18.742
  349    HB2  GLN  48           HB2      GLN  48  -1.432  -3.078 -16.218
  350    HB3  GLN  48           HB3      GLN  48  -3.045  -3.646 -16.590
  351    HG2  GLN  48           HG2      GLN  48  -1.354  -5.334 -17.081
  352    HG3  GLN  48           HG3      GLN  48  -2.264  -4.878 -18.525
  353   HE21  GLN  48          HE22      GLN  48   0.754  -3.867 -16.794
  354   HE22  GLN  48          HE21      GLN  48   1.732  -3.688 -18.259
  355    H    ALA  49           H        ALA  49  -1.484  -0.592 -15.933
  356    HA   ALA  49           HA       ALA  49  -3.883   0.364 -14.804
  357    HB1  ALA  49           HB1      ALA  49  -1.110   1.661 -14.807
  358    HB2  ALA  49           HB2      ALA  49  -2.451   2.021 -13.691
  359    HB3  ALA  49           HB3      ALA  49  -1.679   0.422 -13.666
  360    H    MET  50           H        MET  50  -1.828   1.815 -17.394
  361    HA   MET  50           HA       MET  50  -2.990   4.372 -17.427
  362    HB2  MET  50           HB2      MET  50  -0.840   3.747 -18.403
  363    HB3  MET  50           HB3      MET  50  -1.642   2.784 -19.643
  364    HG2  MET  50           HG2      MET  50  -2.156   5.755 -19.270
  365    HG3  MET  50           HG3      MET  50  -0.816   5.153 -20.217
  366    HE1  MET  50           HE1      MET  50  -2.142   3.805 -23.426
  367    HE2  MET  50           HE2      MET  50  -0.795   4.628 -22.610
  368    HE3  MET  50           HE3      MET  50  -1.344   3.037 -22.029
  369    H    TYR  51           H        TYR  51  -3.953   1.426 -19.217
  370    HA   TYR  51           HA       TYR  51  -6.147   2.712 -20.496
  371    HB2  TYR  51           HB2      TYR  51  -5.472  -0.208 -20.027
  372    HB3  TYR  51           HB3      TYR  51  -6.833   0.355 -20.979
  373    HD1  TYR  51           HD1      TYR  51  -3.103   0.540 -20.744
  374    HD2  TYR  51           HD2      TYR  51  -6.566   1.203 -23.215
  375    HE1  TYR  51           HE1      TYR  51  -1.639   0.537 -22.704
  376    HE2  TYR  51           HE2      TYR  51  -5.146   1.292 -25.210
  377    HH   TYR  51           HH       TYR  51  -2.987   0.900 -26.079
  378    H    ARG  52           H        ARG  52  -5.866   1.395 -17.215
  379    HA   ARG  52           HA       ARG  52  -8.802   1.253 -16.897
  380    HB2  ARG  52           HB2      ARG  52  -6.678   1.395 -14.723
  381    HB3  ARG  52           HB3      ARG  52  -8.415   1.086 -14.551
  382    HG2  ARG  52           HG2      ARG  52  -8.023  -0.952 -16.103
  383    HG3  ARG  52           HG3      ARG  52  -6.306  -0.714 -15.743
  384    HD2  ARG  52           HD2      ARG  52  -8.547  -1.226 -13.723
  385    HD3  ARG  52           HD3      ARG  52  -7.328  -2.383 -14.258
  386    HE   ARG  52           HE       ARG  52  -5.704  -1.412 -12.955
  387   HH11  ARG  52          HH11      ARG  52  -8.701   0.349 -12.329
  388   HH12  ARG  52          HH12      ARG  52  -7.950   1.764 -11.695
  389   HH21  ARG  52          HH21      ARG  52  -4.667   0.249 -11.896
  390   HH22  ARG  52          HH22      ARG  52  -5.553   1.534 -11.104
  391    H    ALA  53           H        ALA  53  -6.126   3.531 -15.938
  392    HA   ALA  53           HA       ALA  53  -7.854   5.485 -14.835
  393    HB1  ALA  53           HB1      ALA  53  -6.015   7.097 -15.311
  394    HB2  ALA  53           HB2      ALA  53  -5.431   5.597 -14.555
  395    HB3  ALA  53           HB3      ALA  53  -5.211   5.856 -16.298
  396    H    LEU  54           H        LEU  54  -6.929   4.959 -18.221
  397    HA   LEU  54           HA       LEU  54  -8.048   7.114 -19.585
  398    HB2  LEU  54           HB2      LEU  54  -6.757   5.119 -20.441
  399    HB3  LEU  54           HB3      LEU  54  -8.217   4.158 -20.159
  400    HG   LEU  54           HG       LEU  54  -9.376   5.350 -21.960
  401   HD11  LEU  54          HD11      LEU  54  -6.669   6.663 -22.447
  402   HD12  LEU  54          HD12      LEU  54  -8.097   6.752 -23.511
  403   HD13  LEU  54          HD13      LEU  54  -8.150   7.495 -21.907
  404   HD21  LEU  54          HD21      LEU  54  -8.224   4.176 -23.719
  405   HD22  LEU  54          HD22      LEU  54  -6.743   4.057 -22.723
  406   HD23  LEU  54          HD23      LEU  54  -8.237   3.218 -22.234
  407    H    PHE  55           H        PHE  55  -9.630   4.107 -18.513
  408    HA   PHE  55           HA       PHE  55 -12.304   4.904 -19.161
  409    HB2  PHE  55           HB2      PHE  55 -12.249   2.673 -19.229
  410    HB3  PHE  55           HB3      PHE  55 -10.897   2.548 -18.124
  411    HD1  PHE  55           HD1      PHE  55 -14.609   3.000 -18.253
  412    HD2  PHE  55           HD2      PHE  55 -11.174   1.963 -15.864
  413    HE1  PHE  55           HE1      PHE  55 -16.109   2.280 -16.402
  414    HE2  PHE  55           HE2      PHE  55 -12.680   1.221 -14.021
  415    HZ   PHE  55           HZ       PHE  55 -15.147   1.383 -14.294
  416    H    GLU  56           H        GLU  56 -10.554   4.728 -15.989
  417    HA   GLU  56           HA       GLU  56 -12.861   5.289 -14.472
  418    HB2  GLU  56           HB2      GLU  56  -9.904   5.728 -13.843
  419    HB3  GLU  56           HB3      GLU  56 -11.199   5.978 -12.669
  420    HG2  GLU  56           HG2      GLU  56 -11.908   3.603 -12.978
  421    HG3  GLU  56           HG3      GLU  56 -10.502   3.343 -14.005
  422    H    GLU  57           H        GLU  57 -10.439   7.456 -15.882
  423    HA   GLU  57           HA       GLU  57 -11.583   9.845 -14.642
  424    HB2  GLU  57           HB2      GLU  57  -9.274   9.551 -16.605
  425    HB3  GLU  57           HB3      GLU  57  -9.645  10.954 -15.626
  426    HG2  GLU  57           HG2      GLU  57  -8.713   8.235 -14.606
  427    HG3  GLU  57           HG3      GLU  57  -7.734   9.680 -14.747
  428    H    VAL  58           H        VAL  58 -11.197   8.486 -17.973
  429    HA   VAL  58           HA       VAL  58 -12.786  10.771 -19.016
  430    HB   VAL  58           HB       VAL  58 -10.914   9.226 -20.782
  431   HG11  VAL  58          HG11      VAL  58 -11.506  12.200 -20.538
  432   HG12  VAL  58          HG12      VAL  58 -10.632  11.379 -21.851
  433   HG13  VAL  58          HG13      VAL  58 -12.362  11.082 -21.622
  434   HG21  VAL  58          HG21      VAL  58  -9.892  11.271 -18.741
  435   HG22  VAL  58          HG22      VAL  58  -9.349   9.587 -18.945
  436   HG23  VAL  58          HG23      VAL  58  -9.012  10.766 -20.197
  437    H    GLY  59           H        GLY  59 -13.044   7.422 -18.497
  438    HA2  GLY  59           HA2      GLY  59 -14.702   5.967 -19.090
  439    HA3  GLY  59           HA3      GLY  59 -15.529   7.283 -19.920
  440    H    LEU  60           H        LEU  60 -12.260   6.597 -20.897
  441    HA   LEU  60           HA       LEU  60 -13.285   5.532 -23.486
  442    HB2  LEU  60           HB2      LEU  60 -10.678   6.911 -22.723
  443    HB3  LEU  60           HB3      LEU  60 -10.963   6.149 -24.278
  444    HG   LEU  60           HG       LEU  60 -12.436   8.526 -23.088
  445   HD11  LEU  60          HD11      LEU  60 -10.649   8.331 -25.553
  446   HD12  LEU  60          HD12      LEU  60 -11.397   9.800 -24.896
  447   HD13  LEU  60          HD13      LEU  60 -10.147   8.971 -23.965
  448   HD21  LEU  60          HD21      LEU  60 -13.567   8.712 -25.336
  449   HD22  LEU  60          HD22      LEU  60 -12.971   7.110 -25.731
  450   HD23  LEU  60          HD23      LEU  60 -14.086   7.328 -24.375
  451    H    SER  61           H        SER  61 -12.274   3.652 -24.380
  452    HA   SER  61           HA       SER  61 -11.095   1.865 -22.290
  453    HB2  SER  61           HB2      SER  61 -12.977   1.099 -24.543
  454    HB3  SER  61           HB3      SER  61 -12.416   0.082 -23.202
  455    HG   SER  61           HG       SER  61 -14.520   0.903 -22.802
  456    H    ARG  62           H        ARG  62 -10.315  -0.244 -23.729
  457    HA   ARG  62           HA       ARG  62  -7.859   0.779 -24.785
  458    HB2  ARG  62           HB2      ARG  62  -8.590  -2.176 -24.764
  459    HB3  ARG  62           HB3      ARG  62  -7.021  -1.413 -24.537
  460    HG2  ARG  62           HG2      ARG  62  -8.189  -0.472 -22.324
  461    HG3  ARG  62           HG3      ARG  62  -9.304  -1.809 -22.586
  462    HD2  ARG  62           HD2      ARG  62  -7.398  -3.392 -22.650
  463    HD3  ARG  62           HD3      ARG  62  -6.281  -2.059 -22.302
  464    HE   ARG  62           HE       ARG  62  -8.207  -2.017 -20.242
  465   HH11  ARG  62          HH11      ARG  62  -5.740  -4.292 -21.430
  466   HH12  ARG  62          HH12      ARG  62  -5.584  -5.129 -19.928
  467   HH21  ARG  62          HH21      ARG  62  -8.017  -3.146 -18.247
  468   HH22  ARG  62          HH22      ARG  62  -6.877  -4.430 -18.076
  469    H    LYS  63           H        LYS  63  -9.343   1.819 -26.466
  470    HA   LYS  63           HA       LYS  63  -8.973   0.571 -29.099
  471    HB2  LYS  63           HB2      LYS  63 -11.315   0.230 -29.572
  472    HB3  LYS  63           HB3      LYS  63 -10.980  -0.582 -28.035
  473    HG2  LYS  63           HG2      LYS  63 -11.911   1.416 -26.823
  474    HG3  LYS  63           HG3      LYS  63 -12.341   2.123 -28.392
  475    HD2  LYS  63           HD2      LYS  63 -13.877   0.250 -28.841
  476    HD3  LYS  63           HD3      LYS  63 -13.422  -0.490 -27.297
  477    HE2  LYS  63           HE2      LYS  63 -15.514   0.692 -26.987
  478    HE3  LYS  63           HE3      LYS  63 -14.239   1.520 -26.074
  479    HZ1  LYS  63           HZ1      LYS  63 -15.828   2.961 -27.425
  480    HZ2  LYS  63           HZ2      LYS  63 -14.248   3.295 -27.577
  481    HZ3  LYS  63           HZ3      LYS  63 -15.048   2.454 -28.761
  482    H    ASP  64           H        ASP  64 -10.059   3.167 -26.982
  483    HA   ASP  64           HA       ASP  64 -11.106   4.869 -29.102
  484    HB2  ASP  64           HB2      ASP  64 -10.678   5.022 -26.097
  485    HB3  ASP  64           HB3      ASP  64 -11.326   6.382 -27.007
  486    H    VAL  65           H        VAL  65  -7.953   4.294 -28.123
  487    HA   VAL  65           HA       VAL  65  -7.052   6.948 -28.944
  488    HB   VAL  65           HB       VAL  65  -5.738   7.260 -26.909
  489   HG11  VAL  65          HG11      VAL  65  -8.029   8.292 -27.189
  490   HG12  VAL  65          HG12      VAL  65  -8.671   7.005 -26.173
  491   HG13  VAL  65          HG13      VAL  65  -7.462   8.117 -25.512
  492   HG21  VAL  65          HG21      VAL  65  -7.367   4.975 -25.710
  493   HG22  VAL  65          HG22      VAL  65  -5.654   4.853 -26.137
  494   HG23  VAL  65          HG23      VAL  65  -6.161   5.975 -24.870
  495    H    ARG  66           H        ARG  66  -4.555   6.941 -28.847
  496    HA   ARG  66           HA       ARG  66  -3.415   4.362 -29.826
  497    HB2  ARG  66           HB2      ARG  66  -4.353   5.411 -31.786
  498    HB3  ARG  66           HB3      ARG  66  -3.917   7.023 -31.234
  499    HG2  ARG  66           HG2      ARG  66  -2.539   6.540 -33.040
  500    HG3  ARG  66           HG3      ARG  66  -1.529   6.520 -31.608
  501    HD2  ARG  66           HD2      ARG  66  -2.696   3.884 -32.520
  502    HD3  ARG  66           HD3      ARG  66  -1.489   4.616 -33.583
  503    HE   ARG  66           HE       ARG  66  -0.169   4.771 -31.256
  504   HH11  ARG  66          HH11      ARG  66  -1.781   1.992 -32.820
  505   HH12  ARG  66          HH12      ARG  66  -0.655   0.842 -32.201
  506   HH21  ARG  66          HH21      ARG  66   1.312   3.270 -30.487
  507   HH22  ARG  66          HH22      ARG  66   1.143   1.579 -30.826
  508    H    ILE  67           H        ILE  67  -1.449   4.220 -28.612
  509    HA   ILE  67           HA       ILE  67  -0.361   6.589 -27.332
  510    HB   ILE  67           HB       ILE  67   0.802   3.806 -27.727
  511   HG12  ILE  67          HG12      ILE  67  -0.562   4.944 -25.242
  512   HG13  ILE  67          HG13      ILE  67  -1.419   3.949 -26.415
  513   HG21  ILE  67          HG21      ILE  67   1.580   6.054 -25.809
  514   HG22  ILE  67          HG22      ILE  67   2.322   4.436 -25.871
  515   HG23  ILE  67          HG23      ILE  67   2.516   5.520 -27.227
  516   HD11  ILE  67          HD11      ILE  67   0.256   2.109 -26.047
  517   HD12  ILE  67          HD12      ILE  67   1.002   3.083 -24.753
  518   HD13  ILE  67          HD13      ILE  67  -0.657   2.530 -24.587
  519    H    LEU  68           H        LEU  68   0.944   8.039 -28.215
  520    HA   LEU  68           HA       LEU  68   2.195   7.414 -30.870
  521    HB2  LEU  68           HB2      LEU  68   0.531   9.572 -29.985
  522    HB3  LEU  68           HB3      LEU  68   2.135  10.248 -30.166
  523    HG   LEU  68           HG       LEU  68   0.804  10.558 -32.145
  524   HD11  LEU  68          HD11      LEU  68   3.251  10.247 -32.459
  525   HD12  LEU  68          HD12      LEU  68   2.993   8.518 -32.764
  526   HD13  LEU  68          HD13      LEU  68   2.317   9.728 -33.869
  527   HD21  LEU  68          HD21      LEU  68  -0.001   8.750 -33.551
  528   HD22  LEU  68          HD22      LEU  68   0.658   7.526 -32.452
  529   HD23  LEU  68          HD23      LEU  68  -0.666   8.589 -31.916
  530    H    ALA  69           H        ALA  69   2.832   8.653 -27.582
  531    HA   ALA  69           HA       ALA  69   5.660   8.050 -27.827
  532    HB1  ALA  69           HB1      ALA  69   4.692  10.930 -27.419
  533    HB2  ALA  69           HB2      ALA  69   6.365  10.372 -27.175
  534    HB3  ALA  69           HB3      ALA  69   5.646  10.326 -28.793
  535    H    SER  70           H        SER  70   6.682   8.402 -25.570
  536    HA   SER  70           HA       SER  70   4.807   8.855 -23.372
  537    HB2  SER  70           HB2      SER  70   6.519   6.355 -23.285
  538    HB3  SER  70           HB3      SER  70   5.168   6.810 -22.228
  539    HG   SER  70           HG       SER  70   4.713   5.147 -23.837
  540    H    THR  71           H        THR  71   6.121   9.133 -21.225
  541    HA   THR  71           HA       THR  71   8.393  10.770 -21.714
  542    HB   THR  71           HB       THR  71   8.606  10.423 -19.105
  543    HG1  THR  71           HG1      THR  71   7.294   8.609 -18.910
  544   HG21  THR  71          HG21      THR  71   6.628  11.937 -18.763
  545   HG22  THR  71          HG22      THR  71   7.757  12.471 -20.022
  546   HG23  THR  71          HG23      THR  71   6.226  11.705 -20.487
  547    H    ARG  72           H        ARG  72  10.598  10.471 -21.149
  548    HA   ARG  72           HA       ARG  72  11.601   8.046 -22.241
  549    HB2  ARG  72           HB2      ARG  72  13.124  10.166 -20.672
  550    HB3  ARG  72           HB3      ARG  72  13.817   8.990 -21.796
  551    HG2  ARG  72           HG2      ARG  72  12.511  10.057 -23.665
  552    HG3  ARG  72           HG3      ARG  72  11.913  11.255 -22.507
  553    HD2  ARG  72           HD2      ARG  72  14.437  11.728 -22.012
  554    HD3  ARG  72           HD3      ARG  72  14.725  10.876 -23.538
  555    HE   ARG  72           HE       ARG  72  12.696  13.033 -23.579
  556   HH11  ARG  72          HH11      ARG  72  16.090  12.232 -24.329
  557   HH12  ARG  72          HH12      ARG  72  16.351  13.670 -25.252
  558   HH21  ARG  72          HH21      ARG  72  13.064  14.945 -24.600
  559   HH22  ARG  72          HH22      ARG  72  14.540  15.238 -25.487
  560    H    ASN  73           H        ASN  73  11.285   9.151 -18.904
  561    HA   ASN  73           HA       ASN  73  11.296   6.476 -17.928
  562    HB2  ASN  73           HB2      ASN  73  13.021   6.540 -16.327
  563    HB3  ASN  73           HB3      ASN  73  13.793   7.080 -17.805
  564   HD21  ASN  73          HD22      ASN  73  13.936   9.602 -18.049
  565   HD22  ASN  73          HD21      ASN  73  14.244  10.494 -16.578
  566    H    TRP  74           H        TRP  74  10.827   6.707 -15.377
  567    HA   TRP  74           HA       TRP  74   8.383   8.043 -15.175
  568    HB2  TRP  74           HB2      TRP  74  10.283   7.021 -13.022
  569    HB3  TRP  74           HB3      TRP  74   8.628   7.553 -12.737
  570    HD1  TRP  74           HD1      TRP  74  10.598   4.654 -14.275
  571    HE1  TRP  74           HE1      TRP  74   9.012   2.726 -14.817
  572    HE3  TRP  74           HE3      TRP  74   6.152   6.834 -13.005
  573    HZ2  TRP  74           HZ2      TRP  74   6.189   2.298 -15.048
  574    HZ3  TRP  74           HZ3      TRP  74   4.026   5.619 -13.375
  575    HH2  TRP  74           HH2      TRP  74   3.996   3.446 -14.535
  576    H    LEU  75           H        LEU  75   7.856  10.101 -14.851
  577    HA   LEU  75           HA       LEU  75   9.850  12.080 -13.919
  578    HB2  LEU  75           HB2      LEU  75   6.926  12.277 -14.767
  579    HB3  LEU  75           HB3      LEU  75   7.862  13.638 -14.146
  580    HG   LEU  75           HG       LEU  75   8.311  12.110 -16.740
  581   HD11  LEU  75          HD11      LEU  75   7.734  14.251 -17.764
  582   HD12  LEU  75          HD12      LEU  75   6.461  13.782 -16.612
  583   HD13  LEU  75          HD13      LEU  75   7.628  15.032 -16.168
  584   HD21  LEU  75          HD21      LEU  75  10.021  14.327 -15.518
  585   HD22  LEU  75          HD22      LEU  75  10.540  12.680 -15.951
  586   HD23  LEU  75          HD23      LEU  75  10.092  13.816 -17.220
  587    H    ARG  76           H        ARG  76   9.405  13.290 -11.935
  588    HA   ARG  76           HA       ARG  76   7.406  12.185 -10.132
  589    HB2  ARG  76           HB2      ARG  76   8.961  11.752  -8.281
  590    HB3  ARG  76           HB3      ARG  76   9.000  10.572  -9.558
  591    HG2  ARG  76           HG2      ARG  76  11.092  12.774  -9.342
  592    HG3  ARG  76           HG3      ARG  76  11.199  11.244  -8.471
  593    HD2  ARG  76           HD2      ARG  76  11.055  10.020 -10.661
  594    HD3  ARG  76           HD3      ARG  76  11.193  11.580 -11.490
  595    HE   ARG  76           HE       ARG  76  13.313  11.394  -9.636
  596   HH11  ARG  76          HH11      ARG  76  12.280   9.872 -12.700
  597   HH12  ARG  76          HH12      ARG  76  13.858   9.417 -13.182
  598   HH21  ARG  76          HH22      ARG  76  15.449  10.795 -10.284
  599   HH22  ARG  76          HH21      ARG  76  15.716   9.961 -11.774
  600    H    TYR  77           H        TYR  77   6.757  13.699  -8.602
  601    HA   TYR  77           HA       TYR  77   8.342  16.164  -8.286
  602    HB2  TYR  77           HB2      TYR  77   6.465  17.633  -8.701
  603    HB3  TYR  77           HB3      TYR  77   6.833  16.697 -10.134
  604    HD1  TYR  77           HD1      TYR  77   4.444  16.958  -7.245
  605    HD2  TYR  77           HD2      TYR  77   5.106  15.450 -11.228
  606    HE1  TYR  77           HE1      TYR  77   2.070  16.357  -7.410
  607    HE2  TYR  77           HE2      TYR  77   2.716  14.915 -11.438
  608    HH   TYR  77           HH       TYR  77   0.611  14.906 -10.365
  609    H    LYS  78           H        LYS  78   7.601  17.371  -6.344
  610    HA   LYS  78           HA       LYS  78   6.534  15.450  -4.341
  611    HB2  LYS  78           HB2      LYS  78   8.244  17.940  -4.016
  612    HB3  LYS  78           HB3      LYS  78   7.358  17.198  -2.679
  613    HG2  LYS  78           HG2      LYS  78   8.482  14.970  -3.360
  614    HG3  LYS  78           HG3      LYS  78   9.606  15.960  -4.299
  615    HD2  LYS  78           HD2      LYS  78   8.979  16.198  -1.319
  616    HD3  LYS  78           HD3      LYS  78  10.400  15.380  -1.969
  617    HE2  LYS  78           HE2      LYS  78   9.808  18.364  -2.318
  618    HE3  LYS  78           HE3      LYS  78  10.840  17.685  -1.061
  619    HZ1  LYS  78           HZ1      LYS  78  12.313  16.819  -2.794
  620    HZ2  LYS  78           HZ2      LYS  78  11.389  17.486  -3.973
  621    HZ3  LYS  78           HZ3      LYS  78  12.169  18.440  -2.906
  622    H    LEU  79           H        LEU  79   5.119  16.159  -2.782
  623    HA   LEU  79           HA       LEU  79   3.013  18.018  -3.744
  624    HB2  LEU  79           HB2      LEU  79   3.129  16.143  -1.337
  625    HB3  LEU  79           HB3      LEU  79   1.729  17.098  -1.805
  626    HG   LEU  79           HG       LEU  79   2.966  14.844  -3.441
  627   HD11  LEU  79          HD11      LEU  79   1.930  13.999  -1.411
  628   HD12  LEU  79          HD12      LEU  79   0.436  14.900  -1.765
  629   HD13  LEU  79          HD13      LEU  79   0.965  13.561  -2.820
  630   HD21  LEU  79          HD21      LEU  79   1.866  16.465  -4.915
  631   HD22  LEU  79          HD22      LEU  79   0.917  14.978  -4.816
  632   HD23  LEU  79          HD23      LEU  79   0.402  16.414  -3.903
  633    HA   PRO  80           HA       PRO  80   4.612  21.094  -0.826
  634    HB2  PRO  80           HB2      PRO  80   2.371  22.519  -0.199
  635    HB3  PRO  80           HB3      PRO  80   3.095  22.580  -1.841
  636    HG2  PRO  80           HG2      PRO  80   0.888  20.724  -0.864
  637    HG3  PRO  80           HG3      PRO  80   0.805  21.872  -2.272
  638    HD2  PRO  80           HD2      PRO  80   1.440  19.306  -2.708
  639    HD3  PRO  80           HD3      PRO  80   2.407  20.576  -3.498
  640    H    LYS  81           H        LYS  81   4.529  21.459   1.535
  641    HA   LYS  81           HA       LYS  81   4.276  19.037   2.844
  642    HB2  LYS  81           HB2      LYS  81   4.381  21.848   4.037
  643    HB3  LYS  81           HB3      LYS  81   4.640  20.390   4.985
  644    HG2  LYS  81           HG2      LYS  81   6.346  21.140   2.570
  645    HG3  LYS  81           HG3      LYS  81   6.729  21.641   4.200
  646    HD2  LYS  81           HD2      LYS  81   6.442  18.720   3.360
  647    HD3  LYS  81           HD3      LYS  81   7.965  19.591   3.331
  648    HE2  LYS  81           HE2      LYS  81   6.280  19.185   5.856
  649    HE3  LYS  81           HE3      LYS  81   7.614  18.142   5.356
  650    HZ1  LYS  81           HZ1      LYS  81   9.112  20.054   5.527
  651    HZ2  LYS  81           HZ2      LYS  81   7.887  21.017   6.050
  652    HZ3  LYS  81           HZ3      LYS  81   8.375  19.747   6.947
  653    H    ARG  82           H        ARG  82   1.823  21.497   2.658
  654    HA   ARG  82           HA       ARG  82   0.128  20.376   4.690
  655    HB2  ARG  82           HB2      ARG  82  -1.494  22.015   3.976
  656    HB3  ARG  82           HB3      ARG  82   0.104  22.737   4.035
  657    HG2  ARG  82           HG2      ARG  82   0.068  22.072   1.379
  658    HG3  ARG  82           HG3      ARG  82  -1.666  22.137   1.665
  659    HD2  ARG  82           HD2      ARG  82  -0.968  24.288   0.887
  660    HD3  ARG  82           HD3      ARG  82  -1.363  24.452   2.609
  661    HE   ARG  82           HE       ARG  82   1.440  23.886   2.294
  662   HH11  ARG  82          HH21      ARG  82  -0.887  26.526   1.770
  663   HH12  ARG  82          HH22      ARG  82   0.276  27.788   1.962
  664   HH21  ARG  82          HH11      ARG  82   3.001  25.585   2.584
  665   HH22  ARG  82          HH12      ARG  82   2.529  27.234   2.427
  666    H    LEU  83           H        LEU  83   0.701  19.417   1.417
  667    HA   LEU  83           HA       LEU  83  -1.895  17.981   1.259
  668    HB2  LEU  83           HB2      LEU  83  -1.305  19.646  -0.539
  669    HB3  LEU  83           HB3      LEU  83   0.079  18.623  -0.950
  670    HG   LEU  83           HG       LEU  83  -1.434  16.795  -1.610
  671   HD11  LEU  83          HD11      LEU  83  -3.679  18.733  -0.889
  672   HD12  LEU  83          HD12      LEU  83  -3.895  17.233  -1.821
  673   HD13  LEU  83          HD13      LEU  83  -3.369  17.155  -0.140
  674   HD21  LEU  83          HD21      LEU  83  -0.731  18.495  -3.247
  675   HD22  LEU  83          HD22      LEU  83  -2.347  17.867  -3.618
  676   HD23  LEU  83          HD23      LEU  83  -2.167  19.471  -2.869
  677    H    VAL  84           H        VAL  84   1.585  17.546   1.487
  678    HA   VAL  84           HA       VAL  84   1.908  14.831   0.851
  679    HB   VAL  84           HB       VAL  84   3.018  16.477   3.177
  680   HG11  VAL  84          HG11      VAL  84   3.931  13.695   2.316
  681   HG12  VAL  84          HG12      VAL  84   4.784  14.756   3.450
  682   HG13  VAL  84          HG13      VAL  84   3.201  14.116   3.868
  683   HG21  VAL  84          HG21      VAL  84   4.299  15.595   0.561
  684   HG22  VAL  84          HG22      VAL  84   3.766  17.224   0.949
  685   HG23  VAL  84          HG23      VAL  84   5.098  16.517   1.847
  686    H    ARG  85           H        ARG  85   1.167  12.978   1.722
  687    HA   ARG  85           HA       ARG  85  -0.615  13.158   4.118
  688    HB2  ARG  85           HB2      ARG  85  -0.369  11.033   1.991
  689    HB3  ARG  85           HB3      ARG  85  -0.819  10.565   3.616
  690    HG2  ARG  85           HG2      ARG  85  -2.875  10.916   2.521
  691    HG3  ARG  85           HG3      ARG  85  -2.661  12.279   3.619
  692    HD2  ARG  85           HD2      ARG  85  -3.479  13.112   1.505
  693    HD3  ARG  85           HD3      ARG  85  -1.792  13.632   1.675
  694    HE   ARG  85           HE       ARG  85  -1.935  11.081   0.386
  695   HH11  ARG  85          HH21      ARG  85  -2.076  14.533  -0.313
  696   HH12  ARG  85          HH22      ARG  85  -2.448  14.355  -2.004
  697   HH21  ARG  85          HH11      ARG  85  -2.308  10.801  -1.913
  698   HH22  ARG  85          HH12      ARG  85  -2.420  12.172  -2.951
  699    H    TRP  86           H        TRP  86   0.097  12.649   6.000
  700    HA   TRP  86           HA       TRP  86   2.625  11.131   6.337
  701    HB2  TRP  86           HB2      TRP  86   0.958  12.715   8.318
  702    HB3  TRP  86           HB3      TRP  86   2.578  12.072   8.587
  703    HD1  TRP  86           HD1      TRP  86   0.748  14.921   6.793
  704    HE1  TRP  86           HE1      TRP  86   2.386  16.648   5.901
  705    HE3  TRP  86           HE3      TRP  86   5.115  12.533   7.995
  706    HZ2  TRP  86           HZ2      TRP  86   5.270  16.961   5.719
  707    HZ3  TRP  86           HZ3      TRP  86   7.298  13.575   7.446
  708    HH2  TRP  86           HH2      TRP  86   7.391  15.777   6.305
  709    H    ASP  87           H        ASP  87  -0.524  10.399   5.795
  710    HA   ASP  87           HA       ASP  87  -0.902   8.521   8.073
  711    HB2  ASP  87           HB2      ASP  87  -2.689  10.110   7.517
  712    HB3  ASP  87           HB3      ASP  87  -2.755   9.485   5.869
  713    H    THR  88           H        THR  88   0.200   8.573   4.760
  714    HA   THR  88           HA       THR  88  -0.952   6.077   3.950
  715    HB   THR  88           HB       THR  88   0.855   6.523   2.086
  716    HG1  THR  88           HG1      THR  88   2.144   7.999   2.863
  717   HG21  THR  88          HG21      THR  88  -1.418   8.469   2.647
  718   HG22  THR  88          HG22      THR  88  -0.559   8.315   1.100
  719   HG23  THR  88          HG23      THR  88  -1.520   6.963   1.715
  720    H    LYS  89           H        LYS  89   2.142   7.032   5.322
  721    HA   LYS  89           HA       LYS  89   4.074   5.914   5.910
  722    HB2  LYS  89           HB2      LYS  89   1.907   4.270   7.228
  723    HB3  LYS  89           HB3      LYS  89   3.635   4.157   7.607
  724    HG2  LYS  89           HG2      LYS  89   3.665   6.618   8.106
  725    HG3  LYS  89           HG3      LYS  89   1.911   6.667   7.852
  726    HD2  LYS  89           HD2      LYS  89   1.560   5.118   9.726
  727    HD3  LYS  89           HD3      LYS  89   3.300   4.887   9.888
  728    HE2  LYS  89           HE2      LYS  89   2.596   6.371  11.630
  729    HE3  LYS  89           HE3      LYS  89   3.601   7.269  10.499
  730    HZ1  LYS  89           HZ1      LYS  89   1.614   8.493  11.204
  731    HZ2  LYS  89           HZ2      LYS  89   1.598   8.294   9.586
  732    HZ3  LYS  89           HZ3      LYS  89   0.629   7.365  10.557
  733    HA   PRO  90           HA       PRO  90   6.088   5.525   4.593
  734    HB2  PRO  90           HB2      PRO  90   5.812   5.468   1.582
  735    HB3  PRO  90           HB3      PRO  90   7.297   5.596   2.572
  736    HG2  PRO  90           HG2      PRO  90   6.588   3.213   1.511
  737    HG3  PRO  90           HG3      PRO  90   7.160   3.291   3.214
  738    HD2  PRO  90           HD2      PRO  90   4.311   3.134   2.195
  739    HD3  PRO  90           HD3      PRO  90   5.084   2.257   3.549
  740    H    VAL  91           H        VAL  91   6.137   7.728   4.567
  741    HA   VAL  91           HA       VAL  91   3.775   9.312   4.333
  742    HB   VAL  91           HB       VAL  91   6.735  10.073   4.308
  743   HG11  VAL  91          HG11      VAL  91   4.362  11.854   4.992
  744   HG12  VAL  91          HG12      VAL  91   6.076  12.301   4.967
  745   HG13  VAL  91          HG13      VAL  91   5.245  11.911   3.459
  746   HG21  VAL  91          HG21      VAL  91   6.386  10.596   6.717
  747   HG22  VAL  91          HG22      VAL  91   4.746   9.924   6.619
  748   HG23  VAL  91          HG23      VAL  91   6.162   8.879   6.379
  749    H    CYS  92           H        CYS  92   2.854  10.143   2.532
  750    HA   CYS  92           HA       CYS  92   4.076   9.400  -0.065
  751    HB2  CYS  92           HB2      CYS  92   1.815   8.699   0.455
  752    HB3  CYS  92           HB3      CYS  92   1.315  10.391   0.713
  753    HG   CYS  92           HG       CYS  92   0.408   9.527  -1.622
  754    H    ILE  93           H        ILE  93   5.689  10.874  -0.304
  755    HA   ILE  93           HA       ILE  93   5.184  13.716   0.230
  756    HB   ILE  93           HB       ILE  93   7.543  14.053  -0.110
  757   HG12  ILE  93          HG12      ILE  93   7.845  11.060  -0.593
  758   HG13  ILE  93          HG13      ILE  93   7.913  12.275  -1.863
  759   HG21  ILE  93          HG21      ILE  93   8.329  12.942   1.894
  760   HG22  ILE  93          HG22      ILE  93   6.633  13.360   2.114
  761   HG23  ILE  93          HG23      ILE  93   7.098  11.678   1.746
  762   HD11  ILE  93          HD11      ILE  93   9.849  11.942   0.450
  763   HD12  ILE  93          HD12      ILE  93  10.160  11.726  -1.276
  764   HD13  ILE  93          HD13      ILE  93   9.850  13.352  -0.640
  765    H    GLY  94           H        GLY  94   4.842  11.656  -2.539
  766    HA2  GLY  94           HA2      GLY  94   4.741  13.960  -4.335
  767    HA3  GLY  94           HA3      GLY  94   6.200  12.991  -4.504
  768    H    GLN  95           H        GLN  95   4.883  13.129  -6.717
  769    HA   GLN  95           HA       GLN  95   3.095  10.733  -6.941
  770    HB2  GLN  95           HB2      GLN  95   2.542  13.463  -7.541
  771    HB3  GLN  95           HB3      GLN  95   2.983  12.772  -9.088
  772    HG2  GLN  95           HG2      GLN  95   0.698  12.454  -9.113
  773    HG3  GLN  95           HG3      GLN  95   1.207  10.919  -8.491
  774   HE21  GLN  95          HE22      GLN  95   1.545  11.316  -5.653
  775   HE22  GLN  95          HE21      GLN  95   0.044  11.926  -5.024
  776    H    LYS  96           H        LYS  96   4.296   9.100  -7.905
  777    HA   LYS  96           HA       LYS  96   6.539   9.831  -9.764
  778    HB2  LYS  96           HB2      LYS  96   7.264   8.104  -8.329
  779    HB3  LYS  96           HB3      LYS  96   5.699   7.285  -8.316
  780    HG2  LYS  96           HG2      LYS  96   6.035   6.477 -10.611
  781    HG3  LYS  96           HG3      LYS  96   7.524   7.431 -10.768
  782    HD2  LYS  96           HD2      LYS  96   8.611   6.114  -9.065
  783    HD3  LYS  96           HD3      LYS  96   7.101   5.235  -8.708
  784    HE2  LYS  96           HE2      LYS  96   7.109   4.325 -11.060
  785    HE3  LYS  96           HE3      LYS  96   8.630   5.175 -11.357
  786    HZ1  LYS  96           HZ1      LYS  96   9.021   2.853 -10.784
  787    HZ2  LYS  96           HZ2      LYS  96   9.677   3.805  -9.631
  788    HZ3  LYS  96           HZ3      LYS  96   8.269   3.014  -9.341
  789    H    GLN  97           H        GLN  97   6.008   9.875 -11.902
  790    HA   GLN  97           HA       GLN  97   3.619   8.423 -12.783
  791    HB2  GLN  97           HB2      GLN  97   3.152  10.818 -14.118
  792    HB3  GLN  97           HB3      GLN  97   2.201  10.062 -12.873
  793    HG2  GLN  97           HG2      GLN  97   2.461  12.349 -12.295
  794    HG3  GLN  97           HG3      GLN  97   3.378  11.419 -11.134
  795   HE21  GLN  97          HE22      GLN  97   5.275  12.565 -10.609
  796   HE22  GLN  97          HE21      GLN  97   6.221  13.446 -11.809
  797    H    LYS  98           H        LYS  98   3.566   7.705 -14.775
  798    HA   LYS  98           HA       LYS  98   5.770   8.493 -16.641
  799    HB2  LYS  98           HB2      LYS  98   5.899   6.145 -16.034
  800    HB3  LYS  98           HB3      LYS  98   4.189   5.890 -16.420
  801    HG2  LYS  98           HG2      LYS  98   4.696   6.341 -18.816
  802    HG3  LYS  98           HG3      LYS  98   6.394   6.635 -18.392
  803    HD2  LYS  98           HD2      LYS  98   6.593   4.309 -17.532
  804    HD3  LYS  98           HD3      LYS  98   4.895   4.005 -17.962
  805    HE2  LYS  98           HE2      LYS  98   5.431   4.495 -20.352
  806    HE3  LYS  98           HE3      LYS  98   7.114   4.801 -19.895
  807    HZ1  LYS  98           HZ1      LYS  98   7.207   2.428 -19.148
  808    HZ2  LYS  98           HZ2      LYS  98   5.715   2.164 -19.811
  809    HZ3  LYS  98           HZ3      LYS  98   6.964   2.599 -20.747
  810    H    TRP  99           H        TRP  99   4.997   9.566 -18.471
  811    HA   TRP  99           HA       TRP  99   2.040   9.899 -18.617
  812    HB2  TRP  99           HB2      TRP  99   4.227  11.765 -19.519
  813    HB3  TRP  99           HB3      TRP  99   2.539  11.936 -19.936
  814    HD1  TRP  99           HD1      TRP  99   4.832  12.046 -16.850
  815    HE1  TRP  99           HE1      TRP  99   3.786  13.536 -15.088
  816    HE3  TRP  99           HE3      TRP  99   0.243  12.706 -18.985
  817    HZ2  TRP  99           HZ2      TRP  99   1.337  15.150 -14.818
  818    HZ3  TRP  99           HZ3      TRP  99  -1.444  14.194 -17.956
  819    HH2  TRP  99           HH2      TRP  99  -0.881  15.436 -15.888
  820    H    PHE 100           H        PHE 100   1.006   9.258 -20.389
  821    HA   PHE 100           HA       PHE 100   2.604   8.250 -22.722
  822    HB2  PHE 100           HB2      PHE 100  -0.112   7.352 -21.673
  823    HB3  PHE 100           HB3      PHE 100   0.615   6.851 -23.196
  824    HD1  PHE 100           HD2      PHE 100   1.178   6.780 -19.474
  825    HD2  PHE 100           HD1      PHE 100   2.062   5.000 -23.308
  826    HE1  PHE 100           HE2      PHE 100   2.233   4.858 -18.343
  827    HE2  PHE 100           HE1      PHE 100   3.112   3.071 -22.165
  828    HZ   PHE 100           HZ       PHE 100   3.179   2.977 -19.684
  829    H    LEU 101           H        LEU 101   2.244   9.296 -24.590
  830    HA   LEU 101           HA       LEU 101   0.304  11.513 -24.680
  831    HB2  LEU 101           HB2      LEU 101   2.734  11.729 -25.385
  832    HB3  LEU 101           HB3      LEU 101   2.379  10.658 -26.729
  833    HG   LEU 101           HG       LEU 101   2.408  12.987 -27.379
  834   HD11  LEU 101          HD11      LEU 101   0.464  13.130 -28.694
  835   HD12  LEU 101          HD12      LEU 101   0.831  11.403 -28.542
  836   HD13  LEU 101          HD13      LEU 101  -0.492  12.126 -27.592
  837   HD21  LEU 101          HD21      LEU 101   0.921  14.656 -26.560
  838   HD22  LEU 101          HD22      LEU 101  -0.077  13.467 -25.694
  839   HD23  LEU 101          HD23      LEU 101   1.557  13.854 -25.127
  840    H    LEU 102           H        LEU 102  -1.681  10.799 -25.093
  841    HA   LEU 102           HA       LEU 102  -2.062   8.518 -26.947
  842    HB2  LEU 102           HB2      LEU 102  -3.631   9.660 -24.608
  843    HB3  LEU 102           HB3      LEU 102  -4.515   8.868 -25.891
  844    HG   LEU 102           HG       LEU 102  -4.123   7.276 -24.166
  845   HD11  LEU 102          HD11      LEU 102  -3.685   6.758 -26.766
  846   HD12  LEU 102          HD12      LEU 102  -2.083   6.427 -26.194
  847   HD13  LEU 102          HD13      LEU 102  -3.414   5.498 -25.502
  848   HD21  LEU 102          HD21      LEU 102  -2.055   8.298 -23.170
  849   HD22  LEU 102          HD22      LEU 102  -1.938   6.552 -23.432
  850   HD23  LEU 102          HD23      LEU 102  -1.125   7.671 -24.542
  851    H    GLN 103           H        GLN 103  -2.846   8.888 -28.948
  852    HA   GLN 103           HA       GLN 103  -3.969  11.602 -29.495
  853    HB2  GLN 103           HB2      GLN 103  -3.316   9.253 -31.306
  854    HB3  GLN 103           HB3      GLN 103  -4.265  10.636 -31.856
  855    HG2  GLN 103           HG2      GLN 103  -1.443  10.775 -30.703
  856    HG3  GLN 103           HG3      GLN 103  -1.852  10.870 -32.415
  857   HE21  GLN 103          HE22      GLN 103  -0.376  12.912 -30.952
  858   HE22  GLN 103          HE21      GLN 103  -1.407  14.345 -30.974
  859    H    LEU 104           H        LEU 104  -6.152  11.997 -29.701
  860    HA   LEU 104           HA       LEU 104  -7.901   9.968 -28.590
  861    HB2  LEU 104           HB2      LEU 104  -8.022  12.419 -28.152
  862    HB3  LEU 104           HB3      LEU 104  -8.492  12.696 -29.820
  863    HG   LEU 104           HG       LEU 104 -10.611  11.579 -29.488
  864   HD11  LEU 104          HD11      LEU 104 -10.070   9.736 -27.977
  865   HD12  LEU 104          HD12      LEU 104  -9.652  10.882 -26.675
  866   HD13  LEU 104          HD13      LEU 104 -11.326  10.725 -27.253
  867   HD21  LEU 104          HD21      LEU 104 -11.519  13.091 -27.629
  868   HD22  LEU 104          HD22      LEU 104  -9.858  13.506 -27.228
  869   HD23  LEU 104          HD23      LEU 104 -10.510  13.904 -28.835
  870    H    VAL 105           H        VAL 105  -8.493   8.244 -29.861
  871    HA   VAL 105           HA       VAL 105  -8.537   8.554 -32.786
  872    HB   VAL 105           HB       VAL 105  -8.843   6.150 -30.954
  873   HG11  VAL 105          HG11      VAL 105 -10.166   5.657 -32.895
  874   HG12  VAL 105          HG12      VAL 105  -8.838   6.166 -33.976
  875   HG13  VAL 105          HG13      VAL 105  -8.668   4.733 -32.927
  876   HG21  VAL 105          HG21      VAL 105  -6.534   7.111 -31.107
  877   HG22  VAL 105          HG22      VAL 105  -6.671   5.491 -31.804
  878   HG23  VAL 105          HG23      VAL 105  -6.606   6.913 -32.869
  879    H    SER 106           H        SER 106 -10.817   7.937 -30.016
  880    HA   SER 106           HA       SER 106 -13.060   8.328 -31.939
  881    HB2  SER 106           HB2      SER 106 -14.503   7.679 -30.073
  882    HB3  SER 106           HB3      SER 106 -13.327   6.447 -30.547
  883    HG   SER 106           HG       SER 106 -13.222   6.499 -28.409
  884    H    GLY 107           H        GLY 107 -13.763   9.517 -28.803
  885    HA2  GLY 107           HA2      GLY 107 -13.034  12.182 -28.797
  886    HA3  GLY 107           HA3      GLY 107 -14.315  12.103 -30.003
  887    H    ASP 108           H        ASP 108 -15.133  13.652 -28.223
  888    HA   ASP 108           HA       ASP 108 -16.359  13.209 -25.892
  889    HB2  ASP 108           HB2      ASP 108 -16.675  15.220 -27.110
  890    HB3  ASP 108           HB3      ASP 108 -17.491  14.384 -28.428
  891    H    ALA 109           H        ALA 109 -17.523  11.830 -29.005
  892    HA   ALA 109           HA       ALA 109 -20.004  10.943 -28.081
  893    HB1  ALA 109           HB1      ALA 109 -20.007   9.488 -30.084
  894    HB2  ALA 109           HB2      ALA 109 -19.404  11.112 -30.465
  895    HB3  ALA 109           HB3      ALA 109 -18.266   9.749 -30.286
  896    H    GLU 110           H        GLU 110 -16.826   9.486 -27.590
  897    HA   GLU 110           HA       GLU 110 -18.049   7.051 -26.450
  898    HB2  GLU 110           HB2      GLU 110 -15.315   7.592 -27.628
  899    HB3  GLU 110           HB3      GLU 110 -15.656   6.166 -26.654
  900    HG2  GLU 110           HG2      GLU 110 -17.096   6.887 -29.246
  901    HG3  GLU 110           HG3      GLU 110 -15.801   5.712 -29.093
  902    H    ILE 111           H        ILE 111 -16.204   9.959 -25.718
  903    HA   ILE 111           HA       ILE 111 -15.065   9.162 -23.235
  904    HB   ILE 111           HB       ILE 111 -15.911  11.791 -24.444
  905   HG12  ILE 111          HG12      ILE 111 -13.274  10.591 -23.634
  906   HG13  ILE 111          HG13      ILE 111 -13.898  10.840 -25.271
  907   HG21  ILE 111          HG21      ILE 111 -15.094  13.048 -22.508
  908   HG22  ILE 111          HG22      ILE 111 -16.443  12.055 -22.025
  909   HG23  ILE 111          HG23      ILE 111 -14.778  11.539 -21.628
  910   HD11  ILE 111          HD11      ILE 111 -12.276  12.515 -24.899
  911   HD12  ILE 111          HD12      ILE 111 -13.865  13.312 -24.828
  912   HD13  ILE 111          HD13      ILE 111 -12.964  12.954 -23.329
  913    H    ASN 112           H        ASN 112 -15.915   8.820 -21.260
  914    HA   ASN 112           HA       ASN 112 -18.672   9.646 -20.679
  915    HB2  ASN 112           HB2      ASN 112 -19.068   7.413 -21.623
  916    HB3  ASN 112           HB3      ASN 112 -17.924   6.716 -20.454
  917   HD21  ASN 112          HD22      ASN 112 -20.085   5.458 -19.879
  918   HD22  ASN 112          HD21      ASN 112 -21.072   6.246 -18.659
  919    H    MET 113           H        MET 113 -17.286  11.018 -19.492
  920    HA   MET 113           HA       MET 113 -15.835  10.243 -17.175
  921    HB2  MET 113           HB2      MET 113 -17.328  12.827 -17.830
  922    HB3  MET 113           HB3      MET 113 -16.132  12.646 -16.541
  923    HG2  MET 113           HG2      MET 113 -14.383  12.161 -18.096
  924    HG3  MET 113           HG3      MET 113 -15.503  12.120 -19.458
  925    HE1  MET 113           HE1      MET 113 -12.707  13.855 -19.017
  926    HE2  MET 113           HE2      MET 113 -13.571  13.669 -20.568
  927    HE3  MET 113           HE3      MET 113 -13.173  15.291 -19.958
  928    H    GLN 114           H        GLN 114 -18.856   9.134 -17.484
  929    HA   GLN 114           HA       GLN 114 -19.428   9.503 -14.624
  930    HB2  GLN 114           HB2      GLN 114 -21.567   9.665 -16.801
  931    HB3  GLN 114           HB3      GLN 114 -21.832   9.740 -15.053
  932    HG2  GLN 114           HG2      GLN 114 -20.397  11.841 -15.015
  933    HG3  GLN 114           HG3      GLN 114 -20.399  11.801 -16.786
  934   HE21  GLN 114          HE22      GLN 114 -22.546  11.959 -13.919
  935   HE22  GLN 114          HE21      GLN 114 -23.852  12.807 -14.725
  936    H    THR 115           H        THR 115 -18.160   7.481 -16.369
  937    HA   THR 115           HA       THR 115 -19.922   5.198 -16.391
  938    HB   THR 115           HB       THR 115 -18.061   5.686 -17.989
  939    HG1  THR 115           HG1      THR 115 -18.814   3.576 -17.907
  940   HG21  THR 115          HG21      THR 115 -15.765   5.116 -17.425
  941   HG22  THR 115          HG22      THR 115 -16.333   6.509 -16.496
  942   HG23  THR 115          HG23      THR 115 -16.188   4.906 -15.727
  943    H    SER 116           H        SER 116 -17.612   6.602 -14.129
  944    HA   SER 116           HA       SER 116 -17.243   4.227 -12.559
  945    HB2  SER 116           HB2      SER 116 -15.872   6.181 -11.344
  946    HB3  SER 116           HB3      SER 116 -15.329   5.362 -12.836
  947    HG   SER 116           HG       SER 116 -15.110   7.500 -13.238
  948    H    SER 117           H        SER 117 -19.607   6.528 -12.497
  949    HA   SER 117           HA       SER 117 -21.354   7.049 -11.191
  950    HB2  SER 117           HB2      SER 117 -20.444   4.916  -9.244
  951    HB3  SER 117           HB3      SER 117 -22.054   5.639  -9.377
  952    HG   SER 117           HG       SER 117 -21.922   3.596 -10.455
  953    H    THR 118           H        THR 118 -18.302   6.833  -9.373
  954    HA   THR 118           HA       THR 118 -18.854   9.527  -8.238
  955    HB   THR 118           HB       THR 118 -17.260   8.783  -6.393
  956    HG1  THR 118           HG1      THR 118 -16.516   6.822  -7.226
  957   HG21  THR 118          HG21      THR 118 -19.973   7.390  -6.550
  958   HG22  THR 118          HG22      THR 118 -19.055   7.755  -5.071
  959   HG23  THR 118          HG23      THR 118 -19.701   9.078  -6.061
  960    HA   PRO 119           HA       PRO 119 -15.519   9.143 -11.436
  961    HB2  PRO 119           HB2      PRO 119 -16.245  11.135 -13.136
  962    HB3  PRO 119           HB3      PRO 119 -17.160   9.611 -13.030
  963    HG2  PRO 119           HG2      PRO 119 -17.765  12.217 -11.581
  964    HG3  PRO 119           HG3      PRO 119 -18.857  11.276 -12.656
  965    HD2  PRO 119           HD2      PRO 119 -18.925  10.897  -9.982
  966    HD3  PRO 119           HD3      PRO 119 -19.029   9.516 -11.114
  967    H    GLU 120           H        GLU 120 -14.261  11.267 -12.547
  968    HA   GLU 120           HA       GLU 120 -13.487  13.135 -10.340
  969    HB2  GLU 120           HB2      GLU 120 -11.875  11.643 -12.410
  970    HB3  GLU 120           HB3      GLU 120 -11.272  13.154 -11.754
  971    HG2  GLU 120           HG2      GLU 120 -12.306  10.957  -9.904
  972    HG3  GLU 120           HG3      GLU 120 -10.658  10.875 -10.537
  973    H    PHE 121           H        PHE 121 -14.975  12.974 -13.494
  974    HA   PHE 121           HA       PHE 121 -14.241  15.825 -13.898
  975    HB2  PHE 121           HB2      PHE 121 -13.956  13.566 -15.884
  976    HB3  PHE 121           HB3      PHE 121 -13.985  15.277 -16.323
  977    HD1  PHE 121           HD2      PHE 121 -12.308  16.862 -15.338
  978    HD2  PHE 121           HD1      PHE 121 -11.892  12.597 -14.961
  979    HE1  PHE 121           HE2      PHE 121  -9.918  17.146 -14.867
  980    HE2  PHE 121           HE1      PHE 121  -9.480  12.890 -14.443
  981    HZ   PHE 121           HZ       PHE 121  -8.478  15.156 -14.408
  982    H    ASP 122           H        ASP 122 -15.586  17.064 -15.098
  983    HA   ASP 122           HA       ASP 122 -18.452  16.217 -15.095
  984    HB2  ASP 122           HB2      ASP 122 -18.021  17.909 -13.484
  985    HB3  ASP 122           HB3      ASP 122 -17.011  18.834 -14.597
  986    H    GLY 123           H        GLY 123 -15.908  17.868 -17.053
  987    HA2  GLY 123           HA2      GLY 123 -17.164  17.166 -19.517
  988    HA3  GLY 123           HA3      GLY 123 -17.437  18.883 -19.159
  989    H    TRP 124           H        TRP 124 -15.927  17.744 -21.310
  990    HA   TRP 124           HA       TRP 124 -13.103  18.359 -20.711
  991    HB2  TRP 124           HB2      TRP 124 -12.745  17.457 -22.970
  992    HB3  TRP 124           HB3      TRP 124 -13.520  16.295 -21.910
  993    HD1  TRP 124           HD1      TRP 124 -15.934  15.460 -22.556
  994    HE1  TRP 124           HE1      TRP 124 -17.471  15.765 -24.585
  995    HE3  TRP 124           HE3      TRP 124 -13.331  19.115 -25.026
  996    HZ2  TRP 124           HZ2      TRP 124 -17.691  17.552 -26.834
  997    HZ3  TRP 124           HZ3      TRP 124 -14.248  20.129 -27.095
  998    HH2  TRP 124           HH2      TRP 124 -16.430  19.361 -28.007
  999    H    ARG 125           H        ARG 125 -11.932  19.699 -22.147
 1000    HA   ARG 125           HA       ARG 125 -13.291  21.366 -24.149
 1001    HB2  ARG 125           HB2      ARG 125 -13.510  22.639 -22.004
 1002    HB3  ARG 125           HB3      ARG 125 -11.750  22.602 -21.817
 1003    HG2  ARG 125           HG2      ARG 125 -11.494  23.988 -23.842
 1004    HG3  ARG 125           HG3      ARG 125 -13.223  23.879 -24.166
 1005    HD2  ARG 125           HD2      ARG 125 -12.616  26.043 -23.158
 1006    HD3  ARG 125           HD3      ARG 125 -13.776  25.151 -22.189
 1007    HE   ARG 125           HE       ARG 125 -11.913  24.455 -20.702
 1008   HH11  ARG 125          HH21      ARG 125 -11.519  27.463 -22.565
 1009   HH12  ARG 125          HH22      ARG 125 -10.513  28.216 -21.384
 1010   HH21  ARG 125          HH11      ARG 125 -10.723  25.541 -19.066
 1011   HH22  ARG 125          HH12      ARG 125  -9.983  27.071 -19.406
 1012    H    TRP 126           H        TRP 126 -11.845  21.073 -25.990
 1013    HA   TRP 126           HA       TRP 126  -9.135  20.165 -25.414
 1014    HB2  TRP 126           HB2      TRP 126 -10.421  20.734 -28.093
 1015    HB3  TRP 126           HB3      TRP 126  -8.979  19.780 -27.776
 1016    HD1  TRP 126           HD1      TRP 126 -12.065  19.070 -29.044
 1017    HE1  TRP 126           HE1      TRP 126 -13.265  16.985 -28.219
 1018    HE3  TRP 126           HE3      TRP 126  -9.275  18.134 -24.837
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.176  15.222 -25.912
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.953  16.343 -23.295
 1021    HH2  TRP 126           HH2      TRP 126 -11.916  14.928 -23.774
 1022    H    VAL 127           H        VAL 127  -8.667  22.079 -24.174
 1023    HA   VAL 127           HA       VAL 127  -8.428  24.679 -25.318
 1024    HB   VAL 127           HB       VAL 127  -7.067  25.138 -23.302
 1025   HG11  VAL 127          HG11      VAL 127  -9.548  25.143 -23.198
 1026   HG12  VAL 127          HG12      VAL 127  -9.502  23.462 -22.585
 1027   HG13  VAL 127          HG13      VAL 127  -8.768  24.775 -21.655
 1028   HG21  VAL 127          HG21      VAL 127  -6.831  23.306 -21.591
 1029   HG22  VAL 127          HG22      VAL 127  -7.262  22.131 -22.834
 1030   HG23  VAL 127          HG23      VAL 127  -5.791  23.100 -23.018
 1031    H    SER 128           H        SER 128  -6.467  25.859 -25.816
 1032    HA   SER 128           HA       SER 128  -4.853  24.717 -27.712
 1033    HB2  SER 128           HB2      SER 128  -4.002  26.987 -25.881
 1034    HB3  SER 128           HB3      SER 128  -3.480  26.698 -27.547
 1035    HG   SER 128           HG       SER 128  -5.144  28.309 -27.445
 1036    H    TYR 129           H        TYR 129  -2.600  24.180 -27.797
 1037    HA   TYR 129           HA       TYR 129  -1.569  22.580 -25.674
 1038    HB2  TYR 129           HB2      TYR 129  -1.045  22.767 -28.280
 1039    HB3  TYR 129           HB3      TYR 129   0.184  23.908 -27.744
 1040    HD1  TYR 129           HD2      TYR 129   1.946  23.045 -26.078
 1041    HD2  TYR 129           HD1      TYR 129  -0.792  20.428 -28.120
 1042    HE1  TYR 129           HE2      TYR 129   3.392  21.129 -25.519
 1043    HE2  TYR 129           HE1      TYR 129   0.573  18.482 -27.427
 1044    HH   TYR 129           HH       TYR 129   3.632  18.816 -25.606
 1045    H    TRP 130           H        TRP 130   0.230  23.138 -24.259
 1046    HA   TRP 130           HA       TRP 130   1.275  24.317 -22.694
 1047    HB2  TRP 130           HB2      TRP 130   0.921  26.910 -24.179
 1048    HB3  TRP 130           HB3      TRP 130   2.168  26.453 -23.031
 1049    HD1  TRP 130           HD1      TRP 130   1.342  26.457 -26.658
 1050    HE1  TRP 130           HE1      TRP 130   3.023  25.190 -28.046
 1051    HE3  TRP 130           HE3      TRP 130   4.026  24.403 -22.839
 1052    HZ2  TRP 130           HZ2      TRP 130   5.466  23.571 -27.536
 1053    HZ3  TRP 130           HZ3      TRP 130   5.995  22.960 -23.299
 1054    HH2  TRP 130           HH2      TRP 130   6.694  22.526 -25.624
 1055    H    TYR 131           H        TYR 131  -1.916  25.661 -23.600
 1056    HA   TYR 131           HA       TYR 131  -2.171  27.531 -21.573
 1057    HB2  TYR 131           HB2      TYR 131  -3.783  27.493 -23.257
 1058    HB3  TYR 131           HB3      TYR 131  -4.234  25.834 -22.961
 1059    HD1  TYR 131           HD2      TYR 131  -5.649  25.190 -21.045
 1060    HD2  TYR 131           HD1      TYR 131  -4.762  29.320 -21.911
 1061    HE1  TYR 131           HE2      TYR 131  -7.585  25.877 -19.685
 1062    HE2  TYR 131           HE1      TYR 131  -6.708  30.023 -20.551
 1063    HH   TYR 131           HH       TYR 131  -8.522  29.321 -19.232
 1064    HA   PRO 132           HA       PRO 132  -3.776  24.338 -18.412
 1065    HB2  PRO 132           HB2      PRO 132  -2.392  21.823 -19.284
 1066    HB3  PRO 132           HB3      PRO 132  -3.946  22.018 -18.421
 1067    HG2  PRO 132           HG2      PRO 132  -3.940  21.494 -21.052
 1068    HG3  PRO 132           HG3      PRO 132  -5.029  22.764 -20.404
 1069    HD2  PRO 132           HD2      PRO 132  -2.309  23.143 -21.726
 1070    HD3  PRO 132           HD3      PRO 132  -3.835  23.988 -22.054
 1071    H    VAL 133           H        VAL 133  -0.456  24.551 -19.598
 1072    HA   VAL 133           HA       VAL 133   0.919  23.430 -17.372
 1073    HB   VAL 133           HB       VAL 133   1.692  25.659 -19.301
 1074   HG11  VAL 133          HG11      VAL 133   3.132  25.844 -17.373
 1075   HG12  VAL 133          HG12      VAL 133   3.466  24.085 -17.399
 1076   HG13  VAL 133          HG13      VAL 133   4.019  25.163 -18.714
 1077   HG21  VAL 133          HG21      VAL 133   1.278  23.462 -20.408
 1078   HG22  VAL 133          HG22      VAL 133   2.990  23.881 -20.460
 1079   HG23  VAL 133          HG23      VAL 133   2.406  22.684 -19.279
 1080    H    ARG 134           H        ARG 134  -0.531  26.712 -17.878
 1081    HA   ARG 134           HA       ARG 134   0.355  27.350 -15.126
 1082    HB2  ARG 134           HB2      ARG 134   0.687  29.038 -16.884
 1083    HB3  ARG 134           HB3      ARG 134  -1.051  29.107 -17.157
 1084    HG2  ARG 134           HG2      ARG 134  -0.267  31.000 -15.860
 1085    HG3  ARG 134           HG3      ARG 134  -1.418  30.063 -14.935
 1086    HD2  ARG 134           HD2      ARG 134   1.613  29.874 -14.559
 1087    HD3  ARG 134           HD3      ARG 134   0.567  31.001 -13.688
 1088    HE   ARG 134           HE       ARG 134  -0.385  28.283 -13.451
 1089   HH11  ARG 134          HH11      ARG 134   1.825  30.614 -11.921
 1090   HH12  ARG 134          HH12      ARG 134   1.735  29.834 -10.376
 1091   HH21  ARG 134          HH21      ARG 134  -0.426  27.226 -11.476
 1092   HH22  ARG 134          HH22      ARG 134   0.465  27.901 -10.125
 1093    H    GLN 135           H        GLN 135  -2.541  26.065 -16.727
 1094    HA   GLN 135           HA       GLN 135  -4.278  27.165 -14.655
 1095    HB2  GLN 135           HB2      GLN 135  -4.834  24.879 -16.568
 1096    HB3  GLN 135           HB3      GLN 135  -5.996  25.672 -15.510
 1097    HG2  GLN 135           HG2      GLN 135  -4.600  26.883 -17.917
 1098    HG3  GLN 135           HG3      GLN 135  -6.309  26.552 -17.683
 1099   HE21  GLN 135          HE22      GLN 135  -7.561  27.960 -16.174
 1100   HE22  GLN 135          HE21      GLN 135  -6.954  29.546 -15.780
 1101    H    VAL 136           H        VAL 136  -2.134  24.340 -14.787
 1102    HA   VAL 136           HA       VAL 136  -3.374  23.103 -12.491
 1103    HB   VAL 136           HB       VAL 136  -1.316  21.843 -12.342
 1104   HG11  VAL 136          HG11      VAL 136  -2.966  20.868 -13.660
 1105   HG12  VAL 136          HG12      VAL 136  -2.575  21.889 -15.082
 1106   HG13  VAL 136          HG13      VAL 136  -1.450  20.645 -14.510
 1107   HG21  VAL 136          HG21      VAL 136   0.287  23.590 -13.194
 1108   HG22  VAL 136          HG22      VAL 136   0.494  21.990 -13.928
 1109   HG23  VAL 136          HG23      VAL 136  -0.332  23.277 -14.822
 1110    H    VAL 137           H        VAL 137  -2.300  22.920 -10.378
 1111    HA   VAL 137           HA       VAL 137  -1.608  25.414  -9.162
 1112    HB   VAL 137           HB       VAL 137  -1.011  23.952  -7.200
 1113   HG11  VAL 137          HG11      VAL 137  -3.725  23.367  -8.473
 1114   HG12  VAL 137          HG12      VAL 137  -3.310  23.255  -6.752
 1115   HG13  VAL 137          HG13      VAL 137  -3.298  24.829  -7.556
 1116   HG21  VAL 137          HG21      VAL 137  -1.585  21.559  -7.272
 1117   HG22  VAL 137          HG22      VAL 137  -1.884  21.639  -9.004
 1118   HG23  VAL 137          HG23      VAL 137  -0.245  21.923  -8.367
 1119    H    SER 138           H        SER 138   0.411  26.088  -8.242
 1120    HA   SER 138           HA       SER 138   2.355  26.179 -10.212
 1121    HB2  SER 138           HB2      SER 138   2.592  26.880  -7.263
 1122    HB3  SER 138           HB3      SER 138   3.568  27.555  -8.589
 1123    HG   SER 138           HG       SER 138   1.638  28.808  -7.895
 1124    H    PHE 139           H        PHE 139   2.293  23.886  -7.428
 1125    HA   PHE 139           HA       PHE 139   5.062  23.144  -7.885
 1126    HB2  PHE 139           HB2      PHE 139   4.707  21.358  -6.338
 1127    HB3  PHE 139           HB3      PHE 139   4.057  22.855  -5.711
 1128    HD1  PHE 139           HD1      PHE 139   3.254  19.464  -6.922
 1129    HD2  PHE 139           HD2      PHE 139   1.640  23.137  -5.321
 1130    HE1  PHE 139           HE1      PHE 139   1.123  18.313  -6.408
 1131    HE2  PHE 139           HE2      PHE 139  -0.492  21.981  -4.833
 1132    HZ   PHE 139           HZ       PHE 139  -0.768  19.575  -5.386
 1133    H    LYS 140           H        LYS 140   2.012  22.179  -9.374
 1134    HA   LYS 140           HA       LYS 140   3.275  19.902 -10.782
 1135    HB2  LYS 140           HB2      LYS 140   0.476  21.087 -11.003
 1136    HB3  LYS 140           HB3      LYS 140   1.072  19.671 -11.886
 1137    HG2  LYS 140           HG2      LYS 140   1.570  18.549  -9.692
 1138    HG3  LYS 140           HG3      LYS 140   0.825  19.924  -8.866
 1139    HD2  LYS 140           HD2      LYS 140  -1.321  19.455 -10.114
 1140    HD3  LYS 140           HD3      LYS 140  -0.550  18.016 -10.804
 1141    HE2  LYS 140           HE2      LYS 140  -0.126  17.176  -8.458
 1142    HE3  LYS 140           HE3      LYS 140  -1.032  18.566  -7.841
 1143    HZ1  LYS 140           HZ1      LYS 140  -2.984  17.702  -9.099
 1144    HZ2  LYS 140           HZ2      LYS 140  -2.125  16.365  -9.543
 1145    HZ3  LYS 140           HZ3      LYS 140  -2.460  16.641  -7.972
 1146    H    ARG 141           H        ARG 141   2.469  23.309 -11.430
 1147    HA   ARG 141           HA       ARG 141   2.498  23.406 -14.175
 1148    HB2  ARG 141           HB2      ARG 141   2.142  25.444 -12.957
 1149    HB3  ARG 141           HB3      ARG 141   3.731  25.340 -12.174
 1150    HG2  ARG 141           HG2      ARG 141   4.891  25.858 -14.244
 1151    HG3  ARG 141           HG3      ARG 141   3.392  25.720 -15.159
 1152    HD2  ARG 141           HD2      ARG 141   3.826  28.055 -14.913
 1153    HD3  ARG 141           HD3      ARG 141   2.479  27.665 -13.864
 1154    HE   ARG 141           HE       ARG 141   3.782  28.054 -11.969
 1155   HH11  ARG 141          HH11      ARG 141   5.874  28.270 -14.853
 1156   HH12  ARG 141          HH12      ARG 141   7.189  28.983 -13.998
 1157   HH21  ARG 141          HH21      ARG 141   5.546  29.026 -10.852
 1158   HH22  ARG 141          HH22      ARG 141   6.996  29.420 -11.695
 1159    H    ASP 142           H        ASP 142   5.547  23.424 -12.253
 1160    HA   ASP 142           HA       ASP 142   7.188  23.871 -14.531
 1161    HB2  ASP 142           HB2      ASP 142   8.009  24.273 -12.270
 1162    HB3  ASP 142           HB3      ASP 142   7.890  22.555 -11.878
 1163    H    VAL 143           H        VAL 143   6.204  20.811 -12.951
 1164    HA   VAL 143           HA       VAL 143   7.784  19.257 -14.801
 1165    HB   VAL 143           HB       VAL 143   7.479  18.489 -12.546
 1166   HG11  VAL 143          HG11      VAL 143   4.485  18.266 -13.101
 1167   HG12  VAL 143          HG12      VAL 143   5.335  17.702 -11.655
 1168   HG13  VAL 143          HG13      VAL 143   5.291  19.406 -11.989
 1169   HG21  VAL 143          HG21      VAL 143   7.779  16.766 -14.296
 1170   HG22  VAL 143          HG22      VAL 143   6.873  16.166 -12.903
 1171   HG23  VAL 143          HG23      VAL 143   6.015  16.572 -14.405
 1172    H    TYR 144           H        TYR 144   4.362  20.323 -14.653
 1173    HA   TYR 144           HA       TYR 144   3.592  18.674 -16.815
 1174    HB2  TYR 144           HB2      TYR 144   2.141  19.938 -15.130
 1175    HB3  TYR 144           HB3      TYR 144   2.358  21.357 -16.130
 1176    HD1  TYR 144           HD2      TYR 144   1.961  17.936 -17.768
 1177    HD2  TYR 144           HD1      TYR 144  -0.073  21.500 -16.354
 1178    HE1  TYR 144           HE2      TYR 144  -0.110  17.131 -18.725
 1179    HE2  TYR 144           HE1      TYR 144  -2.171  20.671 -17.341
 1180    HH   TYR 144           HH       TYR 144  -2.388  17.576 -19.159
 1181    H    ARG 145           H        ARG 145   5.113  21.962 -16.773
 1182    HA   ARG 145           HA       ARG 145   5.065  22.451 -19.519
 1183    HB2  ARG 145           HB2      ARG 145   6.001  23.759 -17.394
 1184    HB3  ARG 145           HB3      ARG 145   7.530  22.998 -17.796
 1185    HG2  ARG 145           HG2      ARG 145   5.846  24.539 -19.781
 1186    HG3  ARG 145           HG3      ARG 145   6.974  25.334 -18.689
 1187    HD2  ARG 145           HD2      ARG 145   7.760  23.285 -20.813
 1188    HD3  ARG 145           HD3      ARG 145   7.902  25.012 -20.993
 1189    HE   ARG 145           HE       ARG 145   9.607  23.217 -19.426
 1190   HH11  ARG 145          HH21      ARG 145   8.779  26.635 -20.006
 1191   HH12  ARG 145          HH22      ARG 145  10.261  27.240 -19.363
 1192   HH21  ARG 145          HH11      ARG 145  11.567  24.040 -18.552
 1193   HH22  ARG 145          HH12      ARG 145  11.875  25.734 -18.528
 1194    H    ARG 146           H        ARG 146   7.248  20.206 -17.673
 1195    HA   ARG 146           HA       ARG 146   8.840  19.887 -20.113
 1196    HB2  ARG 146           HB2      ARG 146  10.352  18.545 -19.013
 1197    HB3  ARG 146           HB3      ARG 146   9.928  19.858 -17.934
 1198    HG2  ARG 146           HG2      ARG 146   8.498  18.233 -16.626
 1199    HG3  ARG 146           HG3      ARG 146   9.041  16.948 -17.705
 1200    HD2  ARG 146           HD2      ARG 146  10.403  16.839 -15.758
 1201    HD3  ARG 146           HD3      ARG 146  11.416  17.537 -17.035
 1202    HE   ARG 146           HE       ARG 146  10.122  19.614 -15.496
 1203   HH11  ARG 146          HH21      ARG 146  12.862  17.350 -15.365
 1204   HH12  ARG 146          HH22      ARG 146  13.717  18.245 -14.164
 1205   HH21  ARG 146          HH11      ARG 146  11.207  20.743 -13.777
 1206   HH22  ARG 146          HH12      ARG 146  12.788  20.230 -13.303
 1207    H    VAL 147           H        VAL 147   6.223  18.062 -18.539
 1208    HA   VAL 147           HA       VAL 147   6.097  15.877 -20.363
 1209    HB   VAL 147           HB       VAL 147   3.907  17.424 -18.905
 1210   HG11  VAL 147          HG11      VAL 147   2.453  15.469 -19.191
 1211   HG12  VAL 147          HG12      VAL 147   2.850  16.181 -20.757
 1212   HG13  VAL 147          HG13      VAL 147   3.676  14.698 -20.223
 1213   HG21  VAL 147          HG21      VAL 147   3.953  15.625 -17.298
 1214   HG22  VAL 147          HG22      VAL 147   5.150  14.734 -18.262
 1215   HG23  VAL 147          HG23      VAL 147   5.596  16.243 -17.439
 1216    H    MET 148           H        MET 148   4.628  19.210 -20.619
 1217    HA   MET 148           HA       MET 148   3.506  18.708 -23.168
 1218    HB2  MET 148           HB2      MET 148   4.227  21.331 -21.801
 1219    HB3  MET 148           HB3      MET 148   3.335  21.216 -23.313
 1220    HG2  MET 148           HG2      MET 148   2.016  19.407 -21.597
 1221    HG3  MET 148           HG3      MET 148   2.389  20.792 -20.591
 1222    HE1  MET 148           HE1      MET 148  -1.358  21.254 -21.232
 1223    HE2  MET 148           HE2      MET 148  -0.377  19.844 -20.799
 1224    HE3  MET 148           HE3      MET 148  -0.066  21.420 -20.030
 1225    H    LYS 149           H        LYS 149   6.702  20.156 -22.287
 1226    HA   LYS 149           HA       LYS 149   7.603  20.785 -24.879
 1227    HB2  LYS 149           HB2      LYS 149   8.731  21.488 -22.845
 1228    HB3  LYS 149           HB3      LYS 149   9.144  19.829 -22.429
 1229    HG2  LYS 149           HG2      LYS 149  10.100  20.958 -25.065
 1230    HG3  LYS 149           HG3      LYS 149  10.871  21.503 -23.588
 1231    HD2  LYS 149           HD2      LYS 149  10.727  18.553 -24.391
 1232    HD3  LYS 149           HD3      LYS 149  12.059  19.644 -24.747
 1233    HE2  LYS 149           HE2      LYS 149  12.343  20.068 -22.285
 1234    HE3  LYS 149           HE3      LYS 149  11.078  18.872 -21.958
 1235    HZ1  LYS 149           HZ1      LYS 149  12.471  17.197 -23.088
 1236    HZ2  LYS 149           HZ2      LYS 149  13.659  18.320 -23.321
 1237    HZ3  LYS 149           HZ3      LYS 149  13.261  17.863 -21.806
 1238    H    GLU 150           H        GLU 150   7.789  17.661 -23.150
 1239    HA   GLU 150           HA       GLU 150   9.436  16.372 -25.059
 1240    HB2  GLU 150           HB2      GLU 150   7.461  15.366 -22.975
 1241    HB3  GLU 150           HB3      GLU 150   8.331  14.245 -24.014
 1242    HG2  GLU 150           HG2      GLU 150   9.716  16.325 -22.269
 1243    HG3  GLU 150           HG3      GLU 150   9.411  14.659 -21.774
 1244    H    PHE 151           H        PHE 151   5.956  16.963 -25.153
 1245    HA   PHE 151           HA       PHE 151   5.706  15.086 -27.457
 1246    HB2  PHE 151           HB2      PHE 151   3.579  16.111 -25.568
 1247    HB3  PHE 151           HB3      PHE 151   3.374  14.927 -26.840
 1248    HD1  PHE 151           HD2      PHE 151   5.709  13.092 -26.475
 1249    HD2  PHE 151           HD1      PHE 151   3.206  15.024 -23.537
 1250    HE1  PHE 151           HE2      PHE 151   6.191  11.283 -24.867
 1251    HE2  PHE 151           HE1      PHE 151   3.650  13.163 -21.955
 1252    HZ   PHE 151           HZ       PHE 151   5.122  11.288 -22.618
 1253    H    ALA 152           H        ALA 152   5.935  18.435 -27.024
 1254    HA   ALA 152           HA       ALA 152   3.737  19.404 -28.420
 1255    HB1  ALA 152           HB1      ALA 152   6.575  20.531 -28.411
 1256    HB2  ALA 152           HB2      ALA 152   5.089  21.421 -28.830
 1257    HB3  ALA 152           HB3      ALA 152   5.327  20.819 -27.177
 1258    H    SER 153           H        SER 153   6.971  18.664 -29.905
 1259    HA   SER 153           HA       SER 153   6.135  19.121 -32.548
 1260    HB2  SER 153           HB2      SER 153   8.255  17.127 -31.649
 1261    HB3  SER 153           HB3      SER 153   8.192  18.034 -33.173
 1262    HG   SER 153           HG       SER 153   9.643  18.998 -31.658
 1263    H    VAL 154           H        VAL 154   5.383  16.407 -30.458
 1264    HA   VAL 154           HA       VAL 154   5.117  14.431 -32.617
 1265    HB   VAL 154           HB       VAL 154   4.266  14.325 -29.685
 1266   HG11  VAL 154          HG11      VAL 154   4.663  12.067 -31.690
 1267   HG12  VAL 154          HG12      VAL 154   4.244  11.887 -29.971
 1268   HG13  VAL 154          HG13      VAL 154   3.095  12.647 -31.076
 1269   HG21  VAL 154          HG21      VAL 154   6.705  14.618 -29.805
 1270   HG22  VAL 154          HG22      VAL 154   6.317  12.970 -29.327
 1271   HG23  VAL 154          HG23      VAL 154   6.827  13.305 -30.995
 1272    H    VAL 155           H        VAL 155   3.078  16.513 -30.552
 1273    HA   VAL 155           HA       VAL 155   0.595  15.641 -31.791
 1274    HB   VAL 155           HB       VAL 155   1.409  17.912 -29.899
 1275   HG11  VAL 155          HG11      VAL 155  -0.617  18.627 -30.955
 1276   HG12  VAL 155          HG12      VAL 155  -1.378  17.021 -30.750
 1277   HG13  VAL 155          HG13      VAL 155  -1.035  18.048 -29.339
 1278   HG21  VAL 155          HG21      VAL 155   1.669  15.577 -28.996
 1279   HG22  VAL 155          HG22      VAL 155   0.435  16.492 -28.161
 1280   HG23  VAL 155          HG23      VAL 155  -0.051  15.287 -29.352
 1281    H    MET 156           H        MET 156   2.731  18.545 -32.139
 1282    HA   MET 156           HA       MET 156   0.917  19.709 -34.063
 1283    HB2  MET 156           HB2      MET 156   3.862  20.247 -33.488
 1284    HB3  MET 156           HB3      MET 156   2.846  21.240 -34.542
 1285    HG2  MET 156           HG2      MET 156   2.363  20.777 -31.573
 1286    HG3  MET 156           HG3      MET 156   3.023  22.233 -32.299
 1287    HE1  MET 156           HE1      MET 156  -0.597  23.104 -30.854
 1288    HE2  MET 156           HE2      MET 156   0.436  21.795 -30.245
 1289    HE3  MET 156           HE3      MET 156   1.149  23.376 -30.662
 1290    H    SER 157           H        SER 157   3.226  17.126 -34.440
 1291    HA   SER 157           HA       SER 157   3.870  17.302 -37.184
 1292    HB2  SER 157           HB2      SER 157   3.049  14.934 -35.460
 1293    HB3  SER 157           HB3      SER 157   3.640  14.762 -37.107
 1294    HG   SER 157           HG       SER 157   5.129  15.978 -34.974
 1295    H    LEU 158           H        LEU 158   0.852  16.344 -35.554
 1296    HA   LEU 158           HA       LEU 158  -0.399  15.214 -37.897
 1297    HB2  LEU 158           HB2      LEU 158  -1.450  16.240 -35.238
 1298    HB3  LEU 158           HB3      LEU 158  -2.519  15.699 -36.526
 1299    HG   LEU 158           HG       LEU 158  -1.449  13.457 -36.479
 1300   HD11  LEU 158          HD11      LEU 158  -0.036  14.478 -33.982
 1301   HD12  LEU 158          HD12      LEU 158  -0.186  12.770 -34.449
 1302   HD13  LEU 158          HD13      LEU 158   0.729  13.871 -35.471
 1303   HD21  LEU 158          HD21      LEU 158  -2.627  14.428 -33.841
 1304   HD22  LEU 158          HD22      LEU 158  -3.552  13.971 -35.292
 1305   HD23  LEU 158          HD23      LEU 158  -2.606  12.746 -34.434
 1306    H    GLN 159           H        GLN 159  -0.080  18.487 -36.593
 1307    HA   GLN 159           HA       GLN 159  -2.023  19.578 -38.531
 1308    HB2  GLN 159           HB2      GLN 159  -0.583  20.705 -36.110
 1309    HB3  GLN 159           HB3      GLN 159  -1.426  21.748 -37.250
 1310    HG2  GLN 159           HG2      GLN 159  -2.785  21.118 -35.298
 1311    HG3  GLN 159           HG3      GLN 159  -3.535  20.695 -36.843
 1312   HE21  GLN 159          HE22      GLN 159  -4.221  18.485 -37.112
 1313   HE22  GLN 159          HE21      GLN 159  -3.902  17.287 -35.865
 1314    H    GLU 160           H        GLU 160   1.459  19.300 -38.184
 1315    HA   GLU 160           HA       GLU 160   2.213  21.213 -40.169
 1316    HB2  GLU 160           HB2      GLU 160   3.699  20.109 -38.480
 1317    HB3  GLU 160           HB3      GLU 160   3.549  18.588 -39.369
 1318    HG2  GLU 160           HG2      GLU 160   4.637  19.601 -41.336
 1319    HG3  GLU 160           HG3      GLU 160   4.663  21.176 -40.533
 1320    H    ASN 161           H        ASN 161   0.447  18.274 -40.388
 1321    HA   ASN 161           HA       ASN 161   0.884  17.913 -43.302
 1322    HB2  ASN 161           HB2      ASN 161   1.032  15.830 -41.940
 1323    HB3  ASN 161           HB3      ASN 161  -0.539  16.189 -41.219
 1324   HD21  ASN 161          HD22      ASN 161  -1.009  13.954 -42.111
 1325   HD22  ASN 161          HD21      ASN 161  -1.537  13.836 -43.774
 1326    H    THR 162           H        THR 162   0.013  20.015 -43.517
 1327    HA   THR 162           HA       THR 162  -1.952  21.185 -42.165
 1328    HB   THR 162           HB       THR 162  -2.188  22.639 -44.346
 1329    HG1  THR 162           HG1      THR 162  -0.551  22.283 -45.814
 1330   HG21  THR 162          HG21      THR 162  -0.028  23.705 -43.818
 1331   HG22  THR 162          HG22      THR 162  -0.886  23.259 -42.339
 1332   HG23  THR 162          HG23      THR 162   0.478  22.270 -42.895
 1333    HA   PRO 163           HA       PRO 163  -5.616  19.678 -44.837
 1334    HB2  PRO 163           HB2      PRO 163  -4.680  16.798 -44.860
 1335    HB3  PRO 163           HB3      PRO 163  -5.811  17.615 -45.987
 1336    HG2  PRO 163           HG2      PRO 163  -3.240  17.255 -46.732
 1337    HG3  PRO 163           HG3      PRO 163  -4.001  18.866 -46.991
 1338    HD2  PRO 163           HD2      PRO 163  -2.204  17.989 -44.709
 1339    HD3  PRO 163           HD3      PRO 163  -2.117  19.487 -45.662
 1340    H    LYS 164           H        LYS 164  -3.904  18.483 -42.019
 1341    HA   LYS 164           HA       LYS 164  -6.479  17.863 -40.665
 1342    HB2  LYS 164           HB2      LYS 164  -3.807  16.432 -40.380
 1343    HB3  LYS 164           HB3      LYS 164  -5.177  16.237 -39.282
 1344    HG2  LYS 164           HG2      LYS 164  -6.577  15.422 -41.189
 1345    HG3  LYS 164           HG3      LYS 164  -5.163  15.545 -42.258
 1346    HD2  LYS 164           HD2      LYS 164  -3.947  13.905 -40.859
 1347    HD3  LYS 164           HD3      LYS 164  -5.355  13.781 -39.776
 1348    HE2  LYS 164           HE2      LYS 164  -6.752  13.023 -41.703
 1349    HE3  LYS 164           HE3      LYS 164  -5.344  13.119 -42.761
 1350    HZ1  LYS 164           HZ1      LYS 164  -5.728  10.858 -41.995
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.296  11.380 -41.409
 1352    HZ3  LYS 164           HZ3      LYS 164  -5.612  11.298 -40.428
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1  -0.020  -0.904  -2.084
    2    H2   MET   1           H2       MET   1   0.235   0.536  -1.347
    3    H3   MET   1           H3       MET   1  -0.180   0.503  -2.928
    4    HA   MET   1           HA       MET   1   2.329  -0.483  -1.740
    5    HB2  MET   1           HB2      MET   1   3.162  -1.052  -3.912
    6    HB3  MET   1           HB3      MET   1   1.666  -1.921  -3.634
    7    HG2  MET   1           HG2      MET   1   0.471  -0.223  -5.071
    8    HG3  MET   1           HG3      MET   1   2.025   0.526  -5.423
    9    HE1  MET   1           HE1      MET   1   3.805  -2.100  -7.690
   10    HE2  MET   1           HE2      MET   1   3.878  -0.485  -6.959
   11    HE3  MET   1           HE3      MET   1   4.044  -1.937  -5.938
   12    H    ILE   2           H        ILE   2   4.130   0.916  -1.837
   13    HA   ILE   2           HA       ILE   2   3.841   3.525  -3.201
   14    HB   ILE   2           HB       ILE   2   5.035   3.157  -0.433
   15   HG12  ILE   2          HG12      ILE   2   2.603   2.957  -0.159
   16   HG13  ILE   2          HG13      ILE   2   3.248   4.399   0.589
   17   HG21  ILE   2          HG21      ILE   2   6.069   4.983  -1.667
   18   HG22  ILE   2          HG22      ILE   2   4.491   5.698  -2.021
   19   HG23  ILE   2          HG23      ILE   2   5.090   5.638  -0.352
   20   HD11  ILE   2          HD11      ILE   2   1.064   4.761  -0.585
   21   HD12  ILE   2          HD12      ILE   2   2.348   5.823  -1.169
   22   HD13  ILE   2          HD13      ILE   2   1.855   4.425  -2.131
   23    H    ASP   3           H        ASP   3   5.817   4.080  -4.167
   24    HA   ASP   3           HA       ASP   3   7.779   2.017  -4.701
   25    HB2  ASP   3           HB2      ASP   3   7.031   3.829  -6.267
   26    HB3  ASP   3           HB3      ASP   3   7.832   5.008  -5.227
   27    H    ASP   4           H        ASP   4  10.008   2.102  -3.971
   28    HA   ASP   4           HA       ASP   4  10.193   2.244  -1.201
   29    HB2  ASP   4           HB2      ASP   4  11.608   0.837  -2.633
   30    HB3  ASP   4           HB3      ASP   4  12.432   2.273  -3.255
   31    H    ASP   5           H        ASP   5  10.882   4.868  -3.465
   32    HA   ASP   5           HA       ASP   5  12.463   6.365  -1.573
   33    HB2  ASP   5           HB2      ASP   5  12.787   6.375  -4.075
   34    HB3  ASP   5           HB3      ASP   5  11.296   7.307  -4.202
   35    H    GLY   6           H        GLY   6   9.202   5.734  -1.668
   36    HA2  GLY   6           HA2      GLY   6   7.640   6.570  -0.178
   37    HA3  GLY   6           HA3      GLY   6   8.490   8.121  -0.091
   38    H    TYR   7           H        TYR   7   7.614   6.404  -3.160
   39    HA   TYR   7           HA       TYR   7   5.987   8.832  -3.834
   40    HB2  TYR   7           HB2      TYR   7   8.059   7.306  -5.412
   41    HB3  TYR   7           HB3      TYR   7   6.754   8.175  -6.216
   42    HD1  TYR   7           HD2      TYR   7   9.442   8.736  -3.623
   43    HD2  TYR   7           HD1      TYR   7   6.912  10.464  -6.648
   44    HE1  TYR   7           HE2      TYR   7  10.503  10.913  -3.233
   45    HE2  TYR   7           HE1      TYR   7   7.956  12.660  -6.260
   46    HH   TYR   7           HH       TYR   7  10.586  13.199  -3.872
   47    H    ARG   8           H        ARG   8   4.011   8.563  -4.788
   48    HA   ARG   8           HA       ARG   8   2.918   5.807  -4.652
   49    HB2  ARG   8           HB2      ARG   8   1.557   7.647  -3.823
   50    HB3  ARG   8           HB3      ARG   8   1.637   8.463  -5.374
   51    HG2  ARG   8           HG2      ARG   8   0.345   6.525  -6.360
   52    HG3  ARG   8           HG3      ARG   8   0.319   5.791  -4.738
   53    HD2  ARG   8           HD2      ARG   8  -0.889   7.879  -3.940
   54    HD3  ARG   8           HD3      ARG   8  -0.989   8.379  -5.644
   55    HE   ARG   8           HE       ARG   8  -1.989   5.688  -5.182
   56   HH11  ARG   8          HH21      ARG   8  -2.950   9.117  -4.972
   57   HH12  ARG   8          HH22      ARG   8  -4.640   8.786  -5.074
   58   HH21  ARG   8          HH11      ARG   8  -4.249   5.265  -5.294
   59   HH22  ARG   8          HH12      ARG   8  -5.386   6.559  -5.274
   60    HA   PRO   9           HA       PRO   9   3.901   5.458  -9.074
   61    HB2  PRO   9           HB2      PRO   9   2.860   2.992  -9.600
   62    HB3  PRO   9           HB3      PRO   9   4.367   3.224  -8.670
   63    HG2  PRO   9           HG2      PRO   9   1.573   2.743  -7.597
   64    HG3  PRO   9           HG3      PRO   9   3.099   1.935  -7.122
   65    HD2  PRO   9           HD2      PRO   9   2.027   4.030  -5.723
   66    HD3  PRO   9           HD3      PRO   9   3.800   3.796  -5.868
   67    H    ASN  10           H        ASN  10   2.778   6.475 -10.662
   68    HA   ASN  10           HA       ASN  10  -0.186   6.308 -10.746
   69    HB2  ASN  10           HB2      ASN  10   1.565   8.802 -10.743
   70    HB3  ASN  10           HB3      ASN  10  -0.059   8.815 -11.390
   71   HD21  ASN  10          HD22      ASN  10   1.782   8.209  -8.384
   72   HD22  ASN  10          HD21      ASN  10   0.524   8.926  -7.390
   73    H    VAL  11           H        VAL  11  -1.027   7.050 -12.816
   74    HA   VAL  11           HA       VAL  11   0.865   7.236 -15.116
   75    HB   VAL  11           HB       VAL  11  -1.176   6.280 -16.410
   76   HG11  VAL  11          HG11      VAL  11   0.991   5.142 -16.252
   77   HG12  VAL  11          HG12      VAL  11   0.528   4.440 -14.685
   78   HG13  VAL  11          HG13      VAL  11  -0.337   3.973 -16.161
   79   HG21  VAL  11          HG21      VAL  11  -2.750   6.212 -14.427
   80   HG22  VAL  11          HG22      VAL  11  -2.585   4.662 -15.240
   81   HG23  VAL  11          HG23      VAL  11  -1.754   4.921 -13.718
   82    H    GLY  12           H        GLY  12   0.493   9.116 -16.276
   83    HA2  GLY  12           HA2      GLY  12  -2.002  10.702 -15.779
   84    HA3  GLY  12           HA3      GLY  12  -0.446  11.393 -16.253
   85    H    ILE  13           H        ILE  13  -3.150  11.364 -17.719
   86    HA   ILE  13           HA       ILE  13  -2.311   9.909 -20.186
   87    HB   ILE  13           HB       ILE  13  -5.100  10.972 -19.721
   88   HG12  ILE  13          HG12      ILE  13  -4.872   9.505 -17.808
   89   HG13  ILE  13          HG13      ILE  13  -5.964   8.825 -19.004
   90   HG21  ILE  13          HG21      ILE  13  -4.011   8.712 -21.450
   91   HG22  ILE  13          HG22      ILE  13  -5.704   9.234 -21.370
   92   HG23  ILE  13          HG23      ILE  13  -4.470  10.333 -22.004
   93   HD11  ILE  13          HD11      ILE  13  -4.474   7.136 -17.964
   94   HD12  ILE  13          HD12      ILE  13  -4.288   7.202 -19.715
   95   HD13  ILE  13          HD13      ILE  13  -3.061   7.947 -18.659
   96    H    VAL  14           H        VAL  14  -1.610  11.218 -21.839
   97    HA   VAL  14           HA       VAL  14  -2.487  14.087 -21.812
   98    HB   VAL  14           HB       VAL  14  -0.262  12.840 -23.481
   99   HG11  VAL  14          HG11      VAL  14  -1.327  14.804 -24.546
  100   HG12  VAL  14          HG12      VAL  14  -1.055  15.758 -23.072
  101   HG13  VAL  14          HG13      VAL  14   0.320  15.158 -24.027
  102   HG21  VAL  14          HG21      VAL  14  -0.112  14.495 -20.941
  103   HG22  VAL  14          HG22      VAL  14   0.510  12.836 -21.246
  104   HG23  VAL  14          HG23      VAL  14   1.243  14.219 -22.046
  105    H    ILE  15           H        ILE  15  -4.691  13.511 -22.473
  106    HA   ILE  15           HA       ILE  15  -5.060  12.019 -24.975
  107    HB   ILE  15           HB       ILE  15  -6.985  13.958 -23.609
  108   HG12  ILE  15          HG12      ILE  15  -6.575  11.841 -22.321
  109   HG13  ILE  15          HG13      ILE  15  -8.234  12.116 -22.828
  110   HG21  ILE  15          HG21      ILE  15  -7.563  13.979 -25.920
  111   HG22  ILE  15          HG22      ILE  15  -7.406  12.215 -26.058
  112   HG23  ILE  15          HG23      ILE  15  -8.720  12.938 -25.093
  113   HD11  ILE  15          HD11      ILE  15  -7.383   9.727 -23.139
  114   HD12  ILE  15          HD12      ILE  15  -8.089  10.460 -24.589
  115   HD13  ILE  15          HD13      ILE  15  -6.328  10.345 -24.432
  116    H    CYS  16           H        CYS  16  -4.770  12.781 -26.929
  117    HA   CYS  16           HA       CYS  16  -4.565  15.735 -27.364
  118    HB2  CYS  16           HB2      CYS  16  -3.087  13.448 -28.736
  119    HB3  CYS  16           HB3      CYS  16  -3.230  15.094 -29.426
  120    HG   CYS  16           HG       CYS  16  -2.264  16.391 -27.425
  121    H    ASN  17           H        ASN  17  -6.282  16.412 -28.505
  122    HA   ASN  17           HA       ASN  17  -8.186  14.347 -29.489
  123    HB2  ASN  17           HB2      ASN  17  -9.905  16.191 -29.280
  124    HB3  ASN  17           HB3      ASN  17  -9.205  15.620 -27.772
  125   HD21  ASN  17          HD22      ASN  17  -7.675  16.954 -26.643
  126   HD22  ASN  17          HD21      ASN  17  -7.470  18.665 -27.059
  127    H    ARG  18           H        ARG  18  -6.003  14.793 -31.006
  128    HA   ARG  18           HA       ARG  18  -5.153  15.104 -32.975
  129    HB2  ARG  18           HB2      ARG  18  -8.092  15.075 -33.755
  130    HB3  ARG  18           HB3      ARG  18  -6.799  15.218 -34.958
  131    HG2  ARG  18           HG2      ARG  18  -5.783  13.160 -34.244
  132    HG3  ARG  18           HG3      ARG  18  -6.869  13.009 -32.857
  133    HD2  ARG  18           HD2      ARG  18  -8.085  13.205 -35.603
  134    HD3  ARG  18           HD3      ARG  18  -7.259  11.702 -35.179
  135    HE   ARG  18           HE       ARG  18  -8.679  11.589 -33.117
  136   HH11  ARG  18          HH11      ARG  18  -9.993  13.138 -36.062
  137   HH12  ARG  18          HH12      ARG  18 -11.631  12.771 -35.656
  138   HH21  ARG  18          HH21      ARG  18 -10.761  11.104 -32.622
  139   HH22  ARG  18          HH22      ARG  18 -12.098  11.572 -33.624
  140    H    GLN  19           H        GLN  19  -7.839  17.333 -32.969
  141    HA   GLN  19           HA       GLN  19  -6.109  19.287 -34.379
  142    HB2  GLN  19           HB2      GLN  19  -8.244  20.522 -34.829
  143    HB3  GLN  19           HB3      GLN  19  -8.149  18.906 -35.505
  144    HG2  GLN  19           HG2      GLN  19 -10.363  19.331 -34.646
  145    HG3  GLN  19           HG3      GLN  19  -9.599  18.013 -33.769
  146   HE21  GLN  19          HE22      GLN  19  -9.960  18.072 -31.551
  147   HE22  GLN  19          HE21      GLN  19 -10.178  19.512 -30.616
  148    H    GLY  20           H        GLY  20  -7.251  18.776 -31.163
  149    HA2  GLY  20           HA2      GLY  20  -6.860  21.667 -30.574
  150    HA3  GLY  20           HA3      GLY  20  -8.062  20.649 -29.805
  151    H    GLN  21           H        GLN  21  -4.598  20.026 -30.516
  152    HA   GLN  21           HA       GLN  21  -2.823  19.597 -29.322
  153    HB2  GLN  21           HB2      GLN  21  -3.945  21.850 -27.677
  154    HB3  GLN  21           HB3      GLN  21  -2.282  21.301 -27.679
  155    HG2  GLN  21           HG2      GLN  21  -2.352  23.259 -29.074
  156    HG3  GLN  21           HG3      GLN  21  -2.148  21.886 -30.143
  157   HE21  GLN  21          HE22      GLN  21  -3.458  22.050 -32.002
  158   HE22  GLN  21          HE21      GLN  21  -5.114  22.597 -31.983
  159    H    VAL  22           H        VAL  22  -4.629  20.326 -26.297
  160    HA   VAL  22           HA       VAL  22  -3.880  17.570 -25.454
  161    HB   VAL  22           HB       VAL  22  -2.862  18.562 -23.429
  162   HG11  VAL  22          HG11      VAL  22  -0.779  19.215 -24.491
  163   HG12  VAL  22          HG12      VAL  22  -1.513  17.905 -25.438
  164   HG13  VAL  22          HG13      VAL  22  -1.602  19.573 -26.021
  165   HG21  VAL  22          HG21      VAL  22  -3.233  21.238 -24.879
  166   HG22  VAL  22          HG22      VAL  22  -4.006  20.745 -23.372
  167   HG23  VAL  22          HG23      VAL  22  -2.253  20.974 -23.424
  168    H    MET  23           H        MET  23  -4.645  16.882 -23.510
  169    HA   MET  23           HA       MET  23  -7.386  17.073 -23.032
  170    HB2  MET  23           HB2      MET  23  -5.785  15.209 -22.417
  171    HB3  MET  23           HB3      MET  23  -5.126  16.206 -21.140
  172    HG2  MET  23           HG2      MET  23  -6.742  14.590 -20.254
  173    HG3  MET  23           HG3      MET  23  -7.276  16.239 -19.981
  174    HE1  MET  23           HE1      MET  23  -9.377  13.886 -19.599
  175    HE2  MET  23           HE2      MET  23  -9.650  15.633 -19.418
  176    HE3  MET  23           HE3      MET  23 -10.752  14.661 -20.424
  177    H    TRP  24           H        TRP  24  -8.601  18.462 -21.730
  178    HA   TRP  24           HA       TRP  24  -7.564  19.304 -19.249
  179    HB2  TRP  24           HB2      TRP  24  -6.850  21.140 -21.051
  180    HB3  TRP  24           HB3      TRP  24  -8.512  21.670 -20.842
  181    HD1  TRP  24           HD1      TRP  24  -8.391  23.699 -19.385
  182    HE1  TRP  24           HE1      TRP  24  -7.358  24.355 -17.147
  183    HE3  TRP  24           HE3      TRP  24  -5.609  19.478 -18.498
  184    HZ2  TRP  24           HZ2      TRP  24  -5.422  23.222 -15.237
  185    HZ3  TRP  24           HZ3      TRP  24  -4.368  19.234 -16.410
  186    HH2  TRP  24           HH2      TRP  24  -4.317  21.066 -14.746
  187    H    ALA  25           H        ALA  25  -9.248  19.470 -17.813
  188    HA   ALA  25           HA       ALA  25 -11.995  19.560 -18.756
  189    HB1  ALA  25           HB1      ALA  25 -12.479  17.257 -17.813
  190    HB2  ALA  25           HB2      ALA  25 -11.542  17.237 -19.318
  191    HB3  ALA  25           HB3      ALA  25 -10.729  16.971 -17.757
  192    H    ARG  26           H        ARG  26 -13.443  19.858 -17.066
  193    HA   ARG  26           HA       ARG  26 -12.286  21.044 -14.655
  194    HB2  ARG  26           HB2      ARG  26 -14.215  22.009 -15.982
  195    HB3  ARG  26           HB3      ARG  26 -15.214  20.652 -15.443
  196    HG2  ARG  26           HG2      ARG  26 -14.853  21.389 -13.064
  197    HG3  ARG  26           HG3      ARG  26 -13.830  22.712 -13.659
  198    HD2  ARG  26           HD2      ARG  26 -16.018  23.607 -13.183
  199    HD3  ARG  26           HD3      ARG  26 -15.763  23.616 -14.937
  200    HE   ARG  26           HE       ARG  26 -17.102  21.194 -14.102
  201   HH11  ARG  26          HH11      ARG  26 -17.765  24.657 -14.637
  202   HH12  ARG  26          HH12      ARG  26 -19.436  24.406 -14.986
  203   HH21  ARG  26          HH21      ARG  26 -19.259  20.863 -14.564
  204   HH22  ARG  26          HH22      ARG  26 -20.324  22.191 -14.942
  205    H    ARG  27           H        ARG  27 -12.434  20.135 -12.542
  206    HA   ARG  27           HA       ARG  27 -12.818  17.239 -12.590
  207    HB2  ARG  27           HB2      ARG  27 -10.730  18.439 -11.837
  208    HB3  ARG  27           HB3      ARG  27 -11.568  18.886 -10.380
  209    HG2  ARG  27           HG2      ARG  27 -10.948  16.048 -11.333
  210    HG3  ARG  27           HG3      ARG  27 -10.077  16.957 -10.104
  211    HD2  ARG  27           HD2      ARG  27 -12.097  17.000  -8.676
  212    HD3  ARG  27           HD3      ARG  27 -12.927  15.962  -9.855
  213    HE   ARG  27           HE       ARG  27 -10.553  14.629  -9.214
  214   HH11  ARG  27          HH12      ARG  27 -13.560  15.598  -7.530
  215   HH12  ARG  27          HH11      ARG  27 -13.395  14.382  -6.306
  216   HH21  ARG  27          HH21      ARG  27 -10.409  13.029  -7.734
  217   HH22  ARG  27          HH22      ARG  27 -11.551  12.841  -6.419
  218    H    PHE  28           H        PHE  28 -14.505  16.274 -11.720
  219    HA   PHE  28           HA       PHE  28 -16.901  17.221 -10.710
  220    HB2  PHE  28           HB2      PHE  28 -16.536  14.959 -11.490
  221    HB3  PHE  28           HB3      PHE  28 -15.242  14.698 -10.337
  222    HD1  PHE  28           HD2      PHE  28 -18.949  15.301 -10.475
  223    HD2  PHE  28           HD1      PHE  28 -15.619  13.545  -8.355
  224    HE1  PHE  28           HE2      PHE  28 -20.527  14.156  -8.931
  225    HE2  PHE  28           HE1      PHE  28 -17.206  12.393  -6.827
  226    HZ   PHE  28           HZ       PHE  28 -19.659  12.701  -7.114
  227    H    GLY  29           H        GLY  29 -17.559  18.044  -8.751
  228    HA2  GLY  29           HA2      GLY  29 -17.691  18.454  -6.520
  229    HA3  GLY  29           HA3      GLY  29 -16.377  17.309  -6.240
  230    H    GLN  30           H        GLN  30 -14.477  18.770  -8.025
  231    HA   GLN  30           HA       GLN  30 -13.525  20.759  -6.131
  232    HB2  GLN  30           HB2      GLN  30 -12.227  19.018  -7.627
  233    HB3  GLN  30           HB3      GLN  30 -12.410  20.243  -8.890
  234    HG2  GLN  30           HG2      GLN  30 -11.281  21.869  -7.248
  235    HG3  GLN  30           HG3      GLN  30 -10.915  20.463  -6.250
  236   HE21  GLN  30          HE22      GLN  30  -9.954  22.330  -8.978
  237   HE22  GLN  30          HE21      GLN  30  -8.768  21.249  -9.677
  238    H    HIS  31           H        HIS  31 -15.029  20.693  -9.353
  239    HA   HIS  31           HA       HIS  31 -15.799  22.196 -10.777
  240    HB2  HIS  31           HB2      HIS  31 -16.293  23.980  -8.381
  241    HB3  HIS  31           HB3      HIS  31 -17.021  24.141  -9.979
  242    HD1  HIS  31           HD1      HIS  31 -18.793  22.120 -10.695
  243    HD2  HIS  31           HD2      HIS  31 -17.401  22.214  -6.719
  244    HE1  HIS  31           HE1      HIS  31 -20.314  20.573  -9.365
  245    H    SER  32           H        SER  32 -12.954  22.104 -10.347
  246    HA   SER  32           HA       SER  32 -12.278  24.369 -12.019
  247    HB2  SER  32           HB2      SER  32 -10.240  24.924 -10.598
  248    HB3  SER  32           HB3      SER  32 -11.804  25.451  -9.972
  249    HG   SER  32           HG       SER  32 -10.769  24.554  -8.265
  250    H    TRP  33           H        TRP  33  -9.760  23.923 -12.638
  251    HA   TRP  33           HA       TRP  33  -9.973  21.379 -13.959
  252    HB2  TRP  33           HB2      TRP  33  -7.603  23.264 -13.990
  253    HB3  TRP  33           HB3      TRP  33  -8.128  22.119 -15.227
  254    HD1  TRP  33           HD1      TRP  33  -8.712  25.649 -13.979
  255    HE1  TRP  33           HE1      TRP  33 -10.409  26.873 -15.438
  256    HE3  TRP  33           HE3      TRP  33 -10.093  21.783 -17.005
  257    HZ2  TRP  33           HZ2      TRP  33 -12.191  26.248 -17.645
  258    HZ3  TRP  33           HZ3      TRP  33 -11.836  22.102 -18.760
  259    HH2  TRP  33           HH2      TRP  33 -12.888  24.333 -19.080
  260    H    GLN  34           H        GLN  34  -8.133  19.757 -14.115
  261    HA   GLN  34           HA       GLN  34  -6.412  19.621 -11.725
  262    HB2  GLN  34           HB2      GLN  34  -8.547  18.450 -11.157
  263    HB3  GLN  34           HB3      GLN  34  -8.281  17.372 -12.530
  264    HG2  GLN  34           HG2      GLN  34  -5.960  16.898 -11.274
  265    HG3  GLN  34           HG3      GLN  34  -6.815  17.559  -9.892
  266   HE21  GLN  34          HE22      GLN  34  -7.608  15.814  -8.619
  267   HE22  GLN  34          HE21      GLN  34  -8.281  14.339  -9.316
  268    H    PHE  35           H        PHE  35  -4.505  18.860 -12.166
  269    HA   PHE  35           HA       PHE  35  -3.391  18.120 -14.680
  270    HB2  PHE  35           HB2      PHE  35  -2.197  19.111 -12.821
  271    HB3  PHE  35           HB3      PHE  35  -2.661  17.823 -11.744
  272    HD1  PHE  35           HD1      PHE  35  -1.584  15.575 -11.864
  273    HD2  PHE  35           HD2      PHE  35  -0.185  18.957 -14.152
  274    HE1  PHE  35           HE1      PHE  35   0.703  14.624 -11.887
  275    HE2  PHE  35           HE2      PHE  35   2.105  18.009 -14.128
  276    HZ   PHE  35           HZ       PHE  35   2.573  15.893 -12.953
  277    HA   PRO  36           HA       PRO  36  -5.374  14.043 -14.603
  278    HB2  PRO  36           HB2      PRO  36  -3.318  13.345 -16.691
  279    HB3  PRO  36           HB3      PRO  36  -5.075  13.010 -16.686
  280    HG2  PRO  36           HG2      PRO  36  -4.065  15.074 -18.151
  281    HG3  PRO  36           HG3      PRO  36  -5.590  15.270 -17.235
  282    HD2  PRO  36           HD2      PRO  36  -2.816  16.227 -16.491
  283    HD3  PRO  36           HD3      PRO  36  -4.396  17.037 -16.307
  284    H    GLN  37           H        GLN  37  -5.030  12.171 -13.474
  285    HA   GLN  37           HA       GLN  37  -2.480  10.920 -13.113
  286    HB2  GLN  37           HB2      GLN  37  -1.931  11.250 -10.966
  287    HB3  GLN  37           HB3      GLN  37  -2.146  12.861 -11.600
  288    HG2  GLN  37           HG2      GLN  37  -4.093  11.371  -9.763
  289    HG3  GLN  37           HG3      GLN  37  -2.940  12.595  -9.280
  290   HE21  GLN  37          HE22      GLN  37  -5.751  12.208 -11.535
  291   HE22  GLN  37          HE21      GLN  37  -6.435  13.785 -11.194
  292    H    GLY  38           H        GLY  38  -2.828   8.788 -12.404
  293    HA2  GLY  38           HA2      GLY  38  -5.130   8.156 -10.689
  294    HA3  GLY  38           HA3      GLY  38  -5.058   7.314 -12.252
  295    H    GLY  39           H        GLY  39  -4.527   6.478  -9.260
  296    HA2  GLY  39           HA2      GLY  39  -1.738   5.842  -9.044
  297    HA3  GLY  39           HA3      GLY  39  -3.062   5.225  -8.048
  298    H    ILE  40           H        ILE  40  -0.785   3.848  -9.329
  299    HA   ILE  40           HA       ILE  40  -1.946   2.161 -11.435
  300    HB   ILE  40           HB       ILE  40   0.717   2.090  -9.983
  301   HG12  ILE  40          HG12      ILE  40  -0.236   2.932 -12.764
  302   HG13  ILE  40          HG13      ILE  40   0.419   3.970 -11.511
  303   HG21  ILE  40          HG21      ILE  40  -0.151   0.303 -12.298
  304   HG22  ILE  40          HG22      ILE  40   1.452   0.354 -11.534
  305   HG23  ILE  40          HG23      ILE  40   0.078  -0.234 -10.623
  306   HD11  ILE  40          HD11      ILE  40   2.109   3.692 -13.174
  307   HD12  ILE  40          HD12      ILE  40   2.644   2.737 -11.785
  308   HD13  ILE  40          HD13      ILE  40   1.926   1.936 -13.202
  309    H    ASN  41           H        ASN  41  -2.993   0.321 -11.195
  310    HA   ASN  41           HA       ASN  41  -3.940  -0.520  -8.585
  311    HB2  ASN  41           HB2      ASN  41  -5.470  -0.541 -10.445
  312    HB3  ASN  41           HB3      ASN  41  -4.334  -1.431 -11.445
  313   HD21  ASN  41          HD22      ASN  41  -5.860  -3.023 -11.938
  314   HD22  ASN  41          HD21      ASN  41  -6.373  -4.231 -10.759
  315    HA   PRO  42           HA       PRO  42  -0.416  -2.964  -7.816
  316    HB2  PRO  42           HB2      PRO  42  -2.267  -4.632  -6.084
  317    HB3  PRO  42           HB3      PRO  42  -0.604  -4.059  -5.729
  318    HG2  PRO  42           HG2      PRO  42  -2.725  -2.716  -4.729
  319    HG3  PRO  42           HG3      PRO  42  -1.360  -1.806  -5.453
  320    HD2  PRO  42           HD2      PRO  42  -4.031  -2.487  -6.691
  321    HD3  PRO  42           HD3      PRO  42  -3.103  -0.955  -6.735
  322    H    GLY  43           H        GLY  43   0.391  -4.131  -9.272
  323    HA2  GLY  43           HA2      GLY  43   1.058  -6.183 -10.217
  324    HA3  GLY  43           HA3      GLY  43  -0.477  -6.920  -9.739
  325    H    GLU  44           H        GLU  44  -1.166  -3.931 -11.173
  326    HA   GLU  44           HA       GLU  44  -1.630  -5.134 -13.875
  327    HB2  GLU  44           HB2      GLU  44  -3.618  -4.367 -12.671
  328    HB3  GLU  44           HB3      GLU  44  -2.904  -2.753 -12.485
  329    HG2  GLU  44           HG2      GLU  44  -2.944  -2.338 -14.810
  330    HG3  GLU  44           HG3      GLU  44  -3.255  -4.040 -15.182
  331    H    SER  45           H        SER  45  -0.094  -4.624 -15.325
  332    HA   SER  45           HA       SER  45   1.943  -2.742 -14.729
  333    HB2  SER  45           HB2      SER  45   1.453  -4.058 -17.398
  334    HB3  SER  45           HB3      SER  45   2.978  -3.478 -16.724
  335    HG   SER  45           HG       SER  45   2.729  -5.778 -16.527
  336    H    ALA  46           H        ALA  46   2.717  -1.105 -16.256
  337    HA   ALA  46           HA       ALA  46   1.153   1.130 -16.096
  338    HB1  ALA  46           HB1      ALA  46   3.288   0.517 -18.193
  339    HB2  ALA  46           HB2      ALA  46   2.770   2.149 -17.669
  340    HB3  ALA  46           HB3      ALA  46   3.606   1.087 -16.529
  341    H    GLU  47           H        GLU  47   1.452  -0.988 -18.999
  342    HA   GLU  47           HA       GLU  47  -0.379   0.748 -20.479
  343    HB2  GLU  47           HB2      GLU  47   1.102  -1.793 -21.261
  344    HB3  GLU  47           HB3      GLU  47   0.066  -0.871 -22.357
  345    HG2  GLU  47           HG2      GLU  47   1.486   1.094 -22.150
  346    HG3  GLU  47           HG3      GLU  47   2.534   0.267 -20.988
  347    H    GLN  48           H        GLN  48  -1.265  -0.770 -18.070
  348    HA   GLN  48           HA       GLN  48  -3.829  -1.719 -19.233
  349    HB2  GLN  48           HB2      GLN  48  -2.310  -3.146 -16.987
  350    HB3  GLN  48           HB3      GLN  48  -3.983  -3.419 -17.447
  351    HG2  GLN  48           HG2      GLN  48  -3.112  -5.123 -18.609
  352    HG3  GLN  48           HG3      GLN  48  -2.892  -3.909 -19.855
  353   HE21  GLN  48          HE22      GLN  48  -0.692  -3.233 -20.343
  354   HE22  GLN  48          HE21      GLN  48   0.721  -4.005 -19.638
  355    H    ALA  49           H        ALA  49  -1.995  -0.706 -16.287
  356    HA   ALA  49           HA       ALA  49  -4.158   0.436 -14.877
  357    HB1  ALA  49           HB1      ALA  49  -1.186   1.132 -14.863
  358    HB2  ALA  49           HB2      ALA  49  -2.373   1.606 -13.631
  359    HB3  ALA  49           HB3      ALA  49  -1.985  -0.114 -13.871
  360    H    MET  50           H        MET  50  -2.023   1.832 -17.425
  361    HA   MET  50           HA       MET  50  -2.927   4.514 -17.305
  362    HB2  MET  50           HB2      MET  50  -0.969   3.796 -18.523
  363    HB3  MET  50           HB3      MET  50  -1.938   2.816 -19.628
  364    HG2  MET  50           HG2      MET  50  -2.279   5.816 -19.312
  365    HG3  MET  50           HG3      MET  50  -1.143   5.102 -20.435
  366    HE1  MET  50           HE1      MET  50  -3.134   3.701 -23.324
  367    HE2  MET  50           HE2      MET  50  -1.586   4.380 -22.785
  368    HE3  MET  50           HE3      MET  50  -2.206   2.885 -22.045
  369    H    TYR  51           H        TYR  51  -4.344   1.670 -19.024
  370    HA   TYR  51           HA       TYR  51  -6.577   3.167 -19.980
  371    HB2  TYR  51           HB2      TYR  51  -6.233   0.179 -19.628
  372    HB3  TYR  51           HB3      TYR  51  -7.568   0.980 -20.448
  373    HD1  TYR  51           HD1      TYR  51  -3.964   0.176 -20.628
  374    HD2  TYR  51           HD2      TYR  51  -7.314   1.961 -22.674
  375    HE1  TYR  51           HE1      TYR  51  -2.683   0.114 -22.708
  376    HE2  TYR  51           HE2      TYR  51  -6.083   1.854 -24.785
  377    HH   TYR  51           HH       TYR  51  -2.809   0.383 -25.086
  378    H    ARG  52           H        ARG  52  -5.943   1.403 -16.926
  379    HA   ARG  52           HA       ARG  52  -8.640   1.420 -15.938
  380    HB2  ARG  52           HB2      ARG  52  -6.559   0.199 -14.980
  381    HB3  ARG  52           HB3      ARG  52  -6.113   1.735 -14.256
  382    HG2  ARG  52           HG2      ARG  52  -7.172   0.554 -12.537
  383    HG3  ARG  52           HG3      ARG  52  -8.335   1.770 -13.065
  384    HD2  ARG  52           HD2      ARG  52  -9.451  -0.346 -12.634
  385    HD3  ARG  52           HD3      ARG  52  -9.562   0.037 -14.357
  386    HE   ARG  52           HE       ARG  52  -7.253  -1.640 -13.819
  387   HH11  ARG  52          HH11      ARG  52 -10.808  -1.911 -13.782
  388   HH12  ARG  52          HH12      ARG  52 -10.816  -3.563 -14.281
  389   HH21  ARG  52          HH21      ARG  52  -7.276  -3.729 -14.692
  390   HH22  ARG  52          HH22      ARG  52  -8.752  -4.660 -14.729
  391    H    ALA  53           H        ALA  53  -5.963   3.832 -15.634
  392    HA   ALA  53           HA       ALA  53  -7.560   5.805 -14.318
  393    HB1  ALA  53           HB1      ALA  53  -5.111   5.801 -14.245
  394    HB2  ALA  53           HB2      ALA  53  -5.033   6.089 -15.997
  395    HB3  ALA  53           HB3      ALA  53  -5.707   7.332 -14.928
  396    H    LEU  54           H        LEU  54  -7.036   5.117 -17.790
  397    HA   LEU  54           HA       LEU  54  -8.133   7.472 -18.949
  398    HB2  LEU  54           HB2      LEU  54  -6.906   5.690 -20.125
  399    HB3  LEU  54           HB3      LEU  54  -8.169   4.555 -19.686
  400    HG   LEU  54           HG       LEU  54  -9.770   5.664 -21.208
  401   HD11  LEU  54          HD11      LEU  54  -8.683   7.911 -21.326
  402   HD12  LEU  54          HD12      LEU  54  -7.256   7.173 -22.091
  403   HD13  LEU  54          HD13      LEU  54  -8.814   7.176 -22.937
  404   HD21  LEU  54          HD21      LEU  54  -8.820   4.639 -23.152
  405   HD22  LEU  54          HD22      LEU  54  -7.219   4.549 -22.345
  406   HD23  LEU  54          HD23      LEU  54  -8.621   3.658 -21.691
  407    H    PHE  55           H        PHE  55  -9.573   4.473 -17.808
  408    HA   PHE  55           HA       PHE  55 -12.331   5.166 -18.300
  409    HB2  PHE  55           HB2      PHE  55 -12.019   2.909 -18.332
  410    HB3  PHE  55           HB3      PHE  55 -10.804   2.915 -17.074
  411    HD1  PHE  55           HD1      PHE  55 -14.474   3.037 -17.680
  412    HD2  PHE  55           HD2      PHE  55 -11.299   2.592 -14.813
  413    HE1  PHE  55           HE1      PHE  55 -16.129   2.288 -15.973
  414    HE2  PHE  55           HE2      PHE  55 -12.949   1.845 -13.090
  415    HZ   PHE  55           HZ       PHE  55 -15.365   1.696 -13.674
  416    H    GLU  56           H        GLU  56 -10.388   5.118 -15.204
  417    HA   GLU  56           HA       GLU  56 -12.575   6.006 -13.641
  418    HB2  GLU  56           HB2      GLU  56  -9.564   6.144 -13.175
  419    HB3  GLU  56           HB3      GLU  56 -10.751   6.667 -11.985
  420    HG2  GLU  56           HG2      GLU  56 -11.788   4.403 -12.003
  421    HG3  GLU  56           HG3      GLU  56 -10.513   3.838 -13.081
  422    H    GLU  57           H        GLU  57 -10.102   7.923 -15.399
  423    HA   GLU  57           HA       GLU  57 -10.977  10.383 -14.097
  424    HB2  GLU  57           HB2      GLU  57  -8.926   9.986 -16.312
  425    HB3  GLU  57           HB3      GLU  57  -9.257  11.473 -15.426
  426    HG2  GLU  57           HG2      GLU  57  -8.624  10.226 -13.301
  427    HG3  GLU  57           HG3      GLU  57  -8.048   8.919 -14.337
  428    H    VAL  58           H        VAL  58 -10.805   9.183 -17.485
  429    HA   VAL  58           HA       VAL  58 -12.411  11.477 -18.371
  430    HB   VAL  58           HB       VAL  58 -11.187   9.419 -20.214
  431   HG11  VAL  58          HG11      VAL  58 -10.842  11.387 -21.670
  432   HG12  VAL  58          HG12      VAL  58 -12.535  11.210 -21.205
  433   HG13  VAL  58          HG13      VAL  58 -11.535  12.439 -20.410
  434   HG21  VAL  58          HG21      VAL  58  -9.050  10.730 -20.264
  435   HG22  VAL  58          HG22      VAL  58  -9.568  11.588 -18.797
  436   HG23  VAL  58          HG23      VAL  58  -9.280   9.835 -18.765
  437    H    GLY  59           H        GLY  59 -12.767   8.015 -17.875
  438    HA2  GLY  59           HA2      GLY  59 -14.498   6.584 -18.323
  439    HA3  GLY  59           HA3      GLY  59 -15.552   7.970 -18.678
  440    H    LEU  60           H        LEU  60 -12.616   6.371 -19.924
  441    HA   LEU  60           HA       LEU  60 -13.830   5.869 -22.551
  442    HB2  LEU  60           HB2      LEU  60 -11.133   7.184 -21.989
  443    HB3  LEU  60           HB3      LEU  60 -11.474   6.334 -23.493
  444    HG   LEU  60           HG       LEU  60 -12.808   8.842 -22.432
  445   HD11  LEU  60          HD11      LEU  60 -10.526   9.108 -23.379
  446   HD12  LEU  60          HD12      LEU  60 -11.049   8.302 -24.880
  447   HD13  LEU  60          HD13      LEU  60 -11.716   9.872 -24.435
  448   HD21  LEU  60          HD21      LEU  60 -14.565   7.690 -23.628
  449   HD22  LEU  60          HD22      LEU  60 -13.944   8.917 -24.728
  450   HD23  LEU  60          HD23      LEU  60 -13.473   7.218 -24.924
  451    H    SER  61           H        SER  61 -12.773   3.960 -23.530
  452    HA   SER  61           HA       SER  61 -11.669   2.153 -21.417
  453    HB2  SER  61           HB2      SER  61 -13.617   1.600 -23.682
  454    HB3  SER  61           HB3      SER  61 -13.088   0.435 -22.449
  455    HG   SER  61           HG       SER  61 -15.118   1.382 -21.904
  456    H    ARG  62           H        ARG  62 -10.972  -0.006 -22.728
  457    HA   ARG  62           HA       ARG  62  -8.439   0.625 -23.876
  458    HB2  ARG  62           HB2      ARG  62  -9.915  -2.016 -23.427
  459    HB3  ARG  62           HB3      ARG  62  -8.225  -1.899 -23.938
  460    HG2  ARG  62           HG2      ARG  62  -7.603  -0.739 -21.944
  461    HG3  ARG  62           HG3      ARG  62  -9.273  -0.698 -21.355
  462    HD2  ARG  62           HD2      ARG  62  -9.192  -3.210 -21.219
  463    HD3  ARG  62           HD3      ARG  62  -7.474  -3.119 -21.678
  464    HE   ARG  62           HE       ARG  62  -8.330  -1.449 -19.404
  465   HH11  ARG  62          HH11      ARG  62  -7.195  -4.719 -20.160
  466   HH12  ARG  62          HH12      ARG  62  -6.418  -4.947 -18.636
  467   HH21  ARG  62          HH21      ARG  62  -7.094  -1.649 -17.477
  468   HH22  ARG  62          HH22      ARG  62  -6.420  -3.163 -17.019
  469    H    LYS  63           H        LYS  63 -10.066   1.841 -25.578
  470    HA   LYS  63           HA       LYS  63  -9.648   0.560 -28.162
  471    HB2  LYS  63           HB2      LYS  63 -11.999   0.194 -28.733
  472    HB3  LYS  63           HB3      LYS  63 -11.524  -0.789 -27.348
  473    HG2  LYS  63           HG2      LYS  63 -12.642   0.799 -25.810
  474    HG3  LYS  63           HG3      LYS  63 -13.141   1.789 -27.194
  475    HD2  LYS  63           HD2      LYS  63 -14.463  -0.064 -28.093
  476    HD3  LYS  63           HD3      LYS  63 -13.911  -1.133 -26.784
  477    HE2  LYS  63           HE2      LYS  63 -14.962   0.332 -25.104
  478    HE3  LYS  63           HE3      LYS  63 -15.458   1.470 -26.364
  479    HZ1  LYS  63           HZ1      LYS  63 -16.885  -0.271 -27.299
  480    HZ2  LYS  63           HZ2      LYS  63 -16.432  -1.334 -26.134
  481    HZ3  LYS  63           HZ3      LYS  63 -17.282   0.005 -25.740
  482    H    ASP  64           H        ASP  64 -10.798   3.240 -26.185
  483    HA   ASP  64           HA       ASP  64 -11.922   4.711 -28.444
  484    HB2  ASP  64           HB2      ASP  64 -11.443   5.308 -25.505
  485    HB3  ASP  64           HB3      ASP  64 -12.188   6.453 -26.609
  486    H    VAL  65           H        VAL  65  -8.767   4.173 -27.654
  487    HA   VAL  65           HA       VAL  65  -7.828   6.767 -28.624
  488    HB   VAL  65           HB       VAL  65  -6.371   7.049 -26.677
  489   HG11  VAL  65          HG11      VAL  65  -8.578   8.233 -26.847
  490   HG12  VAL  65          HG12      VAL  65  -9.256   7.008 -25.767
  491   HG13  VAL  65          HG13      VAL  65  -7.942   8.050 -25.200
  492   HG21  VAL  65          HG21      VAL  65  -6.366   4.700 -25.790
  493   HG22  VAL  65          HG22      VAL  65  -6.800   5.887 -24.552
  494   HG23  VAL  65          HG23      VAL  65  -8.060   4.897 -25.319
  495    H    ARG  66           H        ARG  66  -5.345   6.690 -28.741
  496    HA   ARG  66           HA       ARG  66  -4.306   4.051 -29.663
  497    HB2  ARG  66           HB2      ARG  66  -5.291   4.996 -31.637
  498    HB3  ARG  66           HB3      ARG  66  -4.838   6.634 -31.184
  499    HG2  ARG  66           HG2      ARG  66  -3.533   6.064 -33.021
  500    HG3  ARG  66           HG3      ARG  66  -2.467   6.130 -31.632
  501    HD2  ARG  66           HD2      ARG  66  -3.633   3.438 -32.344
  502    HD3  ARG  66           HD3      ARG  66  -2.495   4.134 -33.502
  503    HE   ARG  66           HE       ARG  66  -1.049   4.427 -31.263
  504   HH11  ARG  66          HH11      ARG  66  -2.693   1.562 -32.622
  505   HH12  ARG  66          HH12      ARG  66  -1.499   0.458 -32.036
  506   HH21  ARG  66          HH21      ARG  66   0.502   2.988 -30.527
  507   HH22  ARG  66          HH22      ARG  66   0.364   1.284 -30.822
  508    H    ILE  67           H        ILE  67  -2.259   3.910 -28.605
  509    HA   ILE  67           HA       ILE  67  -1.103   6.276 -27.391
  510    HB   ILE  67           HB       ILE  67  -0.002   3.464 -27.753
  511   HG12  ILE  67          HG12      ILE  67  -1.257   4.686 -25.248
  512   HG13  ILE  67          HG13      ILE  67  -2.188   3.722 -26.385
  513   HG21  ILE  67          HG21      ILE  67   0.885   5.722 -25.895
  514   HG22  ILE  67          HG22      ILE  67   1.562   4.075 -25.930
  515   HG23  ILE  67          HG23      ILE  67   1.784   5.124 -27.316
  516   HD11  ILE  67          HD11      ILE  67   0.219   2.764 -24.764
  517   HD12  ILE  67          HD12      ILE  67  -1.467   2.294 -24.570
  518   HD13  ILE  67          HD13      ILE  67  -0.590   1.809 -26.034
  519    H    LEU  68           H        LEU  68   0.278   7.683 -28.245
  520    HA   LEU  68           HA       LEU  68   1.537   7.009 -30.887
  521    HB2  LEU  68           HB2      LEU  68  -0.018   9.304 -29.997
  522    HB3  LEU  68           HB3      LEU  68   1.603   9.826 -30.415
  523    HG   LEU  68           HG       LEU  68   0.030  10.060 -32.265
  524   HD11  LEU  68          HD11      LEU  68   1.382   9.047 -34.029
  525   HD12  LEU  68          HD12      LEU  68   2.437   9.680 -32.754
  526   HD13  LEU  68          HD13      LEU  68   2.142   7.933 -32.870
  527   HD21  LEU  68          HD21      LEU  68  -1.425   8.131 -31.713
  528   HD22  LEU  68          HD22      LEU  68  -0.944   8.178 -33.420
  529   HD23  LEU  68          HD23      LEU  68  -0.173   7.019 -32.317
  530    H    ALA  69           H        ALA  69   2.168   8.220 -27.582
  531    HA   ALA  69           HA       ALA  69   5.009   7.683 -27.907
  532    HB1  ALA  69           HB1      ALA  69   4.034  10.540 -27.364
  533    HB2  ALA  69           HB2      ALA  69   5.726   9.985 -27.312
  534    HB3  ALA  69           HB3      ALA  69   4.848   9.996 -28.845
  535    H    SER  70           H        SER  70   6.124   8.136 -25.704
  536    HA   SER  70           HA       SER  70   4.358   8.548 -23.425
  537    HB2  SER  70           HB2      SER  70   5.384   6.522 -22.253
  538    HB3  SER  70           HB3      SER  70   4.151   6.205 -23.478
  539    HG   SER  70           HG       SER  70   5.955   4.803 -23.727
  540    H    THR  71           H        THR  71   5.714   8.992 -21.375
  541    HA   THR  71           HA       THR  71   7.932  10.680 -22.046
  542    HB   THR  71           HB       THR  71   8.181  10.614 -19.449
  543    HG1  THR  71           HG1      THR  71   7.029   8.797 -18.947
  544   HG21  THR  71          HG21      THR  71   6.123  12.034 -19.167
  545   HG22  THR  71          HG22      THR  71   7.162  12.508 -20.519
  546   HG23  THR  71          HG23      THR  71   5.673  11.613 -20.838
  547    H    ARG  72           H        ARG  72  10.122  10.381 -21.752
  548    HA   ARG  72           HA       ARG  72  11.019   7.756 -22.380
  549    HB2  ARG  72           HB2      ARG  72  12.412  10.346 -21.630
  550    HB3  ARG  72           HB3      ARG  72  13.331   8.879 -22.004
  551    HG2  ARG  72           HG2      ARG  72  12.291   8.713 -24.216
  552    HG3  ARG  72           HG3      ARG  72  11.302  10.146 -23.910
  553    HD2  ARG  72           HD2      ARG  72  14.346  10.151 -23.870
  554    HD3  ARG  72           HD3      ARG  72  13.384  10.508 -25.315
  555    HE   ARG  72           HE       ARG  72  12.288  12.278 -23.613
  556   HH11  ARG  72          HH11      ARG  72  15.753  11.661 -24.283
  557   HH12  ARG  72          HH12      ARG  72  16.202  13.304 -24.003
  558   HH21  ARG  72          HH21      ARG  72  12.835  14.300 -23.304
  559   HH22  ARG  72          HH22      ARG  72  14.489  14.897 -23.378
  560    H    ASN  73           H        ASN  73  10.674   9.264 -19.216
  561    HA   ASN  73           HA       ASN  73  11.041   6.712 -18.000
  562    HB2  ASN  73           HB2      ASN  73  12.751   7.187 -16.416
  563    HB3  ASN  73           HB3      ASN  73  13.437   7.566 -17.982
  564   HD21  ASN  73          HD22      ASN  73  13.425   9.994 -18.610
  565   HD22  ASN  73          HD21      ASN  73  13.614  11.142 -17.309
  566    H    TRP  74           H        TRP  74  10.548   6.970 -15.522
  567    HA   TRP  74           HA       TRP  74   8.033   8.274 -15.302
  568    HB2  TRP  74           HB2      TRP  74   9.867   7.186 -13.115
  569    HB3  TRP  74           HB3      TRP  74   8.164   7.601 -12.946
  570    HD1  TRP  74           HD1      TRP  74  10.464   4.935 -14.490
  571    HE1  TRP  74           HE1      TRP  74   9.107   2.874 -15.127
  572    HE3  TRP  74           HE3      TRP  74   5.790   6.618 -13.259
  573    HZ2  TRP  74           HZ2      TRP  74   6.334   2.137 -15.357
  574    HZ3  TRP  74           HZ3      TRP  74   3.805   5.212 -13.727
  575    HH2  TRP  74           HH2      TRP  74   4.017   3.044 -14.868
  576    H    LEU  75           H        LEU  75   7.591  10.336 -14.876
  577    HA   LEU  75           HA       LEU  75   9.643  12.245 -13.945
  578    HB2  LEU  75           HB2      LEU  75   6.706  12.463 -14.729
  579    HB3  LEU  75           HB3      LEU  75   7.623  13.822 -14.096
  580    HG   LEU  75           HG       LEU  75   8.325  12.311 -16.650
  581   HD11  LEU  75          HD11      LEU  75   6.961  15.010 -16.247
  582   HD12  LEU  75          HD12      LEU  75   7.419  14.279 -17.811
  583   HD13  LEU  75          HD13      LEU  75   6.190  13.508 -16.789
  584   HD21  LEU  75          HD21      LEU  75   9.437  14.897 -15.454
  585   HD22  LEU  75          HD22      LEU  75  10.330  13.382 -15.708
  586   HD23  LEU  75          HD23      LEU  75   9.775  14.310 -17.101
  587    H    ARG  76           H        ARG  76   9.332  13.426 -11.913
  588    HA   ARG  76           HA       ARG  76   7.192  12.574 -10.152
  589    HB2  ARG  76           HB2      ARG  76   8.572  11.766  -8.311
  590    HB3  ARG  76           HB3      ARG  76   8.593  10.733  -9.706
  591    HG2  ARG  76           HG2      ARG  76  10.728  10.610  -8.941
  592    HG3  ARG  76           HG3      ARG  76  10.875  11.699 -10.311
  593    HD2  ARG  76           HD2      ARG  76  11.179  13.600  -8.867
  594    HD3  ARG  76           HD3      ARG  76  10.574  12.738  -7.453
  595    HE   ARG  76           HE       ARG  76  13.252  12.655  -8.619
  596   HH11  ARG  76          HH21      ARG  76  11.026  10.946  -6.403
  597   HH12  ARG  76          HH22      ARG  76  12.303  10.240  -5.466
  598   HH21  ARG  76          HH11      ARG  76  14.928  11.630  -7.378
  599   HH22  ARG  76          HH12      ARG  76  14.509  10.584  -6.065
  600    H    TYR  77           H        TYR  77   6.879  13.955  -8.368
  601    HA   TYR  77           HA       TYR  77   8.700  16.190  -7.885
  602    HB2  TYR  77           HB2      TYR  77   6.901  17.873  -8.004
  603    HB3  TYR  77           HB3      TYR  77   7.186  17.159  -9.577
  604    HD1  TYR  77           HD1      TYR  77   4.828  17.354  -6.725
  605    HD2  TYR  77           HD2      TYR  77   5.481  15.823 -10.693
  606    HE1  TYR  77           HE1      TYR  77   2.464  16.679  -6.845
  607    HE2  TYR  77           HE2      TYR  77   3.117  15.146 -10.839
  608    HH   TYR  77           HH       TYR  77   1.004  15.145  -9.741
  609    H    LYS  78           H        LYS  78   8.079  17.180  -5.748
  610    HA   LYS  78           HA       LYS  78   6.832  15.085  -4.091
  611    HB2  LYS  78           HB2      LYS  78   7.852  16.002  -2.131
  612    HB3  LYS  78           HB3      LYS  78   9.008  15.549  -3.363
  613    HG2  LYS  78           HG2      LYS  78   9.868  17.444  -2.392
  614    HG3  LYS  78           HG3      LYS  78   9.258  18.001  -3.954
  615    HD2  LYS  78           HD2      LYS  78   7.358  19.103  -2.847
  616    HD3  LYS  78           HD3      LYS  78   7.714  18.271  -1.330
  617    HE2  LYS  78           HE2      LYS  78   8.437  20.541  -1.111
  618    HE3  LYS  78           HE3      LYS  78   9.858  19.499  -1.140
  619    HZ1  LYS  78           HZ1      LYS  78  10.228  20.164  -3.458
  620    HZ2  LYS  78           HZ2      LYS  78   8.872  21.095  -3.456
  621    HZ3  LYS  78           HZ3      LYS  78  10.140  21.481  -2.507
  622    H    LEU  79           H        LEU  79   5.231  15.524  -2.600
  623    HA   LEU  79           HA       LEU  79   3.265  17.505  -3.466
  624    HB2  LEU  79           HB2      LEU  79   3.139  15.743  -0.982
  625    HB3  LEU  79           HB3      LEU  79   1.799  16.526  -1.812
  626    HG   LEU  79           HG       LEU  79   3.450  14.184  -2.794
  627   HD11  LEU  79          HD11      LEU  79   1.821  13.565  -1.077
  628   HD12  LEU  79          HD12      LEU  79   0.514  14.231  -2.084
  629   HD13  LEU  79          HD13      LEU  79   1.457  12.833  -2.643
  630   HD21  LEU  79          HD21      LEU  79   2.843  15.529  -4.752
  631   HD22  LEU  79          HD22      LEU  79   1.926  14.025  -4.722
  632   HD23  LEU  79          HD23      LEU  79   1.141  15.552  -4.228
  633    HA   PRO  80           HA       PRO  80   4.867  20.552  -0.495
  634    HB2  PRO  80           HB2      PRO  80   2.600  22.063  -0.043
  635    HB3  PRO  80           HB3      PRO  80   3.581  22.167  -1.540
  636    HG2  PRO  80           HG2      PRO  80   1.061  20.546  -1.076
  637    HG3  PRO  80           HG3      PRO  80   1.434  21.660  -2.442
  638    HD2  PRO  80           HD2      PRO  80   1.789  18.992  -2.688
  639    HD3  PRO  80           HD3      PRO  80   2.980  20.129  -3.383
  640    H    LYS  81           H        LYS  81   4.643  20.958   1.858
  641    HA   LYS  81           HA       LYS  81   4.443  18.705   3.252
  642    HB2  LYS  81           HB2      LYS  81   5.170  21.245   3.808
  643    HB3  LYS  81           HB3      LYS  81   3.680  21.231   4.740
  644    HG2  LYS  81           HG2      LYS  81   6.055  19.367   4.978
  645    HG3  LYS  81           HG3      LYS  81   5.607  20.682   6.073
  646    HD2  LYS  81           HD2      LYS  81   3.437  19.375   6.565
  647    HD3  LYS  81           HD3      LYS  81   4.125  18.041   5.631
  648    HE2  LYS  81           HE2      LYS  81   4.553  17.556   7.932
  649    HE3  LYS  81           HE3      LYS  81   6.102  18.007   7.206
  650    HZ1  LYS  81           HZ1      LYS  81   5.869  20.200   8.251
  651    HZ2  LYS  81           HZ2      LYS  81   4.403  19.794   8.878
  652    HZ3  LYS  81           HZ3      LYS  81   5.754  19.031   9.379
  653    H    ARG  82           H        ARG  82   1.771  21.040   3.083
  654    HA   ARG  82           HA       ARG  82   0.008  19.694   4.851
  655    HB2  ARG  82           HB2      ARG  82  -1.664  21.276   4.051
  656    HB3  ARG  82           HB3      ARG  82  -0.122  22.069   4.308
  657    HG2  ARG  82           HG2      ARG  82   0.127  21.517   1.622
  658    HG3  ARG  82           HG3      ARG  82  -1.625  21.526   1.759
  659    HD2  ARG  82           HD2      ARG  82  -0.908  23.725   1.134
  660    HD3  ARG  82           HD3      ARG  82  -1.486  23.803   2.808
  661    HE   ARG  82           HE       ARG  82   1.373  23.342   2.726
  662   HH11  ARG  82          HH11      ARG  82  -1.018  25.925   2.183
  663   HH12  ARG  82          HH12      ARG  82   0.061  27.204   2.605
  664   HH21  ARG  82          HH21      ARG  82   2.818  25.066   3.283
  665   HH22  ARG  82          HH22      ARG  82   2.279  26.701   3.220
  666    H    LEU  83           H        LEU  83   0.907  18.795   1.683
  667    HA   LEU  83           HA       LEU  83  -1.521  17.152   1.299
  668    HB2  LEU  83           HB2      LEU  83  -1.029  19.005  -0.343
  669    HB3  LEU  83           HB3      LEU  83   0.470  18.176  -0.753
  670    HG   LEU  83           HG       LEU  83  -0.795  16.279  -1.689
  671   HD11  LEU  83          HD11      LEU  83  -3.291  16.451  -1.918
  672   HD12  LEU  83          HD12      LEU  83  -2.778  16.223  -0.247
  673   HD13  LEU  83          HD13      LEU  83  -3.271  17.837  -0.805
  674   HD21  LEU  83          HD21      LEU  83  -1.805  18.979  -2.646
  675   HD22  LEU  83          HD22      LEU  83  -0.289  18.190  -3.127
  676   HD23  LEU  83          HD23      LEU  83  -1.840  17.459  -3.575
  677    H    VAL  84           H        VAL  84   1.663  16.831   2.502
  678    HA   VAL  84           HA       VAL  84   2.368  14.364   1.167
  679    HB   VAL  84           HB       VAL  84   3.123  15.531   3.872
  680   HG11  VAL  84          HG11      VAL  84   4.843  13.748   4.028
  681   HG12  VAL  84          HG12      VAL  84   3.226  13.051   4.069
  682   HG13  VAL  84          HG13      VAL  84   4.173  12.964   2.583
  683   HG21  VAL  84          HG21      VAL  84   5.323  15.842   2.804
  684   HG22  VAL  84          HG22      VAL  84   4.710  15.134   1.295
  685   HG23  VAL  84          HG23      VAL  84   4.069  16.681   1.880
  686    H    ARG  85           H        ARG  85   1.726  12.342   1.642
  687    HA   ARG  85           HA       ARG  85  -0.720  12.075   3.315
  688    HB2  ARG  85           HB2      ARG  85   0.515  10.335   1.177
  689    HB3  ARG  85           HB3      ARG  85  -0.882   9.843   2.132
  690    HG2  ARG  85           HG2      ARG  85  -0.933  12.491   0.663
  691    HG3  ARG  85           HG3      ARG  85  -1.155  10.995  -0.248
  692    HD2  ARG  85           HD2      ARG  85  -2.826  11.737   2.181
  693    HD3  ARG  85           HD3      ARG  85  -3.280  12.145   0.514
  694    HE   ARG  85           HE       ARG  85  -2.821   9.519   0.248
  695   HH11  ARG  85          HH11      ARG  85  -4.875  11.297   2.549
  696   HH12  ARG  85          HH12      ARG  85  -5.964   9.983   2.811
  697   HH21  ARG  85          HH21      ARG  85  -4.287   7.769   0.594
  698   HH22  ARG  85          HH22      ARG  85  -5.629   7.946   1.661
  699    H    TRP  86           H        TRP  86  -0.291  11.651   5.325
  700    HA   TRP  86           HA       TRP  86   2.153  10.162   6.119
  701    HB2  TRP  86           HB2      TRP  86   0.133  11.730   7.772
  702    HB3  TRP  86           HB3      TRP  86   1.616  11.005   8.372
  703    HD1  TRP  86           HD1      TRP  86   0.346  14.003   6.409
  704    HE1  TRP  86           HE1      TRP  86   2.206  15.704   6.060
  705    HE3  TRP  86           HE3      TRP  86   4.254  11.273   8.278
  706    HZ2  TRP  86           HZ2      TRP  86   5.107  15.793   6.372
  707    HZ3  TRP  86           HZ3      TRP  86   6.552  12.208   8.265
  708    HH2  TRP  86           HH2      TRP  86   6.992  14.454   7.295
  709    H    ASP  87           H        ASP  87  -1.070   9.450   5.406
  710    HA   ASP  87           HA       ASP  87  -1.430   7.359   7.465
  711    HB2  ASP  87           HB2      ASP  87  -3.352   8.743   6.829
  712    HB3  ASP  87           HB3      ASP  87  -3.152   8.279   5.134
  713    H    THR  88           H        THR  88  -0.283   7.805   4.173
  714    HA   THR  88           HA       THR  88  -0.379   5.008   3.404
  715    HB   THR  88           HB       THR  88   1.305   6.077   1.675
  716    HG1  THR  88           HG1      THR  88   1.600   7.993   2.954
  717   HG21  THR  88          HG21      THR  88  -0.516   7.078   0.357
  718   HG22  THR  88          HG22      THR  88  -1.041   5.539   1.069
  719   HG23  THR  88          HG23      THR  88  -1.568   7.081   1.794
  720    H    LYS  89           H        LYS  89   1.253   3.545   3.880
  721    HA   LYS  89           HA       LYS  89   3.719   4.576   5.208
  722    HB2  LYS  89           HB2      LYS  89   2.382   1.928   5.781
  723    HB3  LYS  89           HB3      LYS  89   3.862   2.540   6.502
  724    HG2  LYS  89           HG2      LYS  89   1.075   3.708   6.842
  725    HG3  LYS  89           HG3      LYS  89   1.962   2.731   8.013
  726    HD2  LYS  89           HD2      LYS  89   3.658   4.549   8.230
  727    HD3  LYS  89           HD3      LYS  89   2.705   5.542   7.099
  728    HE2  LYS  89           HE2      LYS  89   0.700   5.198   8.643
  729    HE3  LYS  89           HE3      LYS  89   1.815   4.476   9.809
  730    HZ1  LYS  89           HZ1      LYS  89   3.038   6.629   9.781
  731    HZ2  LYS  89           HZ2      LYS  89   1.859   7.273   8.807
  732    HZ3  LYS  89           HZ3      LYS  89   1.502   6.782  10.318
  733    HA   PRO  90           HA       PRO  90   5.995   4.387   4.997
  734    HB2  PRO  90           HB2      PRO  90   7.726   5.299   3.057
  735    HB3  PRO  90           HB3      PRO  90   7.933   3.749   3.927
  736    HG2  PRO  90           HG2      PRO  90   6.639   4.196   1.213
  737    HG3  PRO  90           HG3      PRO  90   7.909   3.004   1.650
  738    HD2  PRO  90           HD2      PRO  90   5.313   2.258   1.591
  739    HD3  PRO  90           HD3      PRO  90   6.374   1.688   2.907
  740    H    VAL  91           H        VAL  91   6.065   6.655   5.084
  741    HA   VAL  91           HA       VAL  91   3.884   8.179   4.328
  742    HB   VAL  91           HB       VAL  91   6.746   9.065   4.904
  743   HG11  VAL  91          HG11      VAL  91   5.815  11.252   5.525
  744   HG12  VAL  91          HG12      VAL  91   5.483  10.918   3.828
  745   HG13  VAL  91          HG13      VAL  91   4.192  10.734   5.031
  746   HG21  VAL  91          HG21      VAL  91   5.877   9.485   7.202
  747   HG22  VAL  91          HG22      VAL  91   4.304   8.807   6.725
  748   HG23  VAL  91          HG23      VAL  91   5.757   7.781   6.775
  749    H    CYS  92           H        CYS  92   3.287   9.330   2.523
  750    HA   CYS  92           HA       CYS  92   4.924   8.682   0.137
  751    HB2  CYS  92           HB2      CYS  92   2.756   7.570   0.258
  752    HB3  CYS  92           HB3      CYS  92   1.943   9.148   0.305
  753    HG   CYS  92           HG       CYS  92   1.720   8.346  -2.099
  754    H    ILE  93           H        ILE  93   5.991  10.272  -0.598
  755    HA   ILE  93           HA       ILE  93   5.250  13.055   0.088
  756    HB   ILE  93           HB       ILE  93   7.710  13.477  -0.243
  757   HG12  ILE  93          HG12      ILE  93   7.964  10.436  -0.181
  758   HG13  ILE  93          HG13      ILE  93   8.206  11.435  -1.614
  759   HG21  ILE  93          HG21      ILE  93   8.303  12.728   1.975
  760   HG22  ILE  93          HG22      ILE  93   6.617  13.223   1.971
  761   HG23  ILE  93          HG23      ILE  93   7.029  11.488   1.961
  762   HD11  ILE  93          HD11      ILE  93  10.056  12.618  -0.317
  763   HD12  ILE  93          HD12      ILE  93   9.850  11.356   0.937
  764   HD13  ILE  93          HD13      ILE  93  10.344  10.910  -0.703
  765    H    GLY  94           H        GLY  94   5.028  11.096  -2.729
  766    HA2  GLY  94           HA2      GLY  94   4.679  13.493  -4.332
  767    HA3  GLY  94           HA3      GLY  94   6.185  12.688  -4.688
  768    H    GLN  95           H        GLN  95   4.323  12.930  -6.700
  769    HA   GLN  95           HA       GLN  95   3.080  10.216  -6.923
  770    HB2  GLN  95           HB2      GLN  95   2.706  12.549  -8.836
  771    HB3  GLN  95           HB3      GLN  95   1.889  11.004  -8.860
  772    HG2  GLN  95           HG2      GLN  95   1.406  13.385  -7.074
  773    HG3  GLN  95           HG3      GLN  95   0.313  12.586  -8.221
  774   HE21  GLN  95          HE22      GLN  95  -0.341  13.239  -5.405
  775   HE22  GLN  95          HE21      GLN  95  -0.599  11.705  -4.602
  776    H    LYS  96           H        LYS  96   4.378   8.771  -8.001
  777    HA   LYS  96           HA       LYS  96   6.584   9.672  -9.821
  778    HB2  LYS  96           HB2      LYS  96   7.284   7.860  -8.411
  779    HB3  LYS  96           HB3      LYS  96   5.714   7.063  -8.503
  780    HG2  LYS  96           HG2      LYS  96   6.208   6.501 -10.931
  781    HG3  LYS  96           HG3      LYS  96   7.843   7.149 -10.676
  782    HD2  LYS  96           HD2      LYS  96   8.206   5.498  -8.880
  783    HD3  LYS  96           HD3      LYS  96   6.541   4.905  -9.063
  784    HE2  LYS  96           HE2      LYS  96   7.066   4.190 -11.420
  785    HE3  LYS  96           HE3      LYS  96   8.720   4.780 -11.195
  786    HZ1  LYS  96           HZ1      LYS  96   7.453   2.481  -9.819
  787    HZ2  LYS  96           HZ2      LYS  96   8.806   2.486 -10.736
  788    HZ3  LYS  96           HZ3      LYS  96   8.818   3.153  -9.229
  789    H    GLN  97           H        GLN  97   5.905   9.937 -12.015
  790    HA   GLN  97           HA       GLN  97   3.623   8.277 -12.848
  791    HB2  GLN  97           HB2      GLN  97   2.916  10.685 -14.054
  792    HB3  GLN  97           HB3      GLN  97   2.084   9.801 -12.813
  793    HG2  GLN  97           HG2      GLN  97   2.178  12.026 -12.070
  794    HG3  GLN  97           HG3      GLN  97   3.289  11.136 -11.058
  795   HE21  GLN  97          HE22      GLN  97   4.934  12.612 -10.542
  796   HE22  GLN  97          HE21      GLN  97   5.694  13.658 -11.742
  797    H    LYS  98           H        LYS  98   3.595   7.523 -14.794
  798    HA   LYS  98           HA       LYS  98   5.571   8.563 -16.786
  799    HB2  LYS  98           HB2      LYS  98   5.873   6.193 -16.380
  800    HB3  LYS  98           HB3      LYS  98   4.133   5.883 -16.527
  801    HG2  LYS  98           HG2      LYS  98   4.206   6.462 -18.919
  802    HG3  LYS  98           HG3      LYS  98   5.925   6.853 -18.811
  803    HD2  LYS  98           HD2      LYS  98   4.758   4.115 -18.164
  804    HD3  LYS  98           HD3      LYS  98   5.327   4.593 -19.774
  805    HE2  LYS  98           HE2      LYS  98   7.591   5.092 -18.820
  806    HE3  LYS  98           HE3      LYS  98   7.048   4.489 -17.247
  807    HZ1  LYS  98           HZ1      LYS  98   7.195   2.878 -19.750
  808    HZ2  LYS  98           HZ2      LYS  98   8.228   2.781 -18.493
  809    HZ3  LYS  98           HZ3      LYS  98   6.674   2.303 -18.302
  810    H    TRP  99           H        TRP  99   4.648   9.359 -18.730
  811    HA   TRP  99           HA       TRP  99   1.672   9.590 -18.686
  812    HB2  TRP  99           HB2      TRP  99   3.719  11.523 -19.793
  813    HB3  TRP  99           HB3      TRP  99   1.986  11.627 -20.043
  814    HD1  TRP  99           HD1      TRP  99   4.467  11.598 -17.067
  815    HE1  TRP  99           HE1      TRP  99   3.560  13.064 -15.205
  816    HE3  TRP  99           HE3      TRP  99  -0.036  12.913 -19.162
  817    HZ2  TRP  99           HZ2      TRP  99   1.198  14.631 -14.705
  818    HZ3  TRP  99           HZ3      TRP  99  -1.567  14.444 -17.978
  819    HH2  TRP  99           HH2      TRP  99  -0.948  15.305 -15.702
  820    H    PHE 100           H        PHE 100   0.604   8.922 -20.443
  821    HA   PHE 100           HA       PHE 100   2.191   8.002 -22.812
  822    HB2  PHE 100           HB2      PHE 100  -0.445   6.955 -21.724
  823    HB3  PHE 100           HB3      PHE 100   0.218   6.549 -23.299
  824    HD1  PHE 100           HD2      PHE 100   0.884   6.252 -19.611
  825    HD2  PHE 100           HD1      PHE 100   1.888   4.874 -23.580
  826    HE1  PHE 100           HE2      PHE 100   2.103   4.323 -18.641
  827    HE2  PHE 100           HE1      PHE 100   3.138   2.976 -22.601
  828    HZ   PHE 100           HZ       PHE 100   3.232   2.675 -20.140
  829    H    LEU 101           H        LEU 101   1.685   9.032 -24.697
  830    HA   LEU 101           HA       LEU 101  -0.422  11.115 -24.629
  831    HB2  LEU 101           HB2      LEU 101   1.756  11.826 -25.468
  832    HB3  LEU 101           HB3      LEU 101   1.697  10.598 -26.742
  833    HG   LEU 101           HG       LEU 101  -0.620  12.547 -26.452
  834   HD11  LEU 101          HD11      LEU 101   0.633  14.076 -28.060
  835   HD12  LEU 101          HD12      LEU 101   1.221  14.017 -26.395
  836   HD13  LEU 101          HD13      LEU 101   2.091  13.131 -27.693
  837   HD21  LEU 101          HD21      LEU 101  -0.790  10.743 -28.220
  838   HD22  LEU 101          HD22      LEU 101  -0.778  12.371 -28.858
  839   HD23  LEU 101          HD23      LEU 101   0.704  11.394 -28.942
  840    H    LEU 102           H        LEU 102  -2.295  10.689 -25.402
  841    HA   LEU 102           HA       LEU 102  -2.722   8.227 -27.017
  842    HB2  LEU 102           HB2      LEU 102  -4.180   9.479 -24.657
  843    HB3  LEU 102           HB3      LEU 102  -5.130   8.659 -25.868
  844    HG   LEU 102           HG       LEU 102  -4.721   7.128 -24.105
  845   HD11  LEU 102          HD11      LEU 102  -4.081   5.290 -25.413
  846   HD12  LEU 102          HD12      LEU 102  -4.318   6.519 -26.710
  847   HD13  LEU 102          HD13      LEU 102  -2.726   6.171 -26.134
  848   HD21  LEU 102          HD21      LEU 102  -2.634   8.220 -23.211
  849   HD22  LEU 102          HD22      LEU 102  -2.536   6.461 -23.330
  850   HD23  LEU 102          HD23      LEU 102  -1.719   7.461 -24.537
  851    H    GLN 103           H        GLN 103  -3.590   8.602 -29.003
  852    HA   GLN 103           HA       GLN 103  -4.635  11.365 -29.521
  853    HB2  GLN 103           HB2      GLN 103  -4.113   9.049 -31.401
  854    HB3  GLN 103           HB3      GLN 103  -4.963  10.519 -31.877
  855    HG2  GLN 103           HG2      GLN 103  -2.123  10.425 -30.774
  856    HG3  GLN 103           HG3      GLN 103  -2.537  10.540 -32.478
  857   HE21  GLN 103          HE22      GLN 103  -0.828  12.440 -31.248
  858   HE22  GLN 103          HE21      GLN 103  -1.665  13.967 -31.133
  859    H    LEU 104           H        LEU 104  -6.812  11.780 -29.450
  860    HA   LEU 104           HA       LEU 104  -8.594   9.823 -28.390
  861    HB2  LEU 104           HB2      LEU 104  -8.685  12.308 -28.122
  862    HB3  LEU 104           HB3      LEU 104  -9.160  12.449 -29.818
  863    HG   LEU 104           HG       LEU 104 -11.276  11.307 -29.365
  864   HD11  LEU 104          HD11      LEU 104 -11.963  10.882 -26.996
  865   HD12  LEU 104          HD12      LEU 104 -10.695   9.789 -27.528
  866   HD13  LEU 104          HD13      LEU 104 -10.285  11.166 -26.470
  867   HD21  LEU 104          HD21      LEU 104 -11.112  13.751 -29.142
  868   HD22  LEU 104          HD22      LEU 104 -12.222  13.120 -27.905
  869   HD23  LEU 104          HD23      LEU 104 -10.583  13.589 -27.448
  870    H    VAL 105           H        VAL 105  -9.225   8.027 -29.553
  871    HA   VAL 105           HA       VAL 105  -9.502   8.175 -32.497
  872    HB   VAL 105           HB       VAL 105  -9.740   5.899 -30.500
  873   HG11  VAL 105          HG11      VAL 105  -9.965   5.749 -33.520
  874   HG12  VAL 105          HG12      VAL 105  -9.763   4.360 -32.420
  875   HG13  VAL 105          HG13      VAL 105 -11.219   5.344 -32.313
  876   HG21  VAL 105          HG21      VAL 105  -7.412   6.740 -30.894
  877   HG22  VAL 105          HG22      VAL 105  -7.658   5.088 -31.467
  878   HG23  VAL 105          HG23      VAL 105  -7.627   6.439 -32.624
  879    H    SER 106           H        SER 106 -11.468   8.081 -29.486
  880    HA   SER 106           HA       SER 106 -13.950   7.915 -30.996
  881    HB2  SER 106           HB2      SER 106 -14.953   8.003 -28.790
  882    HB3  SER 106           HB3      SER 106 -13.677   6.791 -28.878
  883    HG   SER 106           HG       SER 106 -13.528   8.111 -26.968
  884    H    GLY 107           H        GLY 107 -14.194  10.222 -28.502
  885    HA2  GLY 107           HA2      GLY 107 -13.590  12.689 -29.663
  886    HA3  GLY 107           HA3      GLY 107 -15.179  12.242 -30.287
  887    H    ASP 108           H        ASP 108 -14.837  14.489 -28.583
  888    HA   ASP 108           HA       ASP 108 -15.488  14.155 -25.915
  889    HB2  ASP 108           HB2      ASP 108 -16.212  16.325 -25.914
  890    HB3  ASP 108           HB3      ASP 108 -15.087  16.312 -27.255
  891    H    ALA 109           H        ALA 109 -17.609  13.632 -28.729
  892    HA   ALA 109           HA       ALA 109 -20.083  13.560 -27.295
  893    HB1  ALA 109           HB1      ALA 109 -19.290  12.204 -29.919
  894    HB2  ALA 109           HB2      ALA 109 -20.944  12.484 -29.337
  895    HB3  ALA 109           HB3      ALA 109 -19.914  13.868 -29.753
  896    H    GLU 110           H        GLU 110 -17.475  11.272 -27.442
  897    HA   GLU 110           HA       GLU 110 -19.182   9.003 -26.639
  898    HB2  GLU 110           HB2      GLU 110 -16.503   9.184 -28.026
  899    HB3  GLU 110           HB3      GLU 110 -17.194   7.660 -27.428
  900    HG2  GLU 110           HG2      GLU 110 -19.176   7.988 -28.885
  901    HG3  GLU 110           HG3      GLU 110 -18.487   9.488 -29.508
  902    H    ILE 111           H        ILE 111 -16.592  11.125 -25.691
  903    HA   ILE 111           HA       ILE 111 -15.524   9.757 -23.423
  904    HB   ILE 111           HB       ILE 111 -15.738  12.536 -24.482
  905   HG12  ILE 111          HG12      ILE 111 -13.414  10.924 -23.483
  906   HG13  ILE 111          HG13      ILE 111 -13.938  11.075 -25.175
  907   HG21  ILE 111          HG21      ILE 111 -14.774  12.082 -21.637
  908   HG22  ILE 111          HG22      ILE 111 -14.753  13.619 -22.549
  909   HG23  ILE 111          HG23      ILE 111 -16.283  12.920 -22.080
  910   HD11  ILE 111          HD11      ILE 111 -12.708  13.243 -23.446
  911   HD12  ILE 111          HD12      ILE 111 -12.035  12.478 -24.886
  912   HD13  ILE 111          HD13      ILE 111 -13.448  13.536 -25.047
  913    H    ASN 112           H        ASN 112 -16.522   9.104 -21.637
  914    HA   ASN 112           HA       ASN 112 -19.381   9.758 -21.378
  915    HB2  ASN 112           HB2      ASN 112 -18.645   7.444 -21.360
  916    HB3  ASN 112           HB3      ASN 112 -17.606   7.734 -19.970
  917   HD21  ASN 112          HD22      ASN 112 -19.612   5.693 -19.952
  918   HD22  ASN 112          HD21      ASN 112 -20.782   6.176 -18.740
  919    H    MET 113           H        MET 113 -16.446   9.915 -19.319
  920    HA   MET 113           HA       MET 113 -15.975  10.836 -17.356
  921    HB2  MET 113           HB2      MET 113 -17.824  13.047 -18.339
  922    HB3  MET 113           HB3      MET 113 -16.812  13.165 -16.909
  923    HG2  MET 113           HG2      MET 113 -14.819  12.632 -18.258
  924    HG3  MET 113           HG3      MET 113 -15.833  12.639 -19.707
  925    HE1  MET 113           HE1      MET 113 -13.890  14.393 -20.637
  926    HE2  MET 113           HE2      MET 113 -13.539  15.934 -19.832
  927    HE3  MET 113           HE3      MET 113 -13.100  14.402 -19.047
  928    H    GLN 114           H        GLN 114 -18.942   9.333 -17.560
  929    HA   GLN 114           HA       GLN 114 -19.191   9.618 -14.608
  930    HB2  GLN 114           HB2      GLN 114 -21.518   9.402 -16.559
  931    HB3  GLN 114           HB3      GLN 114 -21.611   9.526 -14.795
  932    HG2  GLN 114           HG2      GLN 114 -20.418  11.781 -15.011
  933    HG3  GLN 114           HG3      GLN 114 -20.683  11.668 -16.753
  934   HE21  GLN 114          HE22      GLN 114 -22.182  12.212 -13.626
  935   HE22  GLN 114          HE21      GLN 114 -23.769  12.652 -14.222
  936    H    THR 115           H        THR 115 -17.656   7.704 -16.103
  937    HA   THR 115           HA       THR 115 -18.953   5.150 -16.169
  938    HB   THR 115           HB       THR 115 -16.293   4.625 -16.020
  939    HG1  THR 115           HG1      THR 115 -15.136   6.405 -16.044
  940   HG21  THR 115          HG21      THR 115 -16.116   4.903 -18.427
  941   HG22  THR 115          HG22      THR 115 -17.739   4.305 -18.046
  942   HG23  THR 115          HG23      THR 115 -17.494   6.027 -18.428
  943    H    SER 116           H        SER 116 -16.759   6.827 -13.892
  944    HA   SER 116           HA       SER 116 -16.478   4.599 -12.190
  945    HB2  SER 116           HB2      SER 116 -15.708   7.296 -11.221
  946    HB3  SER 116           HB3      SER 116 -14.738   5.820 -11.369
  947    HG   SER 116           HG       SER 116 -14.128   7.543 -12.865
  948    H    SER 117           H        SER 117 -19.132   6.582 -12.299
  949    HA   SER 117           HA       SER 117 -20.826   7.205 -11.014
  950    HB2  SER 117           HB2      SER 117 -19.826   5.354  -8.837
  951    HB3  SER 117           HB3      SER 117 -21.449   6.030  -9.026
  952    HG   SER 117           HG       SER 117 -21.303   3.876  -9.847
  953    H    THR 118           H        THR 118 -17.743   7.246  -9.190
  954    HA   THR 118           HA       THR 118 -18.260  10.101  -8.515
  955    HB   THR 118           HB       THR 118 -16.637   9.638  -6.601
  956    HG1  THR 118           HG1      THR 118 -15.927   7.555  -7.088
  957   HG21  THR 118          HG21      THR 118 -19.388   8.316  -6.536
  958   HG22  THR 118          HG22      THR 118 -18.441   8.851  -5.127
  959   HG23  THR 118          HG23      THR 118 -19.053  10.042  -6.286
  960    HA   PRO 119           HA       PRO 119 -14.946   9.326 -11.692
  961    HB2  PRO 119           HB2      PRO 119 -15.617  11.224 -13.503
  962    HB3  PRO 119           HB3      PRO 119 -16.621   9.758 -13.299
  963    HG2  PRO 119           HG2      PRO 119 -17.041  12.485 -12.002
  964    HG3  PRO 119           HG3      PRO 119 -18.232  11.555 -12.958
  965    HD2  PRO 119           HD2      PRO 119 -18.183  11.403 -10.267
  966    HD3  PRO 119           HD3      PRO 119 -18.510   9.953 -11.262
  967    H    GLU 120           H        GLU 120 -13.369  11.095 -12.773
  968    HA   GLU 120           HA       GLU 120 -12.810  13.176 -10.695
  969    HB2  GLU 120           HB2      GLU 120 -10.867  12.030 -12.714
  970    HB3  GLU 120           HB3      GLU 120 -10.593  13.423 -11.678
  971    HG2  GLU 120           HG2      GLU 120 -11.527  11.631  -9.800
  972    HG3  GLU 120           HG3      GLU 120 -10.739  10.524 -10.928
  973    H    PHE 121           H        PHE 121 -13.040  12.776 -14.336
  974    HA   PHE 121           HA       PHE 121 -13.270  15.712 -14.374
  975    HB2  PHE 121           HB2      PHE 121 -13.140  13.715 -16.620
  976    HB3  PHE 121           HB3      PHE 121 -13.267  15.455 -16.806
  977    HD1  PHE 121           HD2      PHE 121 -11.425  16.647 -14.891
  978    HD2  PHE 121           HD1      PHE 121 -10.943  13.058 -17.242
  979    HE1  PHE 121           HE2      PHE 121  -8.976  16.885 -14.749
  980    HE2  PHE 121           HE1      PHE 121  -8.475  13.309 -17.081
  981    HZ   PHE 121           HZ       PHE 121  -7.494  15.215 -15.828
  982    H    ASP 122           H        ASP 122 -14.941  16.833 -15.325
  983    HA   ASP 122           HA       ASP 122 -17.652  15.558 -15.153
  984    HB2  ASP 122           HB2      ASP 122 -17.220  16.696 -13.107
  985    HB3  ASP 122           HB3      ASP 122 -16.510  18.087 -13.925
  986    H    GLY 123           H        GLY 123 -15.528  17.926 -16.793
  987    HA2  GLY 123           HA2      GLY 123 -17.307  17.914 -19.081
  988    HA3  GLY 123           HA3      GLY 123 -17.149  19.514 -18.313
  989    H    TRP 124           H        TRP 124 -16.197  18.456 -20.946
  990    HA   TRP 124           HA       TRP 124 -13.256  18.491 -20.696
  991    HB2  TRP 124           HB2      TRP 124 -13.313  17.790 -23.016
  992    HB3  TRP 124           HB3      TRP 124 -14.348  16.735 -22.065
  993    HD1  TRP 124           HD1      TRP 124 -17.004  16.893 -22.538
  994    HE1  TRP 124           HE1      TRP 124 -18.407  17.926 -24.398
  995    HE3  TRP 124           HE3      TRP 124 -13.352  19.592 -24.891
  996    HZ2  TRP 124           HZ2      TRP 124 -18.015  19.778 -26.609
  997    HZ3  TRP 124           HZ3      TRP 124 -13.895  20.984 -26.878
  998    HH2  TRP 124           HH2      TRP 124 -16.222  21.089 -27.730
  999    H    ARG 125           H        ARG 125 -11.975  19.960 -21.851
 1000    HA   ARG 125           HA       ARG 125 -13.168  21.994 -23.584
 1001    HB2  ARG 125           HB2      ARG 125 -13.335  22.997 -21.300
 1002    HB3  ARG 125           HB3      ARG 125 -11.610  22.775 -21.072
 1003    HG2  ARG 125           HG2      ARG 125 -12.256  25.091 -21.569
 1004    HG3  ARG 125           HG3      ARG 125 -11.094  24.469 -22.720
 1005    HD2  ARG 125           HD2      ARG 125 -14.037  24.305 -23.396
 1006    HD3  ARG 125           HD3      ARG 125 -13.223  25.874 -23.478
 1007    HE   ARG 125           HE       ARG 125 -11.473  24.420 -24.884
 1008   HH11  ARG 125          HH11      ARG 125 -15.011  24.714 -25.254
 1009   HH12  ARG 125          HH12      ARG 125 -14.966  24.489 -26.966
 1010   HH21  ARG 125          HH21      ARG 125 -11.415  24.147 -27.077
 1011   HH22  ARG 125          HH22      ARG 125 -12.857  24.154 -28.046
 1012    H    TRP 126           H        TRP 126 -11.842  21.467 -25.398
 1013    HA   TRP 126           HA       TRP 126  -9.020  20.812 -25.058
 1014    HB2  TRP 126           HB2      TRP 126 -10.485  21.626 -27.569
 1015    HB3  TRP 126           HB3      TRP 126  -9.018  20.671 -27.430
 1016    HD1  TRP 126           HD1      TRP 126 -11.880  19.898 -28.852
 1017    HE1  TRP 126           HE1      TRP 126 -13.049  17.720 -28.262
 1018    HE3  TRP 126           HE3      TRP 126  -9.541  18.894 -24.378
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.050  15.804 -26.072
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.229  16.949 -23.037
 1021    HH2  TRP 126           HH2      TRP 126 -12.008  15.432 -23.833
 1022    H    VAL 127           H        VAL 127  -7.261  22.104 -25.271
 1023    HA   VAL 127           HA       VAL 127  -7.600  25.029 -25.581
 1024    HB   VAL 127           HB       VAL 127  -6.263  25.341 -23.493
 1025   HG11  VAL 127          HG11      VAL 127  -8.876  23.936 -22.889
 1026   HG12  VAL 127          HG12      VAL 127  -8.066  25.180 -21.924
 1027   HG13  VAL 127          HG13      VAL 127  -8.751  25.601 -23.499
 1028   HG21  VAL 127          HG21      VAL 127  -6.876  22.399 -22.953
 1029   HG22  VAL 127          HG22      VAL 127  -5.272  23.088 -23.247
 1030   HG23  VAL 127          HG23      VAL 127  -6.176  23.536 -21.792
 1031    H    SER 128           H        SER 128  -5.462  26.094 -25.857
 1032    HA   SER 128           HA       SER 128  -3.729  24.848 -27.611
 1033    HB2  SER 128           HB2      SER 128  -2.974  27.054 -25.642
 1034    HB3  SER 128           HB3      SER 128  -2.298  26.774 -27.255
 1035    HG   SER 128           HG       SER 128  -3.876  28.448 -27.295
 1036    H    TYR 129           H        TYR 129  -1.474  24.214 -27.353
 1037    HA   TYR 129           HA       TYR 129  -1.350  22.002 -25.694
 1038    HB2  TYR 129           HB2      TYR 129  -0.142  22.697 -27.911
 1039    HB3  TYR 129           HB3      TYR 129   1.163  23.223 -26.839
 1040    HD1  TYR 129           HD2      TYR 129   1.847  21.326 -25.003
 1041    HD2  TYR 129           HD1      TYR 129  -0.131  20.581 -28.773
 1042    HE1  TYR 129           HE2      TYR 129   2.338  18.898 -24.798
 1043    HE2  TYR 129           HE1      TYR 129   0.374  18.170 -28.556
 1044    HH   TYR 129           HH       TYR 129   1.210  16.489 -27.208
 1045    H    TRP 130           H        TRP 130   0.077  25.216 -25.043
 1046    HA   TRP 130           HA       TRP 130   1.336  24.141 -22.602
 1047    HB2  TRP 130           HB2      TRP 130   1.541  26.882 -23.879
 1048    HB3  TRP 130           HB3      TRP 130   2.532  26.260 -22.564
 1049    HD1  TRP 130           HD1      TRP 130   2.132  26.098 -26.328
 1050    HE1  TRP 130           HE1      TRP 130   3.981  24.721 -27.392
 1051    HE3  TRP 130           HE3      TRP 130   4.329  24.302 -22.063
 1052    HZ2  TRP 130           HZ2      TRP 130   6.193  23.039 -26.505
 1053    HZ3  TRP 130           HZ3      TRP 130   6.328  22.828 -22.210
 1054    HH2  TRP 130           HH2      TRP 130   7.261  22.202 -24.419
 1055    H    TYR 131           H        TYR 131  -1.742  25.280 -23.217
 1056    HA   TYR 131           HA       TYR 131  -2.052  27.273 -21.200
 1057    HB2  TYR 131           HB2      TYR 131  -3.622  27.029 -23.031
 1058    HB3  TYR 131           HB3      TYR 131  -4.101  25.441 -22.495
 1059    HD1  TYR 131           HD1      TYR 131  -5.439  25.146 -20.361
 1060    HD2  TYR 131           HD2      TYR 131  -4.499  29.039 -21.987
 1061    HE1  TYR 131           HE1      TYR 131  -7.229  26.152 -18.986
 1062    HE2  TYR 131           HE2      TYR 131  -6.268  30.052 -20.593
 1063    HH   TYR 131           HH       TYR 131  -7.998  29.662 -19.047
 1064    HA   PRO 132           HA       PRO 132  -3.569  23.742 -18.281
 1065    HB2  PRO 132           HB2      PRO 132  -1.775  21.522 -19.226
 1066    HB3  PRO 132           HB3      PRO 132  -3.371  21.417 -18.449
 1067    HG2  PRO 132           HG2      PRO 132  -3.183  21.066 -21.101
 1068    HG3  PRO 132           HG3      PRO 132  -4.480  22.134 -20.461
 1069    HD2  PRO 132           HD2      PRO 132  -1.782  22.940 -21.581
 1070    HD3  PRO 132           HD3      PRO 132  -3.387  23.595 -21.962
 1071    H    VAL 133           H        VAL 133  -0.182  23.790 -19.487
 1072    HA   VAL 133           HA       VAL 133   1.108  23.346 -16.991
 1073    HB   VAL 133           HB       VAL 133   2.106  25.030 -19.334
 1074   HG11  VAL 133          HG11      VAL 133   4.360  24.282 -18.607
 1075   HG12  VAL 133          HG12      VAL 133   3.567  25.258 -17.387
 1076   HG13  VAL 133          HG13      VAL 133   3.630  23.492 -17.183
 1077   HG21  VAL 133          HG21      VAL 133   1.425  22.874 -20.203
 1078   HG22  VAL 133          HG22      VAL 133   3.183  22.939 -20.129
 1079   HG23  VAL 133          HG23      VAL 133   2.280  22.023 -18.891
 1080    H    ARG 134           H        ARG 134  -0.525  26.219 -18.312
 1081    HA   ARG 134           HA       ARG 134   0.838  27.949 -16.295
 1082    HB2  ARG 134           HB2      ARG 134  -0.796  28.446 -18.814
 1083    HB3  ARG 134           HB3      ARG 134  -0.839  29.638 -17.523
 1084    HG2  ARG 134           HG2      ARG 134   0.864  30.333 -19.022
 1085    HG3  ARG 134           HG3      ARG 134   1.611  29.804 -17.521
 1086    HD2  ARG 134           HD2      ARG 134   1.651  27.499 -19.161
 1087    HD3  ARG 134           HD3      ARG 134   1.960  28.797 -20.279
 1088    HE   ARG 134           HE       ARG 134   3.618  27.884 -18.008
 1089   HH11  ARG 134          HH11      ARG 134   3.188  30.450 -20.444
 1090   HH12  ARG 134          HH12      ARG 134   4.819  31.007 -20.344
 1091   HH21  ARG 134          HH21      ARG 134   5.803  28.654 -17.881
 1092   HH22  ARG 134          HH22      ARG 134   6.316  29.977 -18.858
 1093    H    GLN 135           H        GLN 135  -1.939  25.965 -16.777
 1094    HA   GLN 135           HA       GLN 135  -3.587  27.628 -14.989
 1095    HB2  GLN 135           HB2      GLN 135  -4.375  26.729 -17.175
 1096    HB3  GLN 135           HB3      GLN 135  -4.246  25.095 -16.515
 1097    HG2  GLN 135           HG2      GLN 135  -6.526  25.962 -16.501
 1098    HG3  GLN 135           HG3      GLN 135  -5.961  25.584 -14.870
 1099   HE21  GLN 135          HE22      GLN 135  -6.789  28.277 -17.140
 1100   HE22  GLN 135          HE21      GLN 135  -6.876  29.501 -15.902
 1101    H    VAL 136           H        VAL 136  -1.620  24.679 -14.795
 1102    HA   VAL 136           HA       VAL 136  -2.813  23.764 -12.342
 1103    HB   VAL 136           HB       VAL 136  -0.810  22.347 -12.200
 1104   HG11  VAL 136          HG11      VAL 136  -1.310  20.967 -14.150
 1105   HG12  VAL 136          HG12      VAL 136  -2.753  21.557 -13.321
 1106   HG13  VAL 136          HG13      VAL 136  -2.243  22.306 -14.858
 1107   HG21  VAL 136          HG21      VAL 136   0.062  23.554 -14.845
 1108   HG22  VAL 136          HG22      VAL 136   0.824  23.896 -13.289
 1109   HG23  VAL 136          HG23      VAL 136   0.849  22.246 -13.934
 1110    H    VAL 137           H        VAL 137  -1.643  23.552 -10.312
 1111    HA   VAL 137           HA       VAL 137  -0.693  26.040  -9.244
 1112    HB   VAL 137           HB       VAL 137  -0.314  24.666  -7.178
 1113   HG11  VAL 137          HG11      VAL 137  -2.689  24.291  -6.733
 1114   HG12  VAL 137          HG12      VAL 137  -2.464  25.798  -7.633
 1115   HG13  VAL 137          HG13      VAL 137  -3.065  24.351  -8.466
 1116   HG21  VAL 137          HG21      VAL 137   0.184  22.459  -8.197
 1117   HG22  VAL 137          HG22      VAL 137  -1.174  22.371  -7.072
 1118   HG23  VAL 137          HG23      VAL 137  -1.486  22.348  -8.806
 1119    H    SER 138           H        SER 138   1.347  26.495  -8.302
 1120    HA   SER 138           HA       SER 138   3.356  26.367 -10.141
 1121    HB2  SER 138           HB2      SER 138   3.604  26.873  -7.152
 1122    HB3  SER 138           HB3      SER 138   4.665  27.516  -8.423
 1123    HG   SER 138           HG       SER 138   2.849  28.914  -7.617
 1124    H    PHE 139           H        PHE 139   2.974  24.078  -7.384
 1125    HA   PHE 139           HA       PHE 139   5.665  23.071  -7.774
 1126    HB2  PHE 139           HB2      PHE 139   5.160  21.409  -6.141
 1127    HB3  PHE 139           HB3      PHE 139   4.610  22.981  -5.604
 1128    HD1  PHE 139           HD1      PHE 139   2.204  23.455  -5.285
 1129    HD2  PHE 139           HD2      PHE 139   3.601  19.590  -6.609
 1130    HE1  PHE 139           HE1      PHE 139   0.001  22.467  -4.739
 1131    HE2  PHE 139           HE2      PHE 139   1.408  18.601  -6.011
 1132    HZ   PHE 139           HZ       PHE 139  -0.403  20.038  -5.076
 1133    H    LYS 140           H        LYS 140   2.548  22.284  -9.236
 1134    HA   LYS 140           HA       LYS 140   3.662  19.877 -10.565
 1135    HB2  LYS 140           HB2      LYS 140   0.934  21.199 -10.849
 1136    HB3  LYS 140           HB3      LYS 140   1.452  19.684 -11.611
 1137    HG2  LYS 140           HG2      LYS 140   1.920  18.760  -9.301
 1138    HG3  LYS 140           HG3      LYS 140   1.186  20.223  -8.626
 1139    HD2  LYS 140           HD2      LYS 140  -0.935  19.684  -9.858
 1140    HD3  LYS 140           HD3      LYS 140  -0.175  18.165 -10.406
 1141    HE2  LYS 140           HE2      LYS 140   0.173  17.504  -8.012
 1142    HE3  LYS 140           HE3      LYS 140  -0.615  19.002  -7.491
 1143    HZ1  LYS 140           HZ1      LYS 140  -2.676  18.207  -8.553
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.932  16.805  -9.020
 1145    HZ3  LYS 140           HZ3      LYS 140  -2.155  17.137  -7.437
 1146    H    ARG 141           H        ARG 141   2.950  23.272 -11.358
 1147    HA   ARG 141           HA       ARG 141   2.957  23.321 -14.107
 1148    HB2  ARG 141           HB2      ARG 141   2.614  25.267 -12.697
 1149    HB3  ARG 141           HB3      ARG 141   4.307  25.287 -12.193
 1150    HG2  ARG 141           HG2      ARG 141   5.074  26.102 -14.245
 1151    HG3  ARG 141           HG3      ARG 141   3.699  25.463 -15.134
 1152    HD2  ARG 141           HD2      ARG 141   3.507  27.862 -15.068
 1153    HD3  ARG 141           HD3      ARG 141   2.212  27.180 -14.094
 1154    HE   ARG 141           HE       ARG 141   4.717  28.504 -13.137
 1155   HH11  ARG 141          HH11      ARG 141   1.361  27.478 -12.351
 1156   HH12  ARG 141          HH12      ARG 141   1.373  28.287 -10.825
 1157   HH21  ARG 141          HH21      ARG 141   4.653  29.565 -11.111
 1158   HH22  ARG 141          HH22      ARG 141   3.299  29.330 -10.054
 1159    H    ASP 142           H        ASP 142   5.968  23.269 -12.148
 1160    HA   ASP 142           HA       ASP 142   7.657  23.630 -14.402
 1161    HB2  ASP 142           HB2      ASP 142   8.363  24.100 -12.097
 1162    HB3  ASP 142           HB3      ASP 142   8.326  22.373 -11.714
 1163    H    VAL 143           H        VAL 143   6.401  20.642 -12.903
 1164    HA   VAL 143           HA       VAL 143   8.036  18.981 -14.711
 1165    HB   VAL 143           HB       VAL 143   6.059  18.312 -12.505
 1166   HG11  VAL 143          HG11      VAL 143   7.586  16.394 -14.319
 1167   HG12  VAL 143          HG12      VAL 143   6.756  15.936 -12.814
 1168   HG13  VAL 143          HG13      VAL 143   5.818  16.535 -14.186
 1169   HG21  VAL 143          HG21      VAL 143   8.184  17.337 -11.520
 1170   HG22  VAL 143          HG22      VAL 143   9.086  18.023 -12.871
 1171   HG23  VAL 143          HG23      VAL 143   8.242  19.093 -11.730
 1172    H    TYR 144           H        TYR 144   4.641  20.177 -14.547
 1173    HA   TYR 144           HA       TYR 144   3.743  18.487 -16.627
 1174    HB2  TYR 144           HB2      TYR 144   2.426  20.030 -14.995
 1175    HB3  TYR 144           HB3      TYR 144   2.685  21.293 -16.170
 1176    HD1  TYR 144           HD2      TYR 144   2.082  17.887 -17.638
 1177    HD2  TYR 144           HD1      TYR 144   0.178  21.421 -16.023
 1178    HE1  TYR 144           HE2      TYR 144  -0.042  17.068 -18.399
 1179    HE2  TYR 144           HE1      TYR 144  -1.999  20.582 -16.805
 1180    HH   TYR 144           HH       TYR 144  -2.348  17.523 -18.666
 1181    H    ARG 145           H        ARG 145   5.484  21.668 -16.776
 1182    HA   ARG 145           HA       ARG 145   5.455  22.076 -19.513
 1183    HB2  ARG 145           HB2      ARG 145   6.522  23.388 -17.506
 1184    HB3  ARG 145           HB3      ARG 145   7.918  22.321 -17.710
 1185    HG2  ARG 145           HG2      ARG 145   8.002  23.045 -20.124
 1186    HG3  ARG 145           HG3      ARG 145   6.650  24.136 -19.770
 1187    HD2  ARG 145           HD2      ARG 145   8.755  25.392 -19.761
 1188    HD3  ARG 145           HD3      ARG 145   8.062  25.377 -18.145
 1189    HE   ARG 145           HE       ARG 145  10.370  23.743 -19.146
 1190   HH11  ARG 145          HH11      ARG 145   8.774  25.307 -16.354
 1191   HH12  ARG 145          HH12      ARG 145   9.923  24.651 -15.205
 1192   HH21  ARG 145          HH21      ARG 145  11.935  23.052 -17.593
 1193   HH22  ARG 145          HH22      ARG 145  11.747  23.481 -15.927
 1194    H    ARG 146           H        ARG 146   7.420  19.729 -17.639
 1195    HA   ARG 146           HA       ARG 146   9.104  18.955 -19.862
 1196    HB2  ARG 146           HB2      ARG 146   8.490  17.288 -17.380
 1197    HB3  ARG 146           HB3      ARG 146   9.860  17.124 -18.466
 1198    HG2  ARG 146           HG2      ARG 146  10.722  19.349 -17.754
 1199    HG3  ARG 146           HG3      ARG 146   9.313  19.548 -16.707
 1200    HD2  ARG 146           HD2      ARG 146  10.039  17.372 -15.540
 1201    HD3  ARG 146           HD3      ARG 146  11.580  17.581 -16.402
 1202    HE   ARG 146           HE       ARG 146  10.579  19.911 -14.874
 1203   HH11  ARG 146          HH11      ARG 146  12.772  17.088 -14.801
 1204   HH12  ARG 146          HH12      ARG 146  13.663  17.665 -13.440
 1205   HH21  ARG 146          HH21      ARG 146  11.700  20.612 -13.032
 1206   HH22  ARG 146          HH22      ARG 146  13.062  19.716 -12.425
 1207    H    VAL 147           H        VAL 147   6.091  17.566 -18.421
 1208    HA   VAL 147           HA       VAL 147   5.738  15.378 -20.175
 1209    HB   VAL 147           HB       VAL 147   3.588  17.232 -19.072
 1210   HG11  VAL 147          HG11      VAL 147   2.072  15.307 -19.234
 1211   HG12  VAL 147          HG12      VAL 147   2.676  15.779 -20.822
 1212   HG13  VAL 147          HG13      VAL 147   3.355  14.351 -20.006
 1213   HG21  VAL 147          HG21      VAL 147   4.610  14.638 -17.876
 1214   HG22  VAL 147          HG22      VAL 147   4.994  16.249 -17.225
 1215   HG23  VAL 147          HG23      VAL 147   3.330  15.669 -17.218
 1216    H    MET 148           H        MET 148   4.629  18.839 -20.592
 1217    HA   MET 148           HA       MET 148   3.506  18.322 -23.105
 1218    HB2  MET 148           HB2      MET 148   4.670  20.939 -22.102
 1219    HB3  MET 148           HB3      MET 148   3.666  20.761 -23.537
 1220    HG2  MET 148           HG2      MET 148   2.895  20.461 -20.647
 1221    HG3  MET 148           HG3      MET 148   2.291  21.593 -21.852
 1222    HE1  MET 148           HE1      MET 148  -0.148  21.377 -21.071
 1223    HE2  MET 148           HE2      MET 148  -0.935  19.820 -20.762
 1224    HE3  MET 148           HE3      MET 148   0.440  20.332 -19.771
 1225    H    LYS 149           H        LYS 149   6.838  19.496 -22.269
 1226    HA   LYS 149           HA       LYS 149   7.671  19.935 -24.934
 1227    HB2  LYS 149           HB2      LYS 149   8.779  20.792 -22.901
 1228    HB3  LYS 149           HB3      LYS 149   9.352  19.177 -22.491
 1229    HG2  LYS 149           HG2      LYS 149  10.052  20.425 -25.175
 1230    HG3  LYS 149           HG3      LYS 149  10.886  20.943 -23.709
 1231    HD2  LYS 149           HD2      LYS 149  11.534  18.556 -23.257
 1232    HD3  LYS 149           HD3      LYS 149  10.904  18.097 -24.830
 1233    HE2  LYS 149           HE2      LYS 149  13.104  20.159 -24.342
 1234    HE3  LYS 149           HE3      LYS 149  13.370  18.471 -24.775
 1235    HZ1  LYS 149           HZ1      LYS 149  12.059  20.502 -26.497
 1236    HZ2  LYS 149           HZ2      LYS 149  13.520  19.822 -26.723
 1237    HZ3  LYS 149           HZ3      LYS 149  12.179  18.907 -26.879
 1238    H    GLU 150           H        GLU 150   7.705  16.920 -22.997
 1239    HA   GLU 150           HA       GLU 150   9.233  15.320 -24.777
 1240    HB2  GLU 150           HB2      GLU 150   6.984  14.678 -22.825
 1241    HB3  GLU 150           HB3      GLU 150   7.808  13.429 -23.734
 1242    HG2  GLU 150           HG2      GLU 150   9.459  15.367 -22.094
 1243    HG3  GLU 150           HG3      GLU 150   8.586  14.073 -21.294
 1244    H    PHE 151           H        PHE 151   5.983  16.646 -25.187
 1245    HA   PHE 151           HA       PHE 151   5.479  14.719 -27.413
 1246    HB2  PHE 151           HB2      PHE 151   3.572  15.913 -25.398
 1247    HB3  PHE 151           HB3      PHE 151   3.160  14.842 -26.729
 1248    HD1  PHE 151           HD2      PHE 151   5.238  12.683 -26.486
 1249    HD2  PHE 151           HD1      PHE 151   2.990  14.779 -23.464
 1250    HE1  PHE 151           HE2      PHE 151   5.481  10.761 -24.967
 1251    HE2  PHE 151           HE1      PHE 151   3.204  12.822 -21.951
 1252    HZ   PHE 151           HZ       PHE 151   4.419  10.803 -22.705
 1253    H    ALA 152           H        ALA 152   5.620  18.124 -26.710
 1254    HA   ALA 152           HA       ALA 152   3.504  19.173 -27.971
 1255    HB1  ALA 152           HB1      ALA 152   5.217  20.518 -26.859
 1256    HB2  ALA 152           HB2      ALA 152   6.348  20.246 -28.211
 1257    HB3  ALA 152           HB3      ALA 152   4.851  21.173 -28.465
 1258    H    SER 153           H        SER 153   6.486  18.244 -29.828
 1259    HA   SER 153           HA       SER 153   5.450  19.048 -32.305
 1260    HB2  SER 153           HB2      SER 153   7.442  16.803 -31.935
 1261    HB3  SER 153           HB3      SER 153   7.293  17.943 -33.285
 1262    HG   SER 153           HG       SER 153   9.003  18.536 -31.840
 1263    H    VAL 154           H        VAL 154   4.466  16.223 -30.473
 1264    HA   VAL 154           HA       VAL 154   4.018  14.492 -32.728
 1265    HB   VAL 154           HB       VAL 154   2.807  14.406 -29.936
 1266   HG11  VAL 154          HG11      VAL 154   3.104  12.237 -32.052
 1267   HG12  VAL 154          HG12      VAL 154   2.574  11.972 -30.376
 1268   HG13  VAL 154          HG13      VAL 154   1.582  12.948 -31.473
 1269   HG21  VAL 154          HG21      VAL 154   4.602  12.774 -29.421
 1270   HG22  VAL 154          HG22      VAL 154   5.318  13.045 -31.026
 1271   HG23  VAL 154          HG23      VAL 154   5.292  14.342 -29.819
 1272    H    VAL 155           H        VAL 155   2.015  17.031 -31.119
 1273    HA   VAL 155           HA       VAL 155  -0.261  16.352 -32.873
 1274    HB   VAL 155           HB       VAL 155   0.261  18.625 -30.939
 1275   HG11  VAL 155          HG11      VAL 155  -1.072  19.620 -32.728
 1276   HG12  VAL 155          HG12      VAL 155  -2.163  18.213 -32.749
 1277   HG13  VAL 155          HG13      VAL 155  -2.121  19.303 -31.350
 1278   HG21  VAL 155          HG21      VAL 155  -1.827  16.384 -31.029
 1279   HG22  VAL 155          HG22      VAL 155  -0.346  16.340 -30.039
 1280   HG23  VAL 155          HG23      VAL 155  -1.599  17.546 -29.714
 1281    H    MET 156           H        MET 156   2.647  18.391 -33.035
 1282    HA   MET 156           HA       MET 156   1.689  19.913 -35.293
 1283    HB2  MET 156           HB2      MET 156   4.589  19.334 -34.573
 1284    HB3  MET 156           HB3      MET 156   3.979  20.595 -35.636
 1285    HG2  MET 156           HG2      MET 156   3.563  20.387 -32.639
 1286    HG3  MET 156           HG3      MET 156   4.564  21.556 -33.495
 1287    HE1  MET 156           HE1      MET 156   1.646  23.660 -31.848
 1288    HE2  MET 156           HE2      MET 156   2.345  22.158 -31.198
 1289    HE3  MET 156           HE3      MET 156   3.400  23.397 -31.920
 1290    H    SER 157           H        SER 157   3.106  16.637 -34.981
 1291    HA   SER 157           HA       SER 157   3.683  16.113 -37.678
 1292    HB2  SER 157           HB2      SER 157   2.250  14.295 -35.698
 1293    HB3  SER 157           HB3      SER 157   3.205  13.778 -37.089
 1294    HG   SER 157           HG       SER 157   5.080  14.577 -36.059
 1295    H    LEU 158           H        LEU 158   0.575  16.212 -35.968
 1296    HA   LEU 158           HA       LEU 158  -0.984  15.234 -38.233
 1297    HB2  LEU 158           HB2      LEU 158  -1.652  16.349 -35.483
 1298    HB3  LEU 158           HB3      LEU 158  -2.890  16.128 -36.718
 1299    HG   LEU 158           HG       LEU 158  -2.467  13.724 -36.802
 1300   HD11  LEU 158          HD11      LEU 158  -0.505  14.177 -34.515
 1301   HD12  LEU 158          HD12      LEU 158  -1.127  12.599 -35.025
 1302   HD13  LEU 158          HD13      LEU 158  -0.107  13.524 -36.125
 1303   HD21  LEU 158          HD21      LEU 158  -2.911  14.856 -33.998
 1304   HD22  LEU 158          HD22      LEU 158  -4.144  14.683 -35.277
 1305   HD23  LEU 158          HD23      LEU 158  -3.407  13.236 -34.559
 1306    H    GLN 159           H        GLN 159  -0.547  18.397 -36.532
 1307    HA   GLN 159           HA       GLN 159  -2.322  19.696 -38.404
 1308    HB2  GLN 159           HB2      GLN 159  -0.521  20.955 -36.291
 1309    HB3  GLN 159           HB3      GLN 159  -1.885  21.721 -37.110
 1310    HG2  GLN 159           HG2      GLN 159  -1.951  19.499 -35.066
 1311    HG3  GLN 159           HG3      GLN 159  -2.686  21.085 -34.959
 1312   HE21  GLN 159          HE22      GLN 159  -3.649  18.024 -35.036
 1313   HE22  GLN 159          HE21      GLN 159  -4.973  18.060 -36.171
 1314    H    GLU 160           H        GLU 160   0.981  18.967 -38.705
 1315    HA   GLU 160           HA       GLU 160   1.491  21.092 -40.681
 1316    HB2  GLU 160           HB2      GLU 160   3.289  20.211 -39.209
 1317    HB3  GLU 160           HB3      GLU 160   3.110  18.614 -39.955
 1318    HG2  GLU 160           HG2      GLU 160   3.818  19.529 -42.126
 1319    HG3  GLU 160           HG3      GLU 160   3.831  21.170 -41.463
 1320    H    ASN 161           H        ASN 161   0.087  17.879 -40.627
 1321    HA   ASN 161           HA       ASN 161   0.723  17.271 -43.398
 1322    HB2  ASN 161           HB2      ASN 161   0.303  15.187 -42.810
 1323    HB3  ASN 161           HB3      ASN 161   0.015  15.717 -41.165
 1324   HD21  ASN 161          HD22      ASN 161  -2.355  16.372 -40.645
 1325   HD22  ASN 161          HD21      ASN 161  -3.605  15.446 -41.451
 1326    H    THR 162           H        THR 162  -1.930  18.908 -41.744
 1327    HA   THR 162           HA       THR 162  -3.799  18.672 -43.847
 1328    HB   THR 162           HB       THR 162  -4.603  20.898 -42.501
 1329    HG1  THR 162           HG1      THR 162  -3.982  20.693 -40.371
 1330   HG21  THR 162          HG21      THR 162  -4.878  17.994 -41.576
 1331   HG22  THR 162          HG22      THR 162  -5.933  19.348 -41.104
 1332   HG23  THR 162          HG23      THR 162  -5.894  18.810 -42.787
 1333    HA   PRO 163           HA       PRO 163  -2.132  22.694 -45.656
 1334    HB2  PRO 163           HB2      PRO 163   0.119  23.921 -44.692
 1335    HB3  PRO 163           HB3      PRO 163  -1.521  24.214 -44.041
 1336    HG2  PRO 163           HG2      PRO 163   0.604  22.337 -42.969
 1337    HG3  PRO 163           HG3      PRO 163  -0.378  23.529 -42.062
 1338    HD2  PRO 163           HD2      PRO 163  -1.086  20.885 -42.182
 1339    HD3  PRO 163           HD3      PRO 163  -2.316  22.163 -42.190
 1340    H    LYS 164           H        LYS 164   0.354  20.441 -44.461
 1341    HA   LYS 164           HA       LYS 164   2.262  19.678 -45.290
 1342    HB2  LYS 164           HB2      LYS 164   2.215  18.425 -47.362
 1343    HB3  LYS 164           HB3      LYS 164   0.913  18.022 -46.277
 1344    HG2  LYS 164           HG2      LYS 164   0.415  19.963 -48.561
 1345    HG3  LYS 164           HG3      LYS 164   0.521  18.236 -48.880
 1346    HD2  LYS 164           HD2      LYS 164  -1.353  17.701 -47.544
 1347    HD3  LYS 164           HD3      LYS 164  -1.330  19.261 -46.728
 1348    HE2  LYS 164           HE2      LYS 164  -1.873  20.380 -48.911
 1349    HE3  LYS 164           HE3      LYS 164  -2.064  18.777 -49.642
 1350    HZ1  LYS 164           HZ1      LYS 164  -3.641  19.793 -47.326
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.181  19.737 -48.878
 1352    HZ3  LYS 164           HZ3      LYS 164  -3.865  18.347 -48.083
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1  -0.644   0.980  -1.228
    2    H2   MET   1           H2       MET   1   0.647   1.718  -0.544
    3    H3   MET   1           H3       MET   1  -0.574   2.615  -1.165
    4    HA   MET   1           HA       MET   1   1.239   0.875  -2.727
    5    HB2  MET   1           HB2      MET   1  -1.098   1.002  -3.631
    6    HB3  MET   1           HB3      MET   1  -0.943   2.755  -3.759
    7    HG2  MET   1           HG2      MET   1  -0.593   1.722  -5.907
    8    HG3  MET   1           HG3      MET   1   0.912   2.462  -5.385
    9    HE1  MET   1           HE1      MET   1   2.007  -0.633  -7.579
   10    HE2  MET   1           HE2      MET   1   0.556   0.364  -7.803
   11    HE3  MET   1           HE3      MET   1   2.109   1.127  -7.374
   12    H    ILE   2           H        ILE   2   3.144   1.941  -1.786
   13    HA   ILE   2           HA       ILE   2   3.617   4.636  -2.925
   14    HB   ILE   2           HB       ILE   2   4.108   3.733  -0.068
   15   HG12  ILE   2          HG12      ILE   2   1.936   4.852  -0.466
   16   HG13  ILE   2          HG13      ILE   2   2.980   5.742   0.620
   17   HG21  ILE   2          HG21      ILE   2   5.332   5.923   0.261
   18   HG22  ILE   2          HG22      ILE   2   6.211   4.691  -0.638
   19   HG23  ILE   2          HG23      ILE   2   5.453   6.037  -1.517
   20   HD11  ILE   2          HD11      ILE   2   1.832   7.277  -0.882
   21   HD12  ILE   2          HD12      ILE   2   3.570   7.334  -1.217
   22   HD13  ILE   2          HD13      ILE   2   2.477   6.446  -2.300
   23    H    ASP   3           H        ASP   3   5.716   4.917  -3.627
   24    HA   ASP   3           HA       ASP   3   7.178   2.546  -4.471
   25    HB2  ASP   3           HB2      ASP   3   6.574   4.653  -5.774
   26    HB3  ASP   3           HB3      ASP   3   7.833   5.456  -4.839
   27    H    ASP   4           H        ASP   4   7.187   2.852  -1.802
   28    HA   ASP   4           HA       ASP   4   8.215   2.804   0.161
   29    HB2  ASP   4           HB2      ASP   4   9.609   1.216  -0.984
   30    HB3  ASP   4           HB3      ASP   4  10.736   2.491  -1.472
   31    H    ASP   5           H        ASP   5   9.668   5.287  -1.916
   32    HA   ASP   5           HA       ASP   5  10.852   6.612   0.369
   33    HB2  ASP   5           HB2      ASP   5  12.036   6.230  -1.787
   34    HB3  ASP   5           HB3      ASP   5  10.965   7.407  -2.545
   35    H    GLY   6           H        GLY   6   7.821   6.635  -0.262
   36    HA2  GLY   6           HA2      GLY   6   6.214   8.092   0.629
   37    HA3  GLY   6           HA3      GLY   6   7.332   9.442   0.498
   38    H    TYR   7           H        TYR   7   7.132   7.484  -2.392
   39    HA   TYR   7           HA       TYR   7   5.659   9.704  -3.692
   40    HB2  TYR   7           HB2      TYR   7   7.750   7.767  -4.718
   41    HB3  TYR   7           HB3      TYR   7   6.717   8.699  -5.804
   42    HD1  TYR   7           HD1      TYR   7   9.208   9.026  -3.043
   43    HD2  TYR   7           HD2      TYR   7   7.080  11.027  -6.212
   44    HE1  TYR   7           HE1      TYR   7  10.457  11.070  -2.559
   45    HE2  TYR   7           HE2      TYR   7   8.319  13.093  -5.746
   46    HH   TYR   7           HH       TYR   7  10.001  14.126  -4.444
   47    H    ARG   8           H        ARG   8   3.847   9.363  -4.854
   48    HA   ARG   8           HA       ARG   8   2.591   6.660  -4.546
   49    HB2  ARG   8           HB2      ARG   8   1.392   8.560  -3.669
   50    HB3  ARG   8           HB3      ARG   8   1.438   9.390  -5.223
   51    HG2  ARG   8           HG2      ARG   8  -0.768   8.479  -4.778
   52    HG3  ARG   8           HG3      ARG   8  -0.073   7.691  -6.193
   53    HD2  ARG   8           HD2      ARG   8   0.456   5.695  -4.888
   54    HD3  ARG   8           HD3      ARG   8  -0.054   6.468  -3.392
   55    HE   ARG   8           HE       ARG   8  -1.714   5.367  -5.561
   56   HH11  ARG   8          HH21      ARG   8  -1.782   7.315  -2.565
   57   HH12  ARG   8          HH22      ARG   8  -3.463   7.043  -2.281
   58   HH21  ARG   8          HH11      ARG   8  -3.953   5.005  -5.139
   59   HH22  ARG   8          HH12      ARG   8  -4.705   5.721  -3.767
   60    HA   PRO   9           HA       PRO   9   3.603   6.220  -8.953
   61    HB2  PRO   9           HB2      PRO   9   2.299   3.527  -8.591
   62    HB3  PRO   9           HB3      PRO   9   3.876   3.936  -9.342
   63    HG2  PRO   9           HG2      PRO   9   3.784   2.837  -6.869
   64    HG3  PRO   9           HG3      PRO   9   4.912   4.184  -7.226
   65    HD2  PRO   9           HD2      PRO   9   2.177   4.340  -5.911
   66    HD3  PRO   9           HD3      PRO   9   3.734   5.032  -5.374
   67    H    ASN  10           H        ASN  10   2.324   7.124 -10.506
   68    HA   ASN  10           HA       ASN  10  -0.457   6.242 -10.890
   69    HB2  ASN  10           HB2      ASN  10  -1.298   8.573 -11.107
   70    HB3  ASN  10           HB3      ASN  10  -0.819   8.208  -9.451
   71   HD21  ASN  10          HD21      ASN  10   1.360   8.930  -8.808
   72   HD22  ASN  10          HD22      ASN  10   2.137  10.227  -9.669
   73    H    VAL  11           H        VAL  11  -1.257   7.051 -13.009
   74    HA   VAL  11           HA       VAL  11   0.941   7.542 -14.964
   75    HB   VAL  11           HB       VAL  11  -0.473   6.151 -16.530
   76   HG11  VAL  11          HG11      VAL  11   1.685   5.412 -15.547
   77   HG12  VAL  11          HG12      VAL  11   0.806   4.714 -14.169
   78   HG13  VAL  11          HG13      VAL  11   0.554   4.072 -15.804
   79   HG21  VAL  11          HG21      VAL  11  -1.751   5.152 -13.918
   80   HG22  VAL  11          HG22      VAL  11  -2.583   5.901 -15.303
   81   HG23  VAL  11          HG23      VAL  11  -1.788   4.325 -15.455
   82    H    GLY  12           H        GLY  12   0.489   9.265 -16.342
   83    HA2  GLY  12           HA2      GLY  12  -2.207  10.545 -16.165
   84    HA3  GLY  12           HA3      GLY  12  -0.707  11.371 -16.581
   85    H    ILE  13           H        ILE  13  -3.495  10.547 -18.019
   86    HA   ILE  13           HA       ILE  13  -2.348   9.475 -20.540
   87    HB   ILE  13           HB       ILE  13  -5.233  10.010 -19.662
   88   HG12  ILE  13          HG12      ILE  13  -5.423   7.506 -20.312
   89   HG13  ILE  13          HG13      ILE  13  -3.666   7.480 -20.286
   90   HG21  ILE  13          HG21      ILE  13  -4.276   8.826 -22.294
   91   HG22  ILE  13          HG22      ILE  13  -5.949   9.146 -21.799
   92   HG23  ILE  13          HG23      ILE  13  -4.852  10.486 -22.118
   93   HD11  ILE  13          HD11      ILE  13  -3.708   7.937 -17.852
   94   HD12  ILE  13          HD12      ILE  13  -5.491   8.107 -17.926
   95   HD13  ILE  13          HD13      ILE  13  -4.716   6.563 -18.290
   96    H    VAL  14           H        VAL  14  -1.428  11.006 -21.807
   97    HA   VAL  14           HA       VAL  14  -2.529  13.764 -21.810
   98    HB   VAL  14           HB       VAL  14  -0.228  12.594 -23.440
   99   HG11  VAL  14          HG11      VAL  14   0.365  14.921 -23.877
  100   HG12  VAL  14          HG12      VAL  14  -1.283  14.621 -24.423
  101   HG13  VAL  14          HG13      VAL  14  -1.000  15.492 -22.895
  102   HG21  VAL  14          HG21      VAL  14  -0.156  14.153 -20.831
  103   HG22  VAL  14          HG22      VAL  14   0.445  12.494 -21.136
  104   HG23  VAL  14          HG23      VAL  14   1.240  13.879 -21.886
  105    H    ILE  15           H        ILE  15  -4.677  13.051 -22.534
  106    HA   ILE  15           HA       ILE  15  -4.984  11.730 -25.103
  107    HB   ILE  15           HB       ILE  15  -6.863  13.690 -23.710
  108   HG12  ILE  15          HG12      ILE  15  -6.722  11.583 -22.489
  109   HG13  ILE  15          HG13      ILE  15  -8.301  11.819 -23.208
  110   HG21  ILE  15          HG21      ILE  15  -8.617  12.834 -25.310
  111   HG22  ILE  15          HG22      ILE  15  -7.418  13.900 -26.009
  112   HG23  ILE  15          HG23      ILE  15  -7.290  12.145 -26.286
  113   HD11  ILE  15          HD11      ILE  15  -7.756  10.259 -25.065
  114   HD12  ILE  15          HD12      ILE  15  -6.140  10.008 -24.381
  115   HD13  ILE  15          HD13      ILE  15  -7.585   9.486 -23.486
  116    H    CYS  16           H        CYS  16  -4.824  12.536 -27.088
  117    HA   CYS  16           HA       CYS  16  -4.700  15.498 -27.463
  118    HB2  CYS  16           HB2      CYS  16  -3.032  13.352 -28.866
  119    HB3  CYS  16           HB3      CYS  16  -3.191  15.038 -29.432
  120    HG   CYS  16           HG       CYS  16  -2.168  13.938 -26.474
  121    H    ASN  17           H        ASN  17  -6.493  16.087 -28.655
  122    HA   ASN  17           HA       ASN  17  -8.162  13.877 -29.691
  123    HB2  ASN  17           HB2      ASN  17  -9.028  15.750 -28.194
  124    HB3  ASN  17           HB3      ASN  17  -8.934  16.800 -29.603
  125   HD21  ASN  17          HD22      ASN  17 -10.018  15.337 -31.735
  126   HD22  ASN  17          HD21      ASN  17 -11.612  14.753 -31.308
  127    H    ARG  18           H        ARG  18  -6.020  13.875 -31.229
  128    HA   ARG  18           HA       ARG  18  -4.850  14.456 -33.060
  129    HB2  ARG  18           HB2      ARG  18  -5.977  13.432 -34.991
  130    HB3  ARG  18           HB3      ARG  18  -6.026  12.488 -33.497
  131    HG2  ARG  18           HG2      ARG  18  -8.313  13.120 -33.069
  132    HG3  ARG  18           HG3      ARG  18  -8.315  14.217 -34.482
  133    HD2  ARG  18           HD2      ARG  18  -7.852  12.278 -35.960
  134    HD3  ARG  18           HD3      ARG  18  -7.894  11.185 -34.582
  135    HE   ARG  18           HE       ARG  18 -10.160  12.707 -35.786
  136   HH11  ARG  18          HH11      ARG  18  -9.247  10.142 -33.430
  137   HH12  ARG  18          HH12      ARG  18 -10.788   9.357 -33.542
  138   HH21  ARG  18          HH22      ARG  18 -12.211  11.715 -35.770
  139   HH22  ARG  18          HH21      ARG  18 -12.515  10.328 -34.794
  140    H    GLN  19           H        GLN  19  -6.301  16.912 -32.166
  141    HA   GLN  19           HA       GLN  19  -6.193  18.342 -34.759
  142    HB2  GLN  19           HB2      GLN  19  -7.565  18.958 -32.126
  143    HB3  GLN  19           HB3      GLN  19  -7.476  20.131 -33.438
  144    HG2  GLN  19           HG2      GLN  19  -8.813  18.836 -34.901
  145    HG3  GLN  19           HG3      GLN  19  -8.698  17.390 -33.904
  146   HE21  GLN  19          HE22      GLN  19  -9.592  17.553 -31.650
  147   HE22  GLN  19          HE21      GLN  19 -10.988  18.583 -31.341
  148    H    GLY  20           H        GLY  20  -3.927  17.631 -32.531
  149    HA2  GLY  20           HA2      GLY  20  -1.906  18.719 -32.021
  150    HA3  GLY  20           HA3      GLY  20  -2.471  20.183 -32.815
  151    H    GLN  21           H        GLN  21  -4.421  18.593 -30.338
  152    HA   GLN  21           HA       GLN  21  -4.081  20.941 -28.543
  153    HB2  GLN  21           HB2      GLN  21  -6.781  19.754 -29.254
  154    HB3  GLN  21           HB3      GLN  21  -6.454  21.203 -28.320
  155    HG2  GLN  21           HG2      GLN  21  -6.237  20.783 -31.293
  156    HG3  GLN  21           HG3      GLN  21  -7.285  21.880 -30.429
  157   HE21  GLN  21          HE22      GLN  21  -4.817  22.032 -32.580
  158   HE22  GLN  21          HE21      GLN  21  -3.993  23.453 -31.995
  159    H    VAL  22           H        VAL  22  -4.632  20.393 -26.335
  160    HA   VAL  22           HA       VAL  22  -4.173  17.474 -25.848
  161    HB   VAL  22           HB       VAL  22  -2.868  18.166 -23.874
  162   HG11  VAL  22          HG11      VAL  22  -0.895  18.920 -25.118
  163   HG12  VAL  22          HG12      VAL  22  -1.754  17.630 -25.974
  164   HG13  VAL  22          HG13      VAL  22  -1.914  19.311 -26.520
  165   HG21  VAL  22          HG21      VAL  22  -2.130  20.457 -23.581
  166   HG22  VAL  22          HG22      VAL  22  -3.146  21.011 -24.931
  167   HG23  VAL  22          HG23      VAL  22  -3.888  20.369 -23.451
  168    H    MET  23           H        MET  23  -4.674  16.623 -23.802
  169    HA   MET  23           HA       MET  23  -7.305  16.760 -22.999
  170    HB2  MET  23           HB2      MET  23  -5.573  14.947 -22.557
  171    HB3  MET  23           HB3      MET  23  -4.895  15.936 -21.287
  172    HG2  MET  23           HG2      MET  23  -6.396  14.215 -20.400
  173    HG3  MET  23           HG3      MET  23  -6.996  15.835 -20.025
  174    HE1  MET  23           HE1      MET  23 -10.354  13.856 -20.480
  175    HE2  MET  23           HE2      MET  23  -8.854  13.171 -19.798
  176    HE3  MET  23           HE3      MET  23  -9.353  14.832 -19.381
  177    H    TRP  24           H        TRP  24  -8.459  18.148 -21.722
  178    HA   TRP  24           HA       TRP  24  -7.372  19.135 -19.262
  179    HB2  TRP  24           HB2      TRP  24  -6.639  20.854 -21.072
  180    HB3  TRP  24           HB3      TRP  24  -8.331  21.279 -21.213
  181    HD1  TRP  24           HD1      TRP  24  -8.625  23.499 -20.054
  182    HE1  TRP  24           HE1      TRP  24  -7.942  24.595 -17.859
  183    HE3  TRP  24           HE3      TRP  24  -5.496  19.849 -18.264
  184    HZ2  TRP  24           HZ2      TRP  24  -6.306  23.948 -15.561
  185    HZ3  TRP  24           HZ3      TRP  24  -4.388  20.126 -16.069
  186    HH2  TRP  24           HH2      TRP  24  -4.795  22.162 -14.700
  187    H    ALA  25           H        ALA  25  -9.146  18.603 -17.914
  188    HA   ALA  25           HA       ALA  25 -11.878  18.855 -19.091
  189    HB1  ALA  25           HB1      ALA  25 -11.263  16.597 -19.597
  190    HB2  ALA  25           HB2      ALA  25 -10.600  16.340 -17.968
  191    HB3  ALA  25           HB3      ALA  25 -12.346  16.540 -18.192
  192    H    ARG  26           H        ARG  26 -13.553  18.914 -17.683
  193    HA   ARG  26           HA       ARG  26 -12.976  20.488 -15.305
  194    HB2  ARG  26           HB2      ARG  26 -14.855  20.860 -17.116
  195    HB3  ARG  26           HB3      ARG  26 -15.740  19.627 -16.220
  196    HG2  ARG  26           HG2      ARG  26 -15.355  21.014 -14.117
  197    HG3  ARG  26           HG3      ARG  26 -14.538  22.208 -15.139
  198    HD2  ARG  26           HD2      ARG  26 -16.717  23.033 -14.772
  199    HD3  ARG  26           HD3      ARG  26 -16.690  22.455 -16.448
  200    HE   ARG  26           HE       ARG  26 -17.636  20.272 -15.005
  201   HH11  ARG  26          HH11      ARG  26 -18.702  23.663 -15.404
  202   HH12  ARG  26          HH12      ARG  26 -20.370  23.304 -15.165
  203   HH21  ARG  26          HH21      ARG  26 -19.835  19.800 -14.770
  204   HH22  ARG  26          HH22      ARG  26 -21.036  21.056 -14.772
  205    H    ARG  27           H        ARG  27 -13.264  19.802 -13.189
  206    HA   ARG  27           HA       ARG  27 -13.174  16.920 -12.944
  207    HB2  ARG  27           HB2      ARG  27 -11.579  18.727 -11.983
  208    HB3  ARG  27           HB3      ARG  27 -12.742  18.889 -10.684
  209    HG2  ARG  27           HG2      ARG  27 -11.263  16.332 -11.480
  210    HG3  ARG  27           HG3      ARG  27 -10.816  17.440 -10.182
  211    HD2  ARG  27           HD2      ARG  27 -12.925  16.944  -9.005
  212    HD3  ARG  27           HD3      ARG  27 -13.311  15.731 -10.253
  213    HE   ARG  27           HE       ARG  27 -10.804  15.000  -9.420
  214   HH11  ARG  27          HH11      ARG  27 -14.013  15.312  -7.891
  215   HH12  ARG  27          HH12      ARG  27 -13.629  14.218  -6.596
  216   HH21  ARG  27          HH21      ARG  27 -10.336  13.581  -7.874
  217   HH22  ARG  27          HH22      ARG  27 -11.432  13.158  -6.577
  218    H    PHE  28           H        PHE  28 -14.712  15.637 -12.131
  219    HA   PHE  28           HA       PHE  28 -17.383  16.354 -11.483
  220    HB2  PHE  28           HB2      PHE  28 -16.919  14.132 -12.198
  221    HB3  PHE  28           HB3      PHE  28 -15.578  13.949 -11.081
  222    HD1  PHE  28           HD1      PHE  28 -19.274  13.894 -11.364
  223    HD2  PHE  28           HD2      PHE  28 -15.848  13.251  -8.812
  224    HE1  PHE  28           HE1      PHE  28 -20.714  12.697  -9.727
  225    HE2  PHE  28           HE2      PHE  28 -17.304  12.060  -7.174
  226    HZ   PHE  28           HZ       PHE  28 -19.735  11.788  -7.635
  227    H    GLY  29           H        GLY  29 -18.357  16.973  -9.584
  228    HA2  GLY  29           HA2      GLY  29 -18.717  17.269  -7.350
  229    HA3  GLY  29           HA3      GLY  29 -17.287  16.294  -7.001
  230    H    GLN  30           H        GLN  30 -16.415  18.843  -9.056
  231    HA   GLN  30           HA       GLN  30 -15.810  20.775  -6.879
  232    HB2  GLN  30           HB2      GLN  30 -13.856  19.342  -7.120
  233    HB3  GLN  30           HB3      GLN  30 -13.880  19.515  -8.878
  234    HG2  GLN  30           HG2      GLN  30 -13.338  21.892  -8.686
  235    HG3  GLN  30           HG3      GLN  30 -13.428  21.800  -6.923
  236   HE21  GLN  30          HE22      GLN  30 -11.446  20.941  -9.801
  237   HE22  GLN  30          HE21      GLN  30 -10.039  20.478  -8.878
  238    H    HIS  31           H        HIS  31 -16.016  20.021 -10.367
  239    HA   HIS  31           HA       HIS  31 -16.616  21.112 -12.156
  240    HB2  HIS  31           HB2      HIS  31 -18.317  22.866 -10.388
  241    HB3  HIS  31           HB3      HIS  31 -18.571  22.479 -12.091
  242    HD1  HIS  31           HD1      HIS  31 -20.092  21.496  -9.030
  243    HD2  HIS  31           HD2      HIS  31 -18.283  19.348 -12.172
  244    HE1  HIS  31           HE1      HIS  31 -20.905  19.095  -8.825
  245    H    SER  32           H        SER  32 -14.187  21.740 -11.219
  246    HA   SER  32           HA       SER  32 -13.675  24.232 -12.690
  247    HB2  SER  32           HB2      SER  32 -12.152  23.457 -10.156
  248    HB3  SER  32           HB3      SER  32 -11.882  24.882 -11.172
  249    HG   SER  32           HG       SER  32 -13.127  25.395  -9.304
  250    H    TRP  33           H        TRP  33 -11.350  24.048 -13.607
  251    HA   TRP  33           HA       TRP  33 -11.227  21.410 -14.800
  252    HB2  TRP  33           HB2      TRP  33 -10.305  24.116 -15.416
  253    HB3  TRP  33           HB3      TRP  33  -9.072  22.912 -15.727
  254    HD1  TRP  33           HD1      TRP  33  -9.324  21.372 -17.689
  255    HE1  TRP  33           HE1      TRP  33 -10.984  21.021 -19.601
  256    HE3  TRP  33           HE3      TRP  33 -13.127  24.410 -16.073
  257    HZ2  TRP  33           HZ2      TRP  33 -13.700  21.638 -20.169
  258    HZ3  TRP  33           HZ3      TRP  33 -15.272  24.455 -17.322
  259    HH2  TRP  33           HH2      TRP  33 -15.566  23.001 -19.357
  260    H    GLN  34           H        GLN  34  -9.476  19.936 -14.914
  261    HA   GLN  34           HA       GLN  34  -7.256  20.267 -13.027
  262    HB2  GLN  34           HB2      GLN  34  -9.295  19.168 -11.828
  263    HB3  GLN  34           HB3      GLN  34  -9.004  17.778 -12.872
  264    HG2  GLN  34           HG2      GLN  34  -6.592  17.776 -11.845
  265    HG3  GLN  34           HG3      GLN  34  -7.208  18.952 -10.703
  266   HE21  GLN  34          HE22      GLN  34  -7.634  15.601 -11.968
  267   HE22  GLN  34          HE21      GLN  34  -8.433  14.965 -10.522
  268    H    PHE  35           H        PHE  35  -5.719  18.606 -13.245
  269    HA   PHE  35           HA       PHE  35  -5.127  17.560 -15.898
  270    HB2  PHE  35           HB2      PHE  35  -3.088  16.710 -14.467
  271    HB3  PHE  35           HB3      PHE  35  -3.263  18.437 -14.700
  272    HD1  PHE  35           HD1      PHE  35  -3.741  15.661 -12.246
  273    HD2  PHE  35           HD2      PHE  35  -3.747  19.930 -12.846
  274    HE1  PHE  35           HE1      PHE  35  -4.024  16.004  -9.807
  275    HE2  PHE  35           HE2      PHE  35  -3.989  20.271 -10.400
  276    HZ   PHE  35           HZ       PHE  35  -4.168  18.312  -8.880
  277    HA   PRO  36           HA       PRO  36  -6.578  13.398 -14.807
  278    HB2  PRO  36           HB2      PRO  36  -4.969  11.744 -16.239
  279    HB3  PRO  36           HB3      PRO  36  -6.094  12.891 -17.007
  280    HG2  PRO  36           HG2      PRO  36  -3.121  13.279 -16.497
  281    HG3  PRO  36           HG3      PRO  36  -4.025  13.535 -18.022
  282    HD2  PRO  36           HD2      PRO  36  -3.463  15.581 -16.312
  283    HD3  PRO  36           HD3      PRO  36  -4.976  15.531 -17.250
  284    H    GLN  37           H        GLN  37  -3.717  11.655 -14.878
  285    HA   GLN  37           HA       GLN  37  -2.189  10.815 -13.393
  286    HB2  GLN  37           HB2      GLN  37  -2.813  13.060 -11.489
  287    HB3  GLN  37           HB3      GLN  37  -1.576  11.831 -11.377
  288    HG2  GLN  37           HG2      GLN  37  -0.509  12.701 -13.459
  289    HG3  GLN  37           HG3      GLN  37  -1.735  13.979 -13.535
  290   HE21  GLN  37          HE22      GLN  37   0.621  12.539 -11.202
  291   HE22  GLN  37          HE21      GLN  37   1.038  14.092 -10.445
  292    H    GLY  38           H        GLY  38  -3.124   8.887 -13.096
  293    HA2  GLY  38           HA2      GLY  38  -5.105   8.569 -10.859
  294    HA3  GLY  38           HA3      GLY  38  -5.187   7.680 -12.376
  295    H    GLY  39           H        GLY  39  -4.304   7.317  -9.246
  296    HA2  GLY  39           HA2      GLY  39  -1.854   6.163  -9.026
  297    HA3  GLY  39           HA3      GLY  39  -3.269   5.703  -8.082
  298    H    ILE  40           H        ILE  40  -1.017   4.160  -9.173
  299    HA   ILE  40           HA       ILE  40  -2.127   2.368 -11.200
  300    HB   ILE  40           HB       ILE  40   0.417   2.391  -9.544
  301   HG12  ILE  40          HG12      ILE  40  -0.178   3.000 -12.486
  302   HG13  ILE  40          HG13      ILE  40   0.231   4.168 -11.236
  303   HG21  ILE  40          HG21      ILE  40  -0.152   0.028 -10.103
  304   HG22  ILE  40          HG22      ILE  40  -0.225   0.476 -11.820
  305   HG23  ILE  40          HG23      ILE  40   1.298   0.570 -10.921
  306   HD11  ILE  40          HD11      ILE  40   2.206   3.894 -12.453
  307   HD12  ILE  40          HD12      ILE  40   2.477   2.924 -10.997
  308   HD13  ILE  40          HD13      ILE  40   2.051   2.128 -12.529
  309    H    ASN  41           H        ASN  41  -3.059   0.355 -10.831
  310    HA   ASN  41           HA       ASN  41  -4.010  -0.189  -8.119
  311    HB2  ASN  41           HB2      ASN  41  -5.564  -0.513  -9.975
  312    HB3  ASN  41           HB3      ASN  41  -4.437  -1.613 -10.765
  313   HD21  ASN  41          HD22      ASN  41  -6.563  -1.247  -7.871
  314   HD22  ASN  41          HD21      ASN  41  -6.678  -2.960  -7.566
  315    HA   PRO  42           HA       PRO  42  -0.472  -2.484  -7.123
  316    HB2  PRO  42           HB2      PRO  42  -2.259  -4.193  -5.370
  317    HB3  PRO  42           HB3      PRO  42  -0.675  -3.449  -4.977
  318    HG2  PRO  42           HG2      PRO  42  -2.966  -2.279  -4.141
  319    HG3  PRO  42           HG3      PRO  42  -1.662  -1.266  -4.840
  320    HD2  PRO  42           HD2      PRO  42  -4.178  -2.285  -6.186
  321    HD3  PRO  42           HD3      PRO  42  -3.439  -0.656  -6.227
  322    H    GLY  43           H        GLY  43   0.427  -3.670  -8.552
  323    HA2  GLY  43           HA2      GLY  43   1.196  -5.734  -9.374
  324    HA3  GLY  43           HA3      GLY  43  -0.333  -6.507  -8.925
  325    H    GLU  44           H        GLU  44  -1.137  -3.621 -10.470
  326    HA   GLU  44           HA       GLU  44  -1.414  -4.919 -13.161
  327    HB2  GLU  44           HB2      GLU  44  -3.464  -4.042 -12.074
  328    HB3  GLU  44           HB3      GLU  44  -2.719  -2.429 -11.998
  329    HG2  GLU  44           HG2      GLU  44  -2.591  -2.294 -14.389
  330    HG3  GLU  44           HG3      GLU  44  -3.065  -3.991 -14.567
  331    H    SER  45           H        SER  45   0.249  -4.434 -14.554
  332    HA   SER  45           HA       SER  45   2.161  -2.452 -13.865
  333    HB2  SER  45           HB2      SER  45   2.323  -3.450 -16.617
  334    HB3  SER  45           HB3      SER  45   3.524  -3.368 -15.341
  335    HG   SER  45           HG       SER  45   3.143  -5.521 -15.550
  336    H    ALA  46           H        ALA  46   3.003  -0.891 -15.441
  337    HA   ALA  46           HA       ALA  46   1.602   1.379 -15.169
  338    HB1  ALA  46           HB1      ALA  46   3.994   1.136 -15.752
  339    HB2  ALA  46           HB2      ALA  46   3.531   0.618 -17.392
  340    HB3  ALA  46           HB3      ALA  46   3.189   2.298 -16.841
  341    H    GLU  47           H        GLU  47   1.330  -0.717 -18.122
  342    HA   GLU  47           HA       GLU  47  -0.031   1.521 -19.466
  343    HB2  GLU  47           HB2      GLU  47   0.010   0.327 -21.472
  344    HB3  GLU  47           HB3      GLU  47   1.620   0.255 -20.780
  345    HG2  GLU  47           HG2      GLU  47  -0.423  -2.011 -20.788
  346    HG3  GLU  47           HG3      GLU  47   0.939  -1.847 -21.880
  347    H    GLN  48           H        GLN  48  -0.656  -1.781 -18.241
  348    HA   GLN  48           HA       GLN  48  -3.442  -1.925 -18.751
  349    HB2  GLN  48           HB2      GLN  48  -1.812  -3.017 -16.425
  350    HB3  GLN  48           HB3      GLN  48  -3.455  -3.508 -16.828
  351    HG2  GLN  48           HG2      GLN  48  -2.807  -4.801 -18.606
  352    HG3  GLN  48           HG3      GLN  48  -1.453  -3.772 -19.048
  353   HE21  GLN  48          HE22      GLN  48   0.555  -3.845 -17.786
  354   HE22  GLN  48          HE21      GLN  48   0.912  -5.206 -16.757
  355    H    ALA  49           H        ALA  49  -1.668  -0.447 -15.991
  356    HA   ALA  49           HA       ALA  49  -3.982   0.513 -14.600
  357    HB1  ALA  49           HB1      ALA  49  -2.340   1.896 -13.386
  358    HB2  ALA  49           HB2      ALA  49  -1.812   0.195 -13.499
  359    HB3  ALA  49           HB3      ALA  49  -1.084   1.443 -14.552
  360    H    MET  50           H        MET  50  -2.020   1.872 -17.286
  361    HA   MET  50           HA       MET  50  -3.143   4.513 -17.108
  362    HB2  MET  50           HB2      MET  50  -1.061   4.098 -18.239
  363    HB3  MET  50           HB3      MET  50  -1.808   3.016 -19.395
  364    HG2  MET  50           HG2      MET  50  -2.563   5.918 -19.118
  365    HG3  MET  50           HG3      MET  50  -1.326   5.325 -20.212
  366    HE1  MET  50           HE1      MET  50  -3.156   3.479 -23.025
  367    HE2  MET  50           HE2      MET  50  -1.624   4.134 -22.413
  368    HE3  MET  50           HE3      MET  50  -2.372   2.722 -21.620
  369    H    TYR  51           H        TYR  51  -4.243   1.530 -18.842
  370    HA   TYR  51           HA       TYR  51  -6.582   2.901 -19.707
  371    HB2  TYR  51           HB2      TYR  51  -6.330  -0.062 -19.190
  372    HB3  TYR  51           HB3      TYR  51  -7.582   0.780 -20.100
  373    HD1  TYR  51           HD2      TYR  51  -7.049   1.859 -22.316
  374    HD2  TYR  51           HD1      TYR  51  -4.156  -0.378 -20.099
  375    HE1  TYR  51           HE2      TYR  51  -5.752   1.526 -24.382
  376    HE2  TYR  51           HE1      TYR  51  -2.711  -0.597 -22.098
  377    HH   TYR  51           HH       TYR  51  -2.626  -0.290 -24.461
  378    H    ARG  52           H        ARG  52  -5.852   1.274 -16.599
  379    HA   ARG  52           HA       ARG  52  -8.502   1.273 -15.536
  380    HB2  ARG  52           HB2      ARG  52  -6.364   0.248 -14.530
  381    HB3  ARG  52           HB3      ARG  52  -5.950   1.859 -13.969
  382    HG2  ARG  52           HG2      ARG  52  -6.890   0.800 -12.114
  383    HG3  ARG  52           HG3      ARG  52  -8.106   1.937 -12.676
  384    HD2  ARG  52           HD2      ARG  52  -9.120  -0.177 -12.021
  385    HD3  ARG  52           HD3      ARG  52  -9.346   0.064 -13.764
  386    HE   ARG  52           HE       ARG  52  -6.938  -1.432 -13.336
  387   HH11  ARG  52          HH21      ARG  52 -10.428  -1.935 -12.737
  388   HH12  ARG  52          HH22      ARG  52 -10.364  -3.631 -13.058
  389   HH21  ARG  52          HH11      ARG  52  -6.914  -3.597 -13.960
  390   HH22  ARG  52          HH12      ARG  52  -8.297  -4.625 -13.694
  391    H    ALA  53           H        ALA  53  -5.948   3.842 -15.516
  392    HA   ALA  53           HA       ALA  53  -7.550   5.815 -14.217
  393    HB1  ALA  53           HB1      ALA  53  -5.101   5.933 -14.294
  394    HB2  ALA  53           HB2      ALA  53  -5.140   6.073 -16.062
  395    HB3  ALA  53           HB3      ALA  53  -5.811   7.372 -15.053
  396    H    LEU  54           H        LEU  54  -6.996   5.090 -17.697
  397    HA   LEU  54           HA       LEU  54  -8.290   7.225 -18.939
  398    HB2  LEU  54           HB2      LEU  54  -6.967   5.409 -20.002
  399    HB3  LEU  54           HB3      LEU  54  -8.247   4.273 -19.571
  400    HG   LEU  54           HG       LEU  54  -9.794   5.336 -21.166
  401   HD11  LEU  54          HD11      LEU  54  -8.819   6.859 -22.875
  402   HD12  LEU  54          HD12      LEU  54  -8.768   7.609 -21.269
  403   HD13  LEU  54          HD13      LEU  54  -7.287   6.903 -21.967
  404   HD21  LEU  54          HD21      LEU  54  -8.736   4.333 -23.072
  405   HD22  LEU  54          HD22      LEU  54  -7.164   4.291 -22.201
  406   HD23  LEU  54          HD23      LEU  54  -8.575   3.367 -21.602
  407    H    PHE  55           H        PHE  55  -9.684   4.161 -17.769
  408    HA   PHE  55           HA       PHE  55 -12.389   4.855 -18.448
  409    HB2  PHE  55           HB2      PHE  55 -12.429   2.645 -18.404
  410    HB3  PHE  55           HB3      PHE  55 -10.972   2.522 -17.451
  411    HD1  PHE  55           HD1      PHE  55 -14.662   2.996 -17.182
  412    HD2  PHE  55           HD2      PHE  55 -11.002   1.950 -15.165
  413    HE1  PHE  55           HE1      PHE  55 -15.974   2.219 -15.211
  414    HE2  PHE  55           HE2      PHE  55 -12.314   1.130 -13.209
  415    HZ   PHE  55           HZ       PHE  55 -14.800   1.248 -13.240
  416    H    GLU  56           H        GLU  56 -10.692   4.889 -15.191
  417    HA   GLU  56           HA       GLU  56 -13.070   5.750 -13.879
  418    HB2  GLU  56           HB2      GLU  56 -10.142   5.933 -13.049
  419    HB3  GLU  56           HB3      GLU  56 -11.492   6.414 -12.020
  420    HG2  GLU  56           HG2      GLU  56 -12.449   4.095 -12.247
  421    HG3  GLU  56           HG3      GLU  56 -10.967   3.610 -13.071
  422    H    GLU  57           H        GLU  57 -10.567   7.592 -15.553
  423    HA   GLU  57           HA       GLU  57 -11.479  10.145 -14.434
  424    HB2  GLU  57           HB2      GLU  57  -9.369   9.530 -16.523
  425    HB3  GLU  57           HB3      GLU  57  -9.668  11.093 -15.771
  426    HG2  GLU  57           HG2      GLU  57  -9.004  10.251 -13.588
  427    HG3  GLU  57           HG3      GLU  57  -8.754   8.630 -14.234
  428    H    VAL  58           H        VAL  58 -11.062   8.786 -17.761
  429    HA   VAL  58           HA       VAL  58 -12.720  10.983 -18.767
  430    HB   VAL  58           HB       VAL  58 -11.346   8.994 -20.561
  431   HG11  VAL  58          HG11      VAL  58 -11.631  12.027 -20.641
  432   HG12  VAL  58          HG12      VAL  58 -10.964  11.004 -21.931
  433   HG13  VAL  58          HG13      VAL  58 -12.670  10.876 -21.482
  434   HG21  VAL  58          HG21      VAL  58  -9.810  11.121 -18.975
  435   HG22  VAL  58          HG22      VAL  58  -9.500   9.368 -19.001
  436   HG23  VAL  58          HG23      VAL  58  -9.206  10.327 -20.445
  437    H    GLY  59           H        GLY  59 -13.087   7.583 -18.097
  438    HA2  GLY  59           HA2      GLY  59 -14.801   6.115 -18.578
  439    HA3  GLY  59           HA3      GLY  59 -15.809   7.482 -19.069
  440    H    LEU  60           H        LEU  60 -12.772   5.949 -20.158
  441    HA   LEU  60           HA       LEU  60 -13.860   5.272 -22.802
  442    HB2  LEU  60           HB2      LEU  60 -11.219   6.681 -22.196
  443    HB3  LEU  60           HB3      LEU  60 -11.496   5.784 -23.677
  444    HG   LEU  60           HG       LEU  60 -12.904   8.306 -22.755
  445   HD11  LEU  60          HD11      LEU  60 -10.599   8.624 -23.595
  446   HD12  LEU  60          HD12      LEU  60 -10.998   7.720 -25.079
  447   HD13  LEU  60          HD13      LEU  60 -11.742   9.285 -24.772
  448   HD21  LEU  60          HD21      LEU  60 -13.382   6.677 -25.295
  449   HD22  LEU  60          HD22      LEU  60 -14.557   7.017 -24.016
  450   HD23  LEU  60          HD23      LEU  60 -13.972   8.325 -25.042
  451    H    SER  61           H        SER  61 -12.622   3.338 -23.623
  452    HA   SER  61           HA       SER  61 -11.559   1.780 -21.290
  453    HB2  SER  61           HB2      SER  61 -13.309   0.859 -23.584
  454    HB3  SER  61           HB3      SER  61 -12.826  -0.082 -22.152
  455    HG   SER  61           HG       SER  61 -14.926   0.757 -21.882
  456    H    ARG  62           H        ARG  62 -10.705  -0.487 -22.544
  457    HA   ARG  62           HA       ARG  62  -8.155   0.383 -23.465
  458    HB2  ARG  62           HB2      ARG  62  -9.082  -2.511 -23.411
  459    HB3  ARG  62           HB3      ARG  62  -7.453  -1.862 -23.231
  460    HG2  ARG  62           HG2      ARG  62  -8.581  -0.722 -21.078
  461    HG3  ARG  62           HG3      ARG  62  -9.695  -2.068 -21.223
  462    HD2  ARG  62           HD2      ARG  62  -7.846  -3.672 -21.046
  463    HD3  ARG  62           HD3      ARG  62  -6.662  -2.349 -21.053
  464    HE   ARG  62           HE       ARG  62  -8.571  -1.967 -18.943
  465   HH11  ARG  62          HH11      ARG  62  -5.896  -4.177 -19.700
  466   HH12  ARG  62          HH12      ARG  62  -5.447  -4.406 -18.045
  467   HH21  ARG  62          HH21      ARG  62  -7.854  -2.137 -16.770
  468   HH22  ARG  62          HH22      ARG  62  -6.444  -3.053 -16.355
  469    H    LYS  63           H        LYS  63  -9.741   1.361 -25.339
  470    HA   LYS  63           HA       LYS  63  -9.033  -0.032 -27.832
  471    HB2  LYS  63           HB2      LYS  63 -11.339  -0.513 -28.508
  472    HB3  LYS  63           HB3      LYS  63 -10.946  -1.353 -27.001
  473    HG2  LYS  63           HG2      LYS  63 -12.158   0.361 -25.698
  474    HG3  LYS  63           HG3      LYS  63 -12.551   1.227 -27.193
  475    HD2  LYS  63           HD2      LYS  63 -13.972  -0.538 -27.967
  476    HD3  LYS  63           HD3      LYS  63 -13.409  -1.640 -26.708
  477    HE2  LYS  63           HE2      LYS  63 -15.632  -0.769 -26.165
  478    HE3  LYS  63           HE3      LYS  63 -14.434  -0.305 -24.955
  479    HZ1  LYS  63           HZ1      LYS  63 -15.959   1.513 -25.592
  480    HZ2  LYS  63           HZ2      LYS  63 -14.406   1.939 -25.875
  481    HZ3  LYS  63           HZ3      LYS  63 -15.390   1.502 -27.121
  482    H    ASP  64           H        ASP  64 -10.503   2.694 -26.101
  483    HA   ASP  64           HA       ASP  64 -11.409   3.986 -28.551
  484    HB2  ASP  64           HB2      ASP  64 -11.303   4.885 -25.654
  485    HB3  ASP  64           HB3      ASP  64 -12.116   5.754 -26.954
  486    H    VAL  65           H        VAL  65  -8.340   3.649 -27.449
  487    HA   VAL  65           HA       VAL  65  -7.421   6.229 -28.481
  488    HB   VAL  65           HB       VAL  65  -6.098   6.695 -26.484
  489   HG11  VAL  65          HG11      VAL  65  -7.810   7.633 -25.095
  490   HG12  VAL  65          HG12      VAL  65  -8.396   7.714 -26.772
  491   HG13  VAL  65          HG13      VAL  65  -9.019   6.474 -25.676
  492   HG21  VAL  65          HG21      VAL  65  -6.532   5.596 -24.326
  493   HG22  VAL  65          HG22      VAL  65  -7.689   4.487 -25.093
  494   HG23  VAL  65          HG23      VAL  65  -5.966   4.399 -25.495
  495    H    ARG  66           H        ARG  66  -4.978   6.220 -28.562
  496    HA   ARG  66           HA       ARG  66  -3.860   3.535 -29.267
  497    HB2  ARG  66           HB2      ARG  66  -4.793   4.398 -31.305
  498    HB3  ARG  66           HB3      ARG  66  -4.350   6.051 -30.910
  499    HG2  ARG  66           HG2      ARG  66  -2.978   5.404 -32.673
  500    HG3  ARG  66           HG3      ARG  66  -1.965   5.527 -31.253
  501    HD2  ARG  66           HD2      ARG  66  -3.112   2.810 -31.928
  502    HD3  ARG  66           HD3      ARG  66  -1.916   3.459 -33.047
  503    HE   ARG  66           HE       ARG  66  -0.592   3.807 -30.722
  504   HH11  ARG  66          HH11      ARG  66  -2.149   0.925 -32.133
  505   HH12  ARG  66          HH12      ARG  66  -0.971  -0.167 -31.497
  506   HH21  ARG  66          HH21      ARG  66   0.945   2.396 -29.926
  507   HH22  ARG  66          HH22      ARG  66   0.835   0.688 -30.204
  508    H    ILE  67           H        ILE  67  -1.892   3.439 -28.110
  509    HA   ILE  67           HA       ILE  67  -0.721   5.847 -26.983
  510    HB   ILE  67           HB       ILE  67   0.314   2.992 -27.102
  511   HG12  ILE  67          HG12      ILE  67  -1.057   4.375 -24.748
  512   HG13  ILE  67          HG13      ILE  67  -1.965   3.396 -25.892
  513   HG21  ILE  67          HG21      ILE  67   1.132   5.352 -25.342
  514   HG22  ILE  67          HG22      ILE  67   1.765   3.691 -25.216
  515   HG23  ILE  67          HG23      ILE  67   2.102   4.630 -26.658
  516   HD11  ILE  67          HD11      ILE  67  -0.455   1.449 -25.390
  517   HD12  ILE  67          HD12      ILE  67   0.301   2.421 -24.099
  518   HD13  ILE  67          HD13      ILE  67  -1.412   2.002 -24.010
  519    H    LEU  68           H        LEU  68   0.709   7.156 -27.864
  520    HA   LEU  68           HA       LEU  68   2.058   6.300 -30.417
  521    HB2  LEU  68           HB2      LEU  68   0.753   8.815 -29.594
  522    HB3  LEU  68           HB3      LEU  68   2.395   9.086 -30.142
  523    HG   LEU  68           HG       LEU  68   0.676   9.345 -31.897
  524   HD11  LEU  68          HD11      LEU  68   3.016   8.826 -32.515
  525   HD12  LEU  68          HD12      LEU  68   2.647   7.088 -32.479
  526   HD13  LEU  68          HD13      LEU  68   1.857   8.140 -33.669
  527   HD21  LEU  68          HD21      LEU  68  -0.486   7.487 -32.871
  528   HD22  LEU  68          HD22      LEU  68   0.338   6.318 -31.828
  529   HD23  LEU  68          HD23      LEU  68  -0.816   7.474 -31.126
  530    H    ALA  69           H        ALA  69   2.618   7.686 -27.169
  531    HA   ALA  69           HA       ALA  69   5.394   6.821 -27.242
  532    HB1  ALA  69           HB1      ALA  69   4.708   9.815 -27.045
  533    HB2  ALA  69           HB2      ALA  69   6.314   9.100 -26.799
  534    HB3  ALA  69           HB3      ALA  69   5.559   9.044 -28.400
  535    H    SER  70           H        SER  70   6.392   7.377 -25.003
  536    HA   SER  70           HA       SER  70   4.505   8.245 -22.977
  537    HB2  SER  70           HB2      SER  70   4.889   6.378 -21.462
  538    HB3  SER  70           HB3      SER  70   4.073   5.849 -22.937
  539    HG   SER  70           HG       SER  70   5.980   4.941 -23.685
  540    H    THR  71           H        THR  71   5.777   8.774 -20.861
  541    HA   THR  71           HA       THR  71   8.159  10.165 -21.606
  542    HB   THR  71           HB       THR  71   8.410  10.377 -19.047
  543    HG1  THR  71           HG1      THR  71   7.253   8.736 -18.242
  544   HG21  THR  71          HG21      THR  71   5.821  11.254 -20.401
  545   HG22  THR  71          HG22      THR  71   6.442  11.876 -18.848
  546   HG23  THR  71          HG23      THR  71   7.355  12.141 -20.343
  547    H    ARG  72           H        ARG  72  10.310   9.665 -21.381
  548    HA   ARG  72           HA       ARG  72  10.914   6.950 -21.877
  549    HB2  ARG  72           HB2      ARG  72  12.626   9.389 -21.279
  550    HB3  ARG  72           HB3      ARG  72  13.332   7.819 -21.702
  551    HG2  ARG  72           HG2      ARG  72  12.140   7.787 -23.841
  552    HG3  ARG  72           HG3      ARG  72  11.339   9.318 -23.476
  553    HD2  ARG  72           HD2      ARG  72  14.360   8.958 -23.673
  554    HD3  ARG  72           HD3      ARG  72  13.330   9.503 -25.006
  555    HE   ARG  72           HE       ARG  72  12.587  11.359 -23.341
  556   HH11  ARG  72          HH11      ARG  72  15.965  10.193 -23.604
  557   HH12  ARG  72          HH12      ARG  72  16.628  11.698 -23.080
  558   HH21  ARG  72          HH21      ARG  72  13.400  13.213 -22.753
  559   HH22  ARG  72          HH22      ARG  72  15.122  13.509 -22.530
  560    H    ASN  73           H        ASN  73  10.826   8.631 -18.805
  561    HA   ASN  73           HA       ASN  73  11.085   6.118 -17.471
  562    HB2  ASN  73           HB2      ASN  73  12.859   6.480 -16.013
  563    HB3  ASN  73           HB3      ASN  73  13.532   6.962 -17.556
  564   HD21  ASN  73          HD22      ASN  73  13.428   9.461 -18.018
  565   HD22  ASN  73          HD21      ASN  73  13.666  10.508 -16.637
  566    H    TRP  74           H        TRP  74  10.787   6.656 -14.944
  567    HA   TRP  74           HA       TRP  74   8.277   8.042 -14.834
  568    HB2  TRP  74           HB2      TRP  74  10.013   6.828 -12.649
  569    HB3  TRP  74           HB3      TRP  74   8.386   7.461 -12.436
  570    HD1  TRP  74           HD1      TRP  74  10.263   4.552 -14.083
  571    HE1  TRP  74           HE1      TRP  74   8.632   2.711 -14.728
  572    HE3  TRP  74           HE3      TRP  74   5.880   6.776 -12.664
  573    HZ2  TRP  74           HZ2      TRP  74   5.800   2.339 -14.901
  574    HZ3  TRP  74           HZ3      TRP  74   3.704   5.661 -13.109
  575    HH2  TRP  74           HH2      TRP  74   3.634   3.487 -14.311
  576    H    LEU  75           H        LEU  75   8.064  10.148 -14.705
  577    HA   LEU  75           HA       LEU  75  10.132  11.987 -13.703
  578    HB2  LEU  75           HB2      LEU  75   7.208  12.328 -14.522
  579    HB3  LEU  75           HB3      LEU  75   8.215  13.654 -13.950
  580    HG   LEU  75           HG       LEU  75   8.667  12.043 -16.493
  581   HD11  LEU  75          HD11      LEU  75   6.716  13.577 -16.487
  582   HD12  LEU  75          HD12      LEU  75   7.773  14.935 -16.073
  583   HD13  LEU  75          HD13      LEU  75   7.974  14.092 -17.630
  584   HD21  LEU  75          HD21      LEU  75  10.215  14.432 -15.376
  585   HD22  LEU  75          HD22      LEU  75  10.843  12.789 -15.659
  586   HD23  LEU  75          HD23      LEU  75  10.376  13.792 -17.028
  587    H    ARG  76           H        ARG  76   9.723  13.287 -11.749
  588    HA   ARG  76           HA       ARG  76   7.567  12.486  -9.999
  589    HB2  ARG  76           HB2      ARG  76   8.673  11.654  -8.139
  590    HB3  ARG  76           HB3      ARG  76   9.225  10.690  -9.483
  591    HG2  ARG  76           HG2      ARG  76  10.774  12.856  -8.015
  592    HG3  ARG  76           HG3      ARG  76  11.001  11.121  -7.891
  593    HD2  ARG  76           HD2      ARG  76  11.581  12.837 -10.333
  594    HD3  ARG  76           HD3      ARG  76  12.767  12.182  -9.225
  595    HE   ARG  76           HE       ARG  76  11.271  10.746 -11.330
  596   HH11  ARG  76          HH11      ARG  76  13.461  10.339  -8.539
  597   HH12  ARG  76          HH12      ARG  76  14.108   8.848  -9.115
  598   HH21  ARG  76          HH21      ARG  76  12.140   8.836 -12.090
  599   HH22  ARG  76          HH22      ARG  76  13.335   7.956 -11.181
  600    H    TYR  77           H        TYR  77   7.204  14.062  -8.328
  601    HA   TYR  77           HA       TYR  77   8.985  16.410  -8.293
  602    HB2  TYR  77           HB2      TYR  77   7.135  17.975  -8.659
  603    HB3  TYR  77           HB3      TYR  77   7.431  16.968 -10.061
  604    HD1  TYR  77           HD2      TYR  77   5.187  17.284  -7.056
  605    HD2  TYR  77           HD1      TYR  77   5.607  15.823 -11.090
  606    HE1  TYR  77           HE2      TYR  77   2.839  16.598  -7.041
  607    HE2  TYR  77           HE1      TYR  77   3.220  15.224 -11.132
  608    HH   TYR  77           HH       TYR  77   1.095  15.604  -8.234
  609    H    LYS  78           H        LYS  78   8.442  17.822  -6.490
  610    HA   LYS  78           HA       LYS  78   7.604  16.212  -4.138
  611    HB2  LYS  78           HB2      LYS  78   9.905  17.285  -4.278
  612    HB3  LYS  78           HB3      LYS  78   9.124  18.856  -4.342
  613    HG2  LYS  78           HG2      LYS  78   9.860  18.592  -2.148
  614    HG3  LYS  78           HG3      LYS  78   8.115  18.353  -2.063
  615    HD2  LYS  78           HD2      LYS  78   8.397  15.936  -1.902
  616    HD3  LYS  78           HD3      LYS  78  10.139  16.058  -2.175
  617    HE2  LYS  78           HE2      LYS  78   8.669  17.302   0.205
  618    HE3  LYS  78           HE3      LYS  78   9.420  15.704   0.232
  619    HZ1  LYS  78           HZ1      LYS  78  10.895  18.250  -0.190
  620    HZ2  LYS  78           HZ2      LYS  78  10.910  17.334   1.159
  621    HZ3  LYS  78           HZ3      LYS  78  11.573  16.757  -0.214
  622    H    LEU  79           H        LEU  79   5.668  16.704  -3.206
  623    HA   LEU  79           HA       LEU  79   3.920  18.782  -4.277
  624    HB2  LEU  79           HB2      LEU  79   3.815  16.864  -1.928
  625    HB3  LEU  79           HB3      LEU  79   2.578  18.102  -2.126
  626    HG   LEU  79           HG       LEU  79   3.178  15.999  -4.241
  627   HD11  LEU  79          HD11      LEU  79   1.151  14.852  -3.395
  628   HD12  LEU  79          HD12      LEU  79   2.419  14.901  -2.167
  629   HD13  LEU  79          HD13      LEU  79   1.042  16.014  -2.055
  630   HD21  LEU  79          HD21      LEU  79   0.787  17.847  -3.816
  631   HD22  LEU  79          HD22      LEU  79   2.015  18.028  -5.091
  632   HD23  LEU  79          HD23      LEU  79   0.944  16.624  -5.089
  633    HA   PRO  80           HA       PRO  80   5.388  22.012  -1.520
  634    HB2  PRO  80           HB2      PRO  80   3.259  23.687  -1.352
  635    HB3  PRO  80           HB3      PRO  80   4.096  23.432  -2.921
  636    HG2  PRO  80           HG2      PRO  80   1.704  21.913  -1.833
  637    HG3  PRO  80           HG3      PRO  80   1.761  22.845  -3.388
  638    HD2  PRO  80           HD2      PRO  80   2.237  20.197  -3.424
  639    HD3  PRO  80           HD3      PRO  80   3.336  21.268  -4.334
  640    H    LYS  81           H        LYS  81   5.061  22.755   0.715
  641    HA   LYS  81           HA       LYS  81   4.481  20.571   2.303
  642    HB2  LYS  81           HB2      LYS  81   4.633  23.510   3.140
  643    HB3  LYS  81           HB3      LYS  81   4.753  22.180   4.277
  644    HG2  LYS  81           HG2      LYS  81   6.714  22.628   1.979
  645    HG3  LYS  81           HG3      LYS  81   6.933  23.287   3.584
  646    HD2  LYS  81           HD2      LYS  81   6.719  20.313   2.959
  647    HD3  LYS  81           HD3      LYS  81   8.230  21.186   3.120
  648    HE2  LYS  81           HE2      LYS  81   6.153  20.906   5.348
  649    HE3  LYS  81           HE3      LYS  81   7.577  19.886   5.162
  650    HZ1  LYS  81           HZ1      LYS  81   8.002  21.633   6.748
  651    HZ2  LYS  81           HZ2      LYS  81   8.972  21.858   5.458
  652    HZ3  LYS  81           HZ3      LYS  81   7.655  22.815   5.678
  653    H    ARG  82           H        ARG  82   2.319  23.199   1.567
  654    HA   ARG  82           HA       ARG  82   0.368  22.511   3.561
  655    HB2  ARG  82           HB2      ARG  82  -0.959  24.286   2.605
  656    HB3  ARG  82           HB3      ARG  82   0.718  24.786   2.730
  657    HG2  ARG  82           HG2      ARG  82   0.757  23.913   0.135
  658    HG3  ARG  82           HG3      ARG  82  -0.969  24.213   0.291
  659    HD2  ARG  82           HD2      ARG  82   0.057  26.195  -0.595
  660    HD3  ARG  82           HD3      ARG  82  -0.427  26.549   1.071
  661    HE   ARG  82           HE       ARG  82   2.299  25.599   0.971
  662   HH11  ARG  82          HH11      ARG  82   0.357  28.487   0.238
  663   HH12  ARG  82          HH12      ARG  82   1.655  29.601   0.486
  664   HH21  ARG  82          HH21      ARG  82   4.041  27.101   1.304
  665   HH22  ARG  82          HH22      ARG  82   3.781  28.790   1.093
  666    H    LEU  83           H        LEU  83   0.947  21.297   0.327
  667    HA   LEU  83           HA       LEU  83  -1.836  20.334   0.085
  668    HB2  LEU  83           HB2      LEU  83  -0.640  21.428  -1.821
  669    HB3  LEU  83           HB3      LEU  83   0.470  20.041  -1.856
  670    HG   LEU  83           HG       LEU  83  -1.301  18.546  -2.532
  671   HD11  LEU  83          HD11      LEU  83  -3.189  20.929  -2.220
  672   HD12  LEU  83          HD12      LEU  83  -3.608  19.419  -3.056
  673   HD13  LEU  83          HD13      LEU  83  -3.260  19.391  -1.328
  674   HD21  LEU  83          HD21      LEU  83  -1.473  21.150  -4.115
  675   HD22  LEU  83          HD22      LEU  83  -0.163  19.967  -4.242
  676   HD23  LEU  83          HD23      LEU  83  -1.809  19.514  -4.723
  677    H    VAL  84           H        VAL  84   1.365  19.192   0.957
  678    HA   VAL  84           HA       VAL  84   0.785  16.376   0.878
  679    HB   VAL  84           HB       VAL  84   2.701  18.012   2.605
  680   HG11  VAL  84          HG11      VAL  84   3.878  15.853   3.037
  681   HG12  VAL  84          HG12      VAL  84   2.270  15.871   3.752
  682   HG13  VAL  84          HG13      VAL  84   2.551  14.977   2.243
  683   HG21  VAL  84          HG21      VAL  84   3.201  16.271   0.165
  684   HG22  VAL  84          HG22      VAL  84   3.241  18.054   0.198
  685   HG23  VAL  84          HG23      VAL  84   4.439  17.134   1.105
  686    H    ARG  85           H        ARG  85  -0.318  15.153   2.326
  687    HA   ARG  85           HA       ARG  85  -2.283  16.506   4.000
  688    HB2  ARG  85           HB2      ARG  85  -1.722  13.606   3.259
  689    HB3  ARG  85           HB3      ARG  85  -2.813  13.974   4.584
  690    HG2  ARG  85           HG2      ARG  85  -4.086  13.657   2.576
  691    HG3  ARG  85           HG3      ARG  85  -4.254  15.293   3.204
  692    HD2  ARG  85           HD2      ARG  85  -4.149  15.464   0.844
  693    HD3  ARG  85           HD3      ARG  85  -2.612  16.078   1.448
  694    HE   ARG  85           HE       ARG  85  -2.430  13.258   0.871
  695   HH11  ARG  85          HH11      ARG  85  -2.260  16.393  -0.759
  696   HH12  ARG  85          HH12      ARG  85  -2.201  15.727  -2.361
  697   HH21  ARG  85          HH21      ARG  85  -2.229  12.346  -1.233
  698   HH22  ARG  85          HH22      ARG  85  -2.065  13.359  -2.618
  699    H    TRP  86           H        TRP  86   0.524  14.531   4.648
  700    HA   TRP  86           HA       TRP  86   1.667  13.802   6.437
  701    HB2  TRP  86           HB2      TRP  86   0.581  16.153   7.986
  702    HB3  TRP  86           HB3      TRP  86   2.068  15.260   8.278
  703    HD1  TRP  86           HD1      TRP  86   0.547  17.856   5.957
  704    HE1  TRP  86           HE1      TRP  86   2.364  19.162   4.719
  705    HE3  TRP  86           HE3      TRP  86   4.591  15.064   7.376
  706    HZ2  TRP  86           HZ2      TRP  86   5.196  18.846   4.195
  707    HZ3  TRP  86           HZ3      TRP  86   6.829  15.545   6.429
  708    HH2  TRP  86           HH2      TRP  86   7.146  17.412   4.822
  709    H    ASP  87           H        ASP  87  -1.545  13.547   6.321
  710    HA   ASP  87           HA       ASP  87  -1.931  12.269   8.980
  711    HB2  ASP  87           HB2      ASP  87  -3.636  13.856   8.251
  712    HB3  ASP  87           HB3      ASP  87  -3.862  12.966   6.742
  713    H    THR  88           H        THR  88  -1.410  11.499   5.591
  714    HA   THR  88           HA       THR  88  -2.377   8.798   5.648
  715    HB   THR  88           HB       THR  88  -0.989   8.913   3.404
  716    HG1  THR  88           HG1      THR  88  -0.764  11.095   2.684
  717   HG21  THR  88          HG21      THR  88  -3.473   8.997   3.531
  718   HG22  THR  88          HG22      THR  88  -3.401  10.743   3.846
  719   HG23  THR  88          HG23      THR  88  -2.850  10.085   2.284
  720    H    LYS  89           H        LYS  89  -1.024   6.960   5.534
  721    HA   LYS  89           HA       LYS  89   1.788   7.243   6.483
  722    HB2  LYS  89           HB2      LYS  89  -0.310   5.372   7.614
  723    HB3  LYS  89           HB3      LYS  89   1.415   5.231   7.924
  724    HG2  LYS  89           HG2      LYS  89  -0.264   7.674   8.651
  725    HG3  LYS  89           HG3      LYS  89   0.111   6.343   9.746
  726    HD2  LYS  89           HD2      LYS  89   2.540   6.837   9.526
  727    HD3  LYS  89           HD3      LYS  89   2.154   8.227   8.483
  728    HE2  LYS  89           HE2      LYS  89   0.806   9.231  10.304
  729    HE3  LYS  89           HE3      LYS  89   1.144   7.840  11.339
  730    HZ1  LYS  89           HZ1      LYS  89   3.189   9.751  10.329
  731    HZ2  LYS  89           HZ2      LYS  89   2.611   9.675  11.851
  732    HZ3  LYS  89           HZ3      LYS  89   3.506   8.444  11.272
  733    HA   PRO  90           HA       PRO  90   3.766   6.699   5.581
  734    HB2  PRO  90           HB2      PRO  90   4.276   6.598   2.613
  735    HB3  PRO  90           HB3      PRO  90   5.437   6.441   3.965
  736    HG2  PRO  90           HG2      PRO  90   4.627   4.241   2.604
  737    HG3  PRO  90           HG3      PRO  90   4.745   4.189   4.396
  738    HD2  PRO  90           HD2      PRO  90   2.267   4.636   2.696
  739    HD3  PRO  90           HD3      PRO  90   2.494   3.533   4.086
  740    H    VAL  91           H        VAL  91   4.218   8.996   5.138
  741    HA   VAL  91           HA       VAL  91   2.007  10.589   4.221
  742    HB   VAL  91           HB       VAL  91   4.912  11.315   4.857
  743   HG11  VAL  91          HG11      VAL  91   3.944  13.037   3.421
  744   HG12  VAL  91          HG12      VAL  91   2.467  13.086   4.405
  745   HG13  VAL  91          HG13      VAL  91   4.022  13.646   5.070
  746   HG21  VAL  91          HG21      VAL  91   3.766  10.458   6.854
  747   HG22  VAL  91          HG22      VAL  91   3.971  12.205   6.984
  748   HG23  VAL  91          HG23      VAL  91   2.384  11.525   6.555
  749    H    CYS  92           H        CYS  92   1.694  11.362   2.187
  750    HA   CYS  92           HA       CYS  92   3.403  10.241   0.037
  751    HB2  CYS  92           HB2      CYS  92   1.010   9.810   0.028
  752    HB3  CYS  92           HB3      CYS  92   0.662  11.559   0.046
  753    HG   CYS  92           HG       CYS  92   0.229  10.628  -2.375
  754    H    ILE  93           H        ILE  93   5.116  11.531  -0.389
  755    HA   ILE  93           HA       ILE  93   4.843  14.465   0.005
  756    HB   ILE  93           HB       ILE  93   7.231  14.550   0.120
  757   HG12  ILE  93          HG12      ILE  93   7.237  11.553  -0.422
  758   HG13  ILE  93          HG13      ILE  93   7.866  12.813  -1.482
  759   HG21  ILE  93          HG21      ILE  93   6.242  12.297   1.914
  760   HG22  ILE  93          HG22      ILE  93   7.510  13.489   2.257
  761   HG23  ILE  93          HG23      ILE  93   5.834  14.018   2.132
  762   HD11  ILE  93          HD11      ILE  93   9.714  11.779  -0.376
  763   HD12  ILE  93          HD12      ILE  93   9.530  13.391   0.338
  764   HD13  ILE  93          HD13      ILE  93   8.959  11.948   1.218
  765    H    GLY  94           H        GLY  94   4.655  12.267  -2.613
  766    HA2  GLY  94           HA2      GLY  94   4.683  14.381  -4.555
  767    HA3  GLY  94           HA3      GLY  94   6.193  13.471  -4.581
  768    H    GLN  95           H        GLN  95   4.695  13.435  -6.819
  769    HA   GLN  95           HA       GLN  95   3.226  10.814  -6.816
  770    HB2  GLN  95           HB2      GLN  95   2.915  13.407  -8.314
  771    HB3  GLN  95           HB3      GLN  95   2.542  11.934  -9.156
  772    HG2  GLN  95           HG2      GLN  95   0.481  12.764  -8.298
  773    HG3  GLN  95           HG3      GLN  95   0.887  11.299  -7.430
  774   HE21  GLN  95          HE22      GLN  95  -0.403  11.811  -5.534
  775   HE22  GLN  95          HE21      GLN  95   0.103  13.067  -4.435
  776    H    LYS  96           H        LYS  96   4.363   9.188  -7.716
  777    HA   LYS  96           HA       LYS  96   6.702   9.737  -9.499
  778    HB2  LYS  96           HB2      LYS  96   7.249   7.950  -8.077
  779    HB3  LYS  96           HB3      LYS  96   5.609   7.323  -8.001
  780    HG2  LYS  96           HG2      LYS  96   5.745   6.338 -10.205
  781    HG3  LYS  96           HG3      LYS  96   7.265   7.184 -10.559
  782    HD2  LYS  96           HD2      LYS  96   8.461   5.930  -8.956
  783    HD3  LYS  96           HD3      LYS  96   6.971   5.203  -8.294
  784    HE2  LYS  96           HE2      LYS  96   6.585   3.986 -10.418
  785    HE3  LYS  96           HE3      LYS  96   7.994   4.752 -11.144
  786    HZ1  LYS  96           HZ1      LYS  96   9.436   3.596  -9.650
  787    HZ2  LYS  96           HZ2      LYS  96   8.220   3.030  -8.720
  788    HZ3  LYS  96           HZ3      LYS  96   8.419   2.469 -10.259
  789    H    GLN  97           H        GLN  97   6.251   9.804 -11.751
  790    HA   GLN  97           HA       GLN  97   3.840   8.421 -12.609
  791    HB2  GLN  97           HB2      GLN  97   3.379  10.787 -13.987
  792    HB3  GLN  97           HB3      GLN  97   2.443  10.075 -12.719
  793    HG2  GLN  97           HG2      GLN  97   2.690  12.327 -12.158
  794    HG3  GLN  97           HG3      GLN  97   3.709  11.456 -11.033
  795   HE21  GLN  97          HE22      GLN  97   5.482  12.739 -10.598
  796   HE22  GLN  97          HE21      GLN  97   6.332  13.676 -11.834
  797    H    LYS  98           H        LYS  98   3.605   7.834 -14.604
  798    HA   LYS  98           HA       LYS  98   5.703   8.570 -16.577
  799    HB2  LYS  98           HB2      LYS  98   5.968   6.193 -15.926
  800    HB3  LYS  98           HB3      LYS  98   4.246   5.903 -16.224
  801    HG2  LYS  98           HG2      LYS  98   4.609   6.460 -18.642
  802    HG3  LYS  98           HG3      LYS  98   6.337   6.691 -18.301
  803    HD2  LYS  98           HD2      LYS  98   6.517   4.331 -17.540
  804    HD3  LYS  98           HD3      LYS  98   4.779   4.135 -17.782
  805    HE2  LYS  98           HE2      LYS  98   5.825   3.133 -19.684
  806    HE3  LYS  98           HE3      LYS  98   5.071   4.623 -20.227
  807    HZ1  LYS  98           HZ1      LYS  98   7.394   5.650 -20.057
  808    HZ2  LYS  98           HZ2      LYS  98   7.976   4.129 -19.800
  809    HZ3  LYS  98           HZ3      LYS  98   7.198   4.513 -21.198
  810    H    TRP  99           H        TRP  99   4.750   9.523 -18.352
  811    HA   TRP  99           HA       TRP  99   1.769   9.621 -18.325
  812    HB2  TRP  99           HB2      TRP  99   3.770  11.588 -19.428
  813    HB3  TRP  99           HB3      TRP  99   2.035  11.650 -19.706
  814    HD1  TRP  99           HD1      TRP  99   4.451  11.696 -16.654
  815    HE1  TRP  99           HE1      TRP  99   3.600  13.362 -14.957
  816    HE3  TRP  99           HE3      TRP  99   0.013  12.904 -18.905
  817    HZ2  TRP  99           HZ2      TRP  99   1.283  15.138 -14.652
  818    HZ3  TRP  99           HZ3      TRP  99  -1.456  14.654 -17.935
  819    HH2  TRP  99           HH2      TRP  99  -0.829  15.765 -15.801
  820    H    PHE 100           H        PHE 100   0.696   9.190 -20.270
  821    HA   PHE 100           HA       PHE 100   2.356   7.897 -22.408
  822    HB2  PHE 100           HB2      PHE 100  -0.384   7.120 -21.359
  823    HB3  PHE 100           HB3      PHE 100   0.324   6.531 -22.857
  824    HD1  PHE 100           HD2      PHE 100   0.906   6.571 -19.133
  825    HD2  PHE 100           HD1      PHE 100   1.705   4.637 -22.914
  826    HE1  PHE 100           HE2      PHE 100   1.931   4.654 -17.949
  827    HE2  PHE 100           HE1      PHE 100   2.721   2.726 -21.721
  828    HZ   PHE 100           HZ       PHE 100   2.832   2.720 -19.241
  829    H    LEU 101           H        LEU 101   2.103   8.812 -24.358
  830    HA   LEU 101           HA       LEU 101   0.186  11.018 -24.742
  831    HB2  LEU 101           HB2      LEU 101   2.365  11.415 -25.664
  832    HB3  LEU 101           HB3      LEU 101   2.412   9.814 -26.404
  833    HG   LEU 101           HG       LEU 101   0.587  10.441 -27.949
  834   HD11  LEU 101          HD11      LEU 101  -0.597  12.105 -26.550
  835   HD12  LEU 101          HD12      LEU 101   0.791  13.211 -26.700
  836   HD13  LEU 101          HD13      LEU 101  -0.182  12.750 -28.125
  837   HD21  LEU 101          HD21      LEU 101   2.877  12.442 -27.960
  838   HD22  LEU 101          HD22      LEU 101   2.967  10.777 -28.556
  839   HD23  LEU 101          HD23      LEU 101   1.894  11.939 -29.353
  840    H    LEU 102           H        LEU 102  -1.818  10.444 -25.235
  841    HA   LEU 102           HA       LEU 102  -2.280   7.924 -26.752
  842    HB2  LEU 102           HB2      LEU 102  -3.815   9.345 -24.548
  843    HB3  LEU 102           HB3      LEU 102  -4.708   8.446 -25.753
  844    HG   LEU 102           HG       LEU 102  -4.389   7.043 -23.852
  845   HD11  LEU 102          HD11      LEU 102  -2.413   5.914 -25.817
  846   HD12  LEU 102          HD12      LEU 102  -3.744   5.105 -24.984
  847   HD13  LEU 102          HD13      LEU 102  -4.028   6.218 -26.369
  848   HD21  LEU 102          HD21      LEU 102  -2.231   6.335 -23.017
  849   HD22  LEU 102          HD22      LEU 102  -1.373   7.253 -24.266
  850   HD23  LEU 102          HD23      LEU 102  -2.268   8.103 -22.987
  851    H    GLN 103           H        GLN 103  -3.076   8.116 -28.731
  852    HA   GLN 103           HA       GLN 103  -4.142  10.788 -29.537
  853    HB2  GLN 103           HB2      GLN 103  -3.508   8.304 -31.187
  854    HB3  GLN 103           HB3      GLN 103  -4.316   9.739 -31.823
  855    HG2  GLN 103           HG2      GLN 103  -1.531   9.664 -30.596
  856    HG3  GLN 103           HG3      GLN 103  -1.895   9.773 -32.320
  857   HE21  GLN 103          HE22      GLN 103  -0.245  11.659 -30.882
  858   HE22  GLN 103          HE21      GLN 103  -1.101  13.191 -30.895
  859    H    LEU 104           H        LEU 104  -6.297  11.118 -29.713
  860    HA   LEU 104           HA       LEU 104  -8.085   9.189 -28.502
  861    HB2  LEU 104           HB2      LEU 104  -8.192  11.647 -28.313
  862    HB3  LEU 104           HB3      LEU 104  -8.543  11.778 -30.026
  863    HG   LEU 104           HG       LEU 104 -10.426   9.982 -28.582
  864   HD11  LEU 104          HD11      LEU 104 -11.613  12.058 -27.565
  865   HD12  LEU 104          HD12      LEU 104 -10.187  11.432 -26.727
  866   HD13  LEU 104          HD13      LEU 104 -10.071  12.889 -27.743
  867   HD21  LEU 104          HD21      LEU 104 -10.760  12.412 -30.406
  868   HD22  LEU 104          HD22      LEU 104 -10.821  10.710 -30.899
  869   HD23  LEU 104          HD23      LEU 104 -12.081  11.379 -29.846
  870    H    VAL 105           H        VAL 105  -9.138   7.541 -29.558
  871    HA   VAL 105           HA       VAL 105  -9.031   7.490 -32.540
  872    HB   VAL 105           HB       VAL 105  -9.426   5.232 -30.539
  873   HG11  VAL 105          HG11      VAL 105 -10.754   4.808 -32.532
  874   HG12  VAL 105          HG12      VAL 105  -9.344   5.118 -33.571
  875   HG13  VAL 105          HG13      VAL 105  -9.363   3.723 -32.464
  876   HG21  VAL 105          HG21      VAL 105  -7.281   4.401 -31.305
  877   HG22  VAL 105          HG22      VAL 105  -7.115   5.758 -32.450
  878   HG23  VAL 105          HG23      VAL 105  -7.054   6.049 -30.703
  879    H    SER 106           H        SER 106 -11.038   6.911 -29.603
  880    HA   SER 106           HA       SER 106 -13.384   7.998 -31.069
  881    HB2  SER 106           HB2      SER 106 -13.459   5.702 -29.085
  882    HB3  SER 106           HB3      SER 106 -14.821   6.388 -29.992
  883    HG   SER 106           HG       SER 106 -14.036   4.460 -30.977
  884    H    GLY 107           H        GLY 107 -14.383   9.566 -29.961
  885    HA2  GLY 107           HA2      GLY 107 -14.605   9.764 -27.160
  886    HA3  GLY 107           HA3      GLY 107 -13.286  10.822 -27.688
  887    H    ASP 108           H        ASP 108 -14.611  12.680 -27.122
  888    HA   ASP 108           HA       ASP 108 -15.871  14.476 -27.436
  889    HB2  ASP 108           HB2      ASP 108 -14.922  14.504 -29.631
  890    HB3  ASP 108           HB3      ASP 108 -16.174  13.438 -30.259
  891    H    ALA 109           H        ALA 109 -17.501  11.916 -29.139
  892    HA   ALA 109           HA       ALA 109 -20.085  12.341 -27.712
  893    HB1  ALA 109           HB1      ALA 109 -20.999  10.785 -29.405
  894    HB2  ALA 109           HB2      ALA 109 -20.199  12.164 -30.187
  895    HB3  ALA 109           HB3      ALA 109 -19.381  10.583 -30.114
  896    H    GLU 110           H        GLU 110 -17.439  10.007 -28.283
  897    HA   GLU 110           HA       GLU 110 -18.785   7.915 -26.788
  898    HB2  GLU 110           HB2      GLU 110 -16.071   7.975 -28.152
  899    HB3  GLU 110           HB3      GLU 110 -16.824   6.546 -27.451
  900    HG2  GLU 110           HG2      GLU 110 -17.852   8.165 -29.816
  901    HG3  GLU 110           HG3      GLU 110 -17.116   6.572 -29.871
  902    H    ILE 111           H        ILE 111 -16.822  10.511 -25.897
  903    HA   ILE 111           HA       ILE 111 -15.468   9.248 -23.604
  904    HB   ILE 111           HB       ILE 111 -15.641  11.966 -24.837
  905   HG12  ILE 111          HG12      ILE 111 -13.410  10.396 -23.539
  906   HG13  ILE 111          HG13      ILE 111 -13.736  10.542 -25.263
  907   HG21  ILE 111          HG21      ILE 111 -16.416  12.497 -22.561
  908   HG22  ILE 111          HG22      ILE 111 -14.988  11.649 -21.888
  909   HG23  ILE 111          HG23      ILE 111 -14.822  13.138 -22.857
  910   HD11  ILE 111          HD11      ILE 111 -13.289  13.030 -25.064
  911   HD12  ILE 111          HD12      ILE 111 -12.684  12.706 -23.413
  912   HD13  ILE 111          HD13      ILE 111 -11.893  11.964 -24.801
  913    H    ASN 112           H        ASN 112 -16.666   8.486 -21.997
  914    HA   ASN 112           HA       ASN 112 -19.476   9.426 -21.785
  915    HB2  ASN 112           HB2      ASN 112 -18.977   6.997 -21.988
  916    HB3  ASN 112           HB3      ASN 112 -18.102   7.065 -20.452
  917   HD21  ASN 112          HD22      ASN 112 -19.447   6.035 -18.947
  918   HD22  ASN 112          HD21      ASN 112 -21.160   6.373 -18.762
  919    H    MET 113           H        MET 113 -16.505   9.361 -19.915
  920    HA   MET 113           HA       MET 113 -15.762  10.064 -17.981
  921    HB2  MET 113           HB2      MET 113 -17.854  12.240 -18.305
  922    HB3  MET 113           HB3      MET 113 -16.564  12.216 -17.103
  923    HG2  MET 113           HG2      MET 113 -14.892  11.958 -18.944
  924    HG3  MET 113           HG3      MET 113 -16.204  12.239 -20.102
  925    HE1  MET 113           HE1      MET 113 -13.696  15.443 -19.826
  926    HE2  MET 113           HE2      MET 113 -13.241  13.812 -19.294
  927    HE3  MET 113           HE3      MET 113 -14.089  14.040 -20.841
  928    H    GLN 114           H        GLN 114 -19.273   9.575 -17.773
  929    HA   GLN 114           HA       GLN 114 -19.057   9.176 -14.857
  930    HB2  GLN 114           HB2      GLN 114 -21.348   9.804 -16.740
  931    HB3  GLN 114           HB3      GLN 114 -21.572   9.431 -15.011
  932    HG2  GLN 114           HG2      GLN 114 -20.070  11.340 -14.420
  933    HG3  GLN 114           HG3      GLN 114 -19.951  11.764 -16.130
  934   HE21  GLN 114          HE22      GLN 114 -22.286  11.443 -13.390
  935   HE22  GLN 114          HE21      GLN 114 -23.464  12.552 -14.056
  936    H    THR 115           H        THR 115 -17.997   7.219 -16.630
  937    HA   THR 115           HA       THR 115 -19.788   4.946 -16.624
  938    HB   THR 115           HB       THR 115 -16.746   4.905 -16.700
  939    HG1  THR 115           HG1      THR 115 -17.170   4.902 -19.033
  940   HG21  THR 115          HG21      THR 115 -17.106   2.792 -17.902
  941   HG22  THR 115          HG22      THR 115 -17.951   2.740 -16.338
  942   HG23  THR 115          HG23      THR 115 -18.871   3.025 -17.828
  943    H    SER 116           H        SER 116 -17.014   6.035 -14.569
  944    HA   SER 116           HA       SER 116 -17.672   4.164 -12.450
  945    HB2  SER 116           HB2      SER 116 -15.836   6.597 -12.430
  946    HB3  SER 116           HB3      SER 116 -15.853   5.269 -11.258
  947    HG   SER 116           HG       SER 116 -15.168   3.865 -12.902
  948    H    SER 117           H        SER 117 -18.797   4.638 -10.663
  949    HA   SER 117           HA       SER 117 -20.817   6.613 -10.673
  950    HB2  SER 117           HB2      SER 117 -19.816   5.058  -8.257
  951    HB3  SER 117           HB3      SER 117 -21.441   5.718  -8.523
  952    HG   SER 117           HG       SER 117 -21.338   3.457  -8.978
  953    H    THR 118           H        THR 118 -17.594   6.610  -9.146
  954    HA   THR 118           HA       THR 118 -17.923   9.513  -8.561
  955    HB   THR 118           HB       THR 118 -16.234   9.060  -6.679
  956    HG1  THR 118           HG1      THR 118 -15.740   6.898  -7.062
  957   HG21  THR 118          HG21      THR 118 -19.072   7.995  -6.349
  958   HG22  THR 118          HG22      THR 118 -17.996   8.573  -5.061
  959   HG23  THR 118          HG23      THR 118 -18.590   9.706  -6.286
  960    HA   PRO 119           HA       PRO 119 -14.499   8.663 -11.548
  961    HB2  PRO 119           HB2      PRO 119 -15.300  10.267 -13.605
  962    HB3  PRO 119           HB3      PRO 119 -16.014   8.662 -13.311
  963    HG2  PRO 119           HG2      PRO 119 -17.162  11.366 -12.639
  964    HG3  PRO 119           HG3      PRO 119 -17.989   9.870 -13.202
  965    HD2  PRO 119           HD2      PRO 119 -17.810  10.737 -10.547
  966    HD3  PRO 119           HD3      PRO 119 -18.267   9.117 -11.126
  967    H    GLU 120           H        GLU 120 -13.161  10.592 -12.795
  968    HA   GLU 120           HA       GLU 120 -12.932  12.855 -10.854
  969    HB2  GLU 120           HB2      GLU 120 -10.835  11.609 -12.634
  970    HB3  GLU 120           HB3      GLU 120 -10.693  13.244 -11.990
  971    HG2  GLU 120           HG2      GLU 120 -11.433  11.863  -9.708
  972    HG3  GLU 120           HG3      GLU 120 -10.494  10.647 -10.564
  973    H    PHE 121           H        PHE 121 -13.649  12.251 -14.344
  974    HA   PHE 121           HA       PHE 121 -13.775  15.221 -14.530
  975    HB2  PHE 121           HB2      PHE 121 -13.528  13.250 -16.781
  976    HB3  PHE 121           HB3      PHE 121 -13.626  14.994 -16.911
  977    HD1  PHE 121           HD2      PHE 121 -11.812  16.104 -14.931
  978    HD2  PHE 121           HD1      PHE 121 -11.346  12.620 -17.435
  979    HE1  PHE 121           HE2      PHE 121  -9.363  16.387 -14.867
  980    HE2  PHE 121           HE1      PHE 121  -8.873  12.900 -17.338
  981    HZ   PHE 121           HZ       PHE 121  -7.895  14.810 -16.091
  982    H    ASP 122           H        ASP 122 -15.455  16.218 -15.683
  983    HA   ASP 122           HA       ASP 122 -17.919  14.652 -16.117
  984    HB2  ASP 122           HB2      ASP 122 -19.179  15.657 -14.590
  985    HB3  ASP 122           HB3      ASP 122 -17.671  15.957 -13.757
  986    H    GLY 123           H        GLY 123 -15.749  16.955 -17.384
  987    HA2  GLY 123           HA2      GLY 123 -17.361  17.169 -19.737
  988    HA3  GLY 123           HA3      GLY 123 -17.194  18.749 -18.940
  989    H    TRP 124           H        TRP 124 -16.100  18.028 -21.537
  990    HA   TRP 124           HA       TRP 124 -13.174  18.252 -20.964
  991    HB2  TRP 124           HB2      TRP 124 -12.897  17.311 -23.254
  992    HB3  TRP 124           HB3      TRP 124 -13.519  16.199 -22.050
  993    HD1  TRP 124           HD1      TRP 124 -15.914  15.197 -22.405
  994    HE1  TRP 124           HE1      TRP 124 -17.574  15.158 -24.351
  995    HE3  TRP 124           HE3      TRP 124 -13.817  18.848 -25.328
  996    HZ2  TRP 124           HZ2      TRP 124 -18.029  16.635 -26.792
  997    HZ3  TRP 124           HZ3      TRP 124 -14.921  19.554 -27.427
  998    HH2  TRP 124           HH2      TRP 124 -17.032  18.456 -28.170
  999    H    ARG 125           H        ARG 125 -11.975  19.722 -22.101
 1000    HA   ARG 125           HA       ARG 125 -13.178  21.366 -24.253
 1001    HB2  ARG 125           HB2      ARG 125 -13.489  22.739 -22.239
 1002    HB3  ARG 125           HB3      ARG 125 -11.824  22.436 -21.736
 1003    HG2  ARG 125           HG2      ARG 125 -11.031  23.666 -23.794
 1004    HG3  ARG 125           HG3      ARG 125 -12.722  24.093 -24.123
 1005    HD2  ARG 125           HD2      ARG 125 -12.867  25.304 -22.006
 1006    HD3  ARG 125           HD3      ARG 125 -11.281  24.687 -21.506
 1007    HE   ARG 125           HE       ARG 125 -11.392  26.264 -23.999
 1008   HH11  ARG 125          HH11      ARG 125 -10.745  26.402 -20.497
 1009   HH12  ARG 125          HH12      ARG 125  -9.622  27.721 -20.624
 1010   HH21  ARG 125          HH21      ARG 125 -10.004  28.085 -24.133
 1011   HH22  ARG 125          HH22      ARG 125  -9.272  28.740 -22.712
 1012    H    TRP 126           H        TRP 126 -11.685  20.985 -25.991
 1013    HA   TRP 126           HA       TRP 126  -8.957  20.185 -25.321
 1014    HB2  TRP 126           HB2      TRP 126 -10.039  20.884 -28.058
 1015    HB3  TRP 126           HB3      TRP 126  -8.659  19.856 -27.652
 1016    HD1  TRP 126           HD1      TRP 126 -11.975  19.474 -28.891
 1017    HE1  TRP 126           HE1      TRP 126 -13.183  17.349 -28.167
 1018    HE3  TRP 126           HE3      TRP 126  -8.801  17.964 -25.151
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.989  15.415 -26.016
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.410  16.043 -23.723
 1021    HH2  TRP 126           HH2      TRP 126 -11.519  14.803 -24.089
 1022    H    VAL 127           H        VAL 127  -7.088  21.413 -25.530
 1023    HA   VAL 127           HA       VAL 127  -7.431  24.340 -25.926
 1024    HB   VAL 127           HB       VAL 127  -6.129  24.683 -23.850
 1025   HG11  VAL 127          HG11      VAL 127  -8.618  24.831 -23.850
 1026   HG12  VAL 127          HG12      VAL 127  -8.685  23.149 -23.277
 1027   HG13  VAL 127          HG13      VAL 127  -7.925  24.394 -22.280
 1028   HG21  VAL 127          HG21      VAL 127  -5.034  22.466 -23.665
 1029   HG22  VAL 127          HG22      VAL 127  -5.894  22.887 -22.178
 1030   HG23  VAL 127          HG23      VAL 127  -6.601  21.716 -23.302
 1031    H    SER 128           H        SER 128  -5.365  25.498 -26.128
 1032    HA   SER 128           HA       SER 128  -3.610  24.451 -27.994
 1033    HB2  SER 128           HB2      SER 128  -2.834  26.513 -25.912
 1034    HB3  SER 128           HB3      SER 128  -2.224  26.345 -27.561
 1035    HG   SER 128           HG       SER 128  -3.802  28.019 -27.422
 1036    H    TYR 129           H        TYR 129  -1.513  23.615 -27.896
 1037    HA   TYR 129           HA       TYR 129  -1.284  21.452 -26.278
 1038    HB2  TYR 129           HB2      TYR 129  -0.162  21.990 -28.471
 1039    HB3  TYR 129           HB3      TYR 129   1.091  22.848 -27.562
 1040    HD1  TYR 129           HD2      TYR 129  -0.431  19.626 -28.453
 1041    HD2  TYR 129           HD1      TYR 129   2.705  21.521 -26.160
 1042    HE1  TYR 129           HE2      TYR 129   0.561  17.413 -27.961
 1043    HE2  TYR 129           HE1      TYR 129   3.757  19.296 -25.790
 1044    HH   TYR 129           HH       TYR 129   2.215  16.247 -26.859
 1045    H    TRP 130           H        TRP 130   0.231  24.626 -25.572
 1046    HA   TRP 130           HA       TRP 130   1.421  23.505 -23.110
 1047    HB2  TRP 130           HB2      TRP 130   1.809  26.236 -24.345
 1048    HB3  TRP 130           HB3      TRP 130   2.768  25.495 -23.065
 1049    HD1  TRP 130           HD1      TRP 130   2.309  25.557 -26.807
 1050    HE1  TRP 130           HE1      TRP 130   4.067  24.189 -27.984
 1051    HE3  TRP 130           HE3      TRP 130   4.498  23.418 -22.700
 1052    HZ2  TRP 130           HZ2      TRP 130   6.218  22.320 -27.239
 1053    HZ3  TRP 130           HZ3      TRP 130   6.439  21.894 -22.961
 1054    HH2  TRP 130           HH2      TRP 130   7.269  21.286 -25.218
 1055    H    TYR 131           H        TYR 131  -1.612  24.631 -23.708
 1056    HA   TYR 131           HA       TYR 131  -1.870  26.802 -21.885
 1057    HB2  TYR 131           HB2      TYR 131  -3.432  26.378 -23.687
 1058    HB3  TYR 131           HB3      TYR 131  -3.963  24.883 -22.954
 1059    HD1  TYR 131           HD2      TYR 131  -3.996  28.588 -22.649
 1060    HD2  TYR 131           HD1      TYR 131  -5.589  24.863 -21.147
 1061    HE1  TYR 131           HE2      TYR 131  -5.853  29.814 -21.586
 1062    HE2  TYR 131           HE1      TYR 131  -7.493  26.074 -20.154
 1063    HH   TYR 131           HH       TYR 131  -7.826  29.655 -20.310
 1064    HA   PRO 132           HA       PRO 132  -3.160  23.585 -18.540
 1065    HB2  PRO 132           HB2      PRO 132  -1.524  21.200 -19.381
 1066    HB3  PRO 132           HB3      PRO 132  -3.079  21.262 -18.514
 1067    HG2  PRO 132           HG2      PRO 132  -3.027  20.634 -21.136
 1068    HG3  PRO 132           HG3      PRO 132  -4.276  21.771 -20.520
 1069    HD2  PRO 132           HD2      PRO 132  -1.640  22.443 -21.875
 1070    HD3  PRO 132           HD3      PRO 132  -3.267  23.065 -22.225
 1071    H    VAL 133           H        VAL 133   0.032  23.755 -20.086
 1072    HA   VAL 133           HA       VAL 133   1.567  23.570 -17.645
 1073    HB   VAL 133           HB       VAL 133   1.998  23.665 -20.517
 1074   HG11  VAL 133          HG11      VAL 133   4.057  25.304 -19.014
 1075   HG12  VAL 133          HG12      VAL 133   4.142  24.743 -20.693
 1076   HG13  VAL 133          HG13      VAL 133   2.921  25.936 -20.237
 1077   HG21  VAL 133          HG21      VAL 133   2.614  21.862 -18.950
 1078   HG22  VAL 133          HG22      VAL 133   3.976  22.428 -19.925
 1079   HG23  VAL 133          HG23      VAL 133   3.840  22.935 -18.227
 1080    H    ARG 134           H        ARG 134  -0.422  26.071 -18.876
 1081    HA   ARG 134           HA       ARG 134   0.955  27.991 -17.022
 1082    HB2  ARG 134           HB2      ARG 134  -1.138  28.496 -19.179
 1083    HB3  ARG 134           HB3      ARG 134  -0.399  29.721 -18.164
 1084    HG2  ARG 134           HG2      ARG 134   1.095  28.040 -20.239
 1085    HG3  ARG 134           HG3      ARG 134   0.476  29.664 -20.473
 1086    HD2  ARG 134           HD2      ARG 134   2.754  29.952 -20.054
 1087    HD3  ARG 134           HD3      ARG 134   1.941  30.452 -18.563
 1088    HE   ARG 134           HE       ARG 134   2.630  27.708 -18.303
 1089   HH11  ARG 134          HH11      ARG 134   4.311  30.835 -18.560
 1090   HH12  ARG 134          HH12      ARG 134   5.727  30.299 -17.727
 1091   HH21  ARG 134          HH21      ARG 134   4.485  26.989 -17.229
 1092   HH22  ARG 134          HH22      ARG 134   5.826  28.049 -16.947
 1093    H    GLN 135           H        GLN 135  -2.081  26.214 -17.690
 1094    HA   GLN 135           HA       GLN 135  -3.458  27.696 -15.607
 1095    HB2  GLN 135           HB2      GLN 135  -4.251  25.155 -17.075
 1096    HB3  GLN 135           HB3      GLN 135  -5.284  26.076 -15.984
 1097    HG2  GLN 135           HG2      GLN 135  -4.207  27.029 -18.661
 1098    HG3  GLN 135           HG3      GLN 135  -5.865  26.618 -18.236
 1099   HE21  GLN 135          HE22      GLN 135  -7.002  28.054 -16.602
 1100   HE22  GLN 135          HE21      GLN 135  -6.515  29.728 -16.503
 1101    H    VAL 136           H        VAL 136  -1.552  24.688 -15.588
 1102    HA   VAL 136           HA       VAL 136  -2.678  23.751 -13.138
 1103    HB   VAL 136           HB       VAL 136  -1.420  22.417 -14.890
 1104   HG11  VAL 136          HG11      VAL 136   0.612  23.686 -15.163
 1105   HG12  VAL 136          HG12      VAL 136   1.028  23.471 -13.439
 1106   HG13  VAL 136          HG13      VAL 136   1.015  22.080 -14.523
 1107   HG21  VAL 136          HG21      VAL 136  -0.718  20.734 -13.389
 1108   HG22  VAL 136          HG22      VAL 136  -0.474  21.890 -12.064
 1109   HG23  VAL 136          HG23      VAL 136  -2.115  21.538 -12.653
 1110    H    VAL 137           H        VAL 137  -1.573  23.617 -11.039
 1111    HA   VAL 137           HA       VAL 137  -0.708  26.017  -9.914
 1112    HB   VAL 137           HB       VAL 137   0.379  24.359  -8.188
 1113   HG11  VAL 137          HG11      VAL 137  -2.632  24.364  -8.739
 1114   HG12  VAL 137          HG12      VAL 137  -1.861  23.942  -7.194
 1115   HG13  VAL 137          HG13      VAL 137  -1.732  25.591  -7.819
 1116   HG21  VAL 137          HG21      VAL 137  -1.372  22.338  -9.670
 1117   HG22  VAL 137          HG22      VAL 137   0.416  22.347  -9.642
 1118   HG23  VAL 137          HG23      VAL 137  -0.509  22.106  -8.154
 1119    H    SER 138           H        SER 138   1.219  26.992  -9.467
 1120    HA   SER 138           HA       SER 138   3.095  27.017 -11.417
 1121    HB2  SER 138           HB2      SER 138   3.553  27.878  -8.542
 1122    HB3  SER 138           HB3      SER 138   4.251  28.591 -10.012
 1123    HG   SER 138           HG       SER 138   2.437  29.788  -9.202
 1124    H    PHE 139           H        PHE 139   3.375  25.092  -8.362
 1125    HA   PHE 139           HA       PHE 139   6.131  24.456  -8.800
 1126    HB2  PHE 139           HB2      PHE 139   5.924  22.858  -7.070
 1127    HB3  PHE 139           HB3      PHE 139   4.969  24.247  -6.610
 1128    HD1  PHE 139           HD2      PHE 139   4.868  20.705  -7.714
 1129    HD2  PHE 139           HD1      PHE 139   2.530  24.050  -6.302
 1130    HE1  PHE 139           HE2      PHE 139   2.936  19.205  -7.347
 1131    HE2  PHE 139           HE1      PHE 139   0.606  22.534  -5.926
 1132    HZ   PHE 139           HZ       PHE 139   0.791  20.112  -6.470
 1133    H    LYS 140           H        LYS 140   3.113  23.019 -10.028
 1134    HA   LYS 140           HA       LYS 140   4.571  20.681 -11.049
 1135    HB2  LYS 140           HB2      LYS 140   2.241  20.669  -9.953
 1136    HB3  LYS 140           HB3      LYS 140   1.646  21.230 -11.531
 1137    HG2  LYS 140           HG2      LYS 140   2.814  19.215 -12.565
 1138    HG3  LYS 140           HG3      LYS 140   3.218  18.674 -10.935
 1139    HD2  LYS 140           HD2      LYS 140   0.431  19.012 -12.120
 1140    HD3  LYS 140           HD3      LYS 140   1.285  17.493 -11.835
 1141    HE2  LYS 140           HE2      LYS 140   1.275  17.967  -9.368
 1142    HE3  LYS 140           HE3      LYS 140   0.337  19.435  -9.656
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.454  18.083 -10.559
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.579  16.709 -10.466
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.059  17.478  -9.083
 1146    H    ARG 141           H        ARG 141   3.278  23.722 -12.365
 1147    HA   ARG 141           HA       ARG 141   3.203  23.310 -15.076
 1148    HB2  ARG 141           HB2      ARG 141   4.733  25.587 -13.716
 1149    HB3  ARG 141           HB3      ARG 141   4.302  25.554 -15.427
 1150    HG2  ARG 141           HG2      ARG 141   1.899  25.506 -14.848
 1151    HG3  ARG 141           HG3      ARG 141   2.328  25.551 -13.133
 1152    HD2  ARG 141           HD2      ARG 141   3.531  27.742 -13.610
 1153    HD3  ARG 141           HD3      ARG 141   2.760  27.712 -15.215
 1154    HE   ARG 141           HE       ARG 141   0.687  27.262 -13.433
 1155   HH11  ARG 141          HH11      ARG 141   3.023  29.938 -13.840
 1156   HH12  ARG 141          HH12      ARG 141   1.962  31.122 -13.171
 1157   HH21  ARG 141          HH21      ARG 141  -0.704  28.837 -12.618
 1158   HH22  ARG 141          HH22      ARG 141  -0.201  30.482 -12.436
 1159    H    ASP 142           H        ASP 142   6.366  23.575 -13.338
 1160    HA   ASP 142           HA       ASP 142   7.948  23.471 -15.692
 1161    HB2  ASP 142           HB2      ASP 142   8.877  24.204 -13.570
 1162    HB3  ASP 142           HB3      ASP 142   8.640  22.601 -12.863
 1163    H    VAL 143           H        VAL 143   7.022  20.772 -13.473
 1164    HA   VAL 143           HA       VAL 143   8.358  18.815 -15.110
 1165    HB   VAL 143           HB       VAL 143   8.187  18.531 -12.757
 1166   HG11  VAL 143          HG11      VAL 143   6.110  18.032 -11.572
 1167   HG12  VAL 143          HG12      VAL 143   6.065  19.627 -12.268
 1168   HG13  VAL 143          HG13      VAL 143   5.161  18.294 -13.045
 1169   HG21  VAL 143          HG21      VAL 143   7.518  16.219 -12.601
 1170   HG22  VAL 143          HG22      VAL 143   6.538  16.343 -14.080
 1171   HG23  VAL 143          HG23      VAL 143   8.312  16.493 -14.159
 1172    H    TYR 144           H        TYR 144   5.001  20.099 -15.072
 1173    HA   TYR 144           HA       TYR 144   4.037  18.146 -16.909
 1174    HB2  TYR 144           HB2      TYR 144   2.738  19.844 -15.441
 1175    HB3  TYR 144           HB3      TYR 144   2.989  20.982 -16.740
 1176    HD1  TYR 144           HD1      TYR 144   2.505  17.676 -18.218
 1177    HD2  TYR 144           HD2      TYR 144   0.384  20.909 -16.285
 1178    HE1  TYR 144           HE1      TYR 144   0.385  16.725 -18.957
 1179    HE2  TYR 144           HE2      TYR 144  -1.748  19.954 -17.034
 1180    HH   TYR 144           HH       TYR 144  -2.809  18.227 -18.258
 1181    H    ARG 145           H        ARG 145   5.848  21.226 -17.383
 1182    HA   ARG 145           HA       ARG 145   5.722  21.164 -20.251
 1183    HB2  ARG 145           HB2      ARG 145   6.453  23.211 -19.735
 1184    HB3  ARG 145           HB3      ARG 145   7.038  22.740 -18.152
 1185    HG2  ARG 145           HG2      ARG 145   9.140  21.952 -19.080
 1186    HG3  ARG 145           HG3      ARG 145   8.593  22.345 -20.734
 1187    HD2  ARG 145           HD2      ARG 145   8.411  24.727 -20.104
 1188    HD3  ARG 145           HD3      ARG 145   8.942  24.339 -18.448
 1189    HE   ARG 145           HE       ARG 145  10.880  23.336 -20.249
 1190   HH11  ARG 145          HH21      ARG 145   9.676  26.510 -19.175
 1191   HH12  ARG 145          HH22      ARG 145  11.174  27.326 -19.441
 1192   HH21  ARG 145          HH11      ARG 145  12.876  24.436 -20.618
 1193   HH22  ARG 145          HH12      ARG 145  13.018  26.125 -20.289
 1194    H    ARG 146           H        ARG 146   7.851  19.427 -17.933
 1195    HA   ARG 146           HA       ARG 146   9.608  18.430 -19.974
 1196    HB2  ARG 146           HB2      ARG 146   8.823  16.981 -17.392
 1197    HB3  ARG 146           HB3      ARG 146  10.198  16.623 -18.422
 1198    HG2  ARG 146           HG2      ARG 146  11.165  18.868 -17.962
 1199    HG3  ARG 146           HG3      ARG 146   9.778  19.243 -16.934
 1200    HD2  ARG 146           HD2      ARG 146  10.434  17.152 -15.560
 1201    HD3  ARG 146           HD3      ARG 146  11.973  17.241 -16.436
 1202    HE   ARG 146           HE       ARG 146  11.019  19.739 -15.155
 1203   HH11  ARG 146          HH11      ARG 146  13.215  16.930 -14.773
 1204   HH12  ARG 146          HH12      ARG 146  14.098  17.670 -13.489
 1205   HH21  ARG 146          HH21      ARG 146  12.089  20.628 -13.520
 1206   HH22  ARG 146          HH22      ARG 146  13.473  19.876 -12.749
 1207    H    VAL 147           H        VAL 147   6.497  17.071 -18.688
 1208    HA   VAL 147           HA       VAL 147   6.401  14.816 -20.408
 1209    HB   VAL 147           HB       VAL 147   4.083  16.560 -19.464
 1210   HG11  VAL 147          HG11      VAL 147   4.148  13.674 -20.405
 1211   HG12  VAL 147          HG12      VAL 147   2.737  14.485 -19.673
 1212   HG13  VAL 147          HG13      VAL 147   3.363  15.038 -21.226
 1213   HG21  VAL 147          HG21      VAL 147   5.472  15.722 -17.545
 1214   HG22  VAL 147          HG22      VAL 147   3.846  15.055 -17.586
 1215   HG23  VAL 147          HG23      VAL 147   5.209  14.068 -18.149
 1216    H    MET 148           H        MET 148   5.173  18.189 -20.955
 1217    HA   MET 148           HA       MET 148   4.165  17.589 -23.537
 1218    HB2  MET 148           HB2      MET 148   4.996  20.166 -22.174
 1219    HB3  MET 148           HB3      MET 148   4.272  20.122 -23.791
 1220    HG2  MET 148           HG2      MET 148   2.280  18.991 -22.920
 1221    HG3  MET 148           HG3      MET 148   2.989  18.952 -21.297
 1222    HE1  MET 148           HE1      MET 148   0.219  21.596 -20.716
 1223    HE2  MET 148           HE2      MET 148   0.089  20.117 -21.696
 1224    HE3  MET 148           HE3      MET 148   0.965  20.088 -20.146
 1225    H    LYS 149           H        LYS 149   7.445  18.720 -22.521
 1226    HA   LYS 149           HA       LYS 149   8.402  19.117 -25.180
 1227    HB2  LYS 149           HB2      LYS 149   9.444  20.021 -23.130
 1228    HB3  LYS 149           HB3      LYS 149   9.937  18.407 -22.628
 1229    HG2  LYS 149           HG2      LYS 149  10.798  19.456 -25.346
 1230    HG3  LYS 149           HG3      LYS 149  11.560  20.097 -23.895
 1231    HD2  LYS 149           HD2      LYS 149  12.294  17.833 -23.219
 1232    HD3  LYS 149           HD3      LYS 149  11.565  17.143 -24.681
 1233    HE2  LYS 149           HE2      LYS 149  12.995  18.614 -26.095
 1234    HE3  LYS 149           HE3      LYS 149  13.722  19.304 -24.640
 1235    HZ1  LYS 149           HZ1      LYS 149  13.948  16.458 -25.469
 1236    HZ2  LYS 149           HZ2      LYS 149  15.118  17.586 -25.594
 1237    HZ3  LYS 149           HZ3      LYS 149  14.624  17.106 -24.115
 1238    H    GLU 150           H        GLU 150   8.166  16.210 -23.132
 1239    HA   GLU 150           HA       GLU 150   9.761  14.479 -24.775
 1240    HB2  GLU 150           HB2      GLU 150   7.475  13.929 -22.841
 1241    HB3  GLU 150           HB3      GLU 150   8.357  12.658 -23.644
 1242    HG2  GLU 150           HG2      GLU 150   9.949  14.699 -22.094
 1243    HG3  GLU 150           HG3      GLU 150   8.999  13.514 -21.207
 1244    H    PHE 151           H        PHE 151   6.460  15.707 -25.154
 1245    HA   PHE 151           HA       PHE 151   5.900  13.690 -27.291
 1246    HB2  PHE 151           HB2      PHE 151   4.115  15.252 -25.409
 1247    HB3  PHE 151           HB3      PHE 151   3.517  14.166 -26.661
 1248    HD1  PHE 151           HD1      PHE 151   5.830  11.981 -26.024
 1249    HD2  PHE 151           HD2      PHE 151   2.906  14.138 -23.690
 1250    HE1  PHE 151           HE1      PHE 151   5.880  10.216 -24.342
 1251    HE2  PHE 151           HE2      PHE 151   2.906  12.289 -22.022
 1252    HZ   PHE 151           HZ       PHE 151   4.407  10.357 -22.321
 1253    H    ALA 152           H        ALA 152   6.200  17.142 -26.844
 1254    HA   ALA 152           HA       ALA 152   4.413  18.328 -28.339
 1255    HB1  ALA 152           HB1      ALA 152   6.187  19.575 -27.289
 1256    HB2  ALA 152           HB2      ALA 152   7.402  18.912 -28.408
 1257    HB3  ALA 152           HB3      ALA 152   6.147  20.014 -29.006
 1258    H    SER 153           H        SER 153   7.456  17.418 -30.110
 1259    HA   SER 153           HA       SER 153   6.312  17.959 -32.591
 1260    HB2  SER 153           HB2      SER 153   8.516  15.922 -32.167
 1261    HB3  SER 153           HB3      SER 153   8.259  17.010 -33.549
 1262    HG   SER 153           HG       SER 153   9.910  17.801 -32.149
 1263    H    VAL 154           H        VAL 154   5.786  15.093 -30.628
 1264    HA   VAL 154           HA       VAL 154   5.313  13.253 -32.847
 1265    HB   VAL 154           HB       VAL 154   4.416  12.942 -29.958
 1266   HG11  VAL 154          HG11      VAL 154   5.150  10.913 -32.120
 1267   HG12  VAL 154          HG12      VAL 154   4.714  10.521 -30.446
 1268   HG13  VAL 154          HG13      VAL 154   3.517  11.266 -31.515
 1269   HG21  VAL 154          HG21      VAL 154   6.559  11.722 -29.542
 1270   HG22  VAL 154          HG22      VAL 154   7.163  12.275 -31.119
 1271   HG23  VAL 154          HG23      VAL 154   6.815  13.440 -29.822
 1272    H    VAL 155           H        VAL 155   3.514  15.636 -31.011
 1273    HA   VAL 155           HA       VAL 155   0.945  14.786 -32.247
 1274    HB   VAL 155           HB       VAL 155   1.541  16.942 -30.185
 1275   HG11  VAL 155          HG11      VAL 155  -1.060  15.530 -30.983
 1276   HG12  VAL 155          HG12      VAL 155  -0.897  16.729 -29.680
 1277   HG13  VAL 155          HG13      VAL 155  -0.608  17.200 -31.358
 1278   HG21  VAL 155          HG21      VAL 155   0.784  14.016 -29.819
 1279   HG22  VAL 155          HG22      VAL 155   2.205  14.852 -29.154
 1280   HG23  VAL 155          HG23      VAL 155   0.604  15.228 -28.536
 1281    H    MET 156           H        MET 156   3.273  17.529 -32.173
 1282    HA   MET 156           HA       MET 156   1.541  19.261 -33.630
 1283    HB2  MET 156           HB2      MET 156   4.547  19.296 -33.184
 1284    HB3  MET 156           HB3      MET 156   3.661  20.611 -33.977
 1285    HG2  MET 156           HG2      MET 156   2.318  21.023 -32.026
 1286    HG3  MET 156           HG3      MET 156   2.907  19.570 -31.227
 1287    HE1  MET 156           HE1      MET 156   3.479  20.554 -29.065
 1288    HE2  MET 156           HE2      MET 156   4.415  22.039 -28.806
 1289    HE3  MET 156           HE3      MET 156   2.813  22.118 -29.579
 1290    H    SER 157           H        SER 157   4.012  16.916 -34.809
 1291    HA   SER 157           HA       SER 157   4.050  17.706 -37.504
 1292    HB2  SER 157           HB2      SER 157   4.120  14.938 -36.265
 1293    HB3  SER 157           HB3      SER 157   4.507  15.288 -37.958
 1294    HG   SER 157           HG       SER 157   6.409  15.254 -36.607
 1295    H    LEU 158           H        LEU 158   1.498  16.010 -35.715
 1296    HA   LEU 158           HA       LEU 158   0.191  14.834 -37.979
 1297    HB2  LEU 158           HB2      LEU 158  -1.005  15.798 -35.351
 1298    HB3  LEU 158           HB3      LEU 158  -1.782  14.695 -36.484
 1299    HG   LEU 158           HG       LEU 158   0.774  14.093 -34.936
 1300   HD11  LEU 158          HD11      LEU 158  -0.647  12.628 -33.583
 1301   HD12  LEU 158          HD12      LEU 158  -1.202  14.314 -33.469
 1302   HD13  LEU 158          HD13      LEU 158  -2.096  13.156 -34.476
 1303   HD21  LEU 158          HD21      LEU 158  -0.987  12.297 -36.664
 1304   HD22  LEU 158          HD22      LEU 158   0.675  12.804 -37.033
 1305   HD23  LEU 158          HD23      LEU 158   0.363  11.750 -35.648
 1306    H    GLN 159           H        GLN 159   0.161  18.097 -36.622
 1307    HA   GLN 159           HA       GLN 159  -2.033  18.898 -38.468
 1308    HB2  GLN 159           HB2      GLN 159  -0.739  20.616 -36.317
 1309    HB3  GLN 159           HB3      GLN 159  -2.240  20.913 -37.181
 1310    HG2  GLN 159           HG2      GLN 159  -1.679  18.828 -35.064
 1311    HG3  GLN 159           HG3      GLN 159  -2.795  20.185 -35.024
 1312   HE21  GLN 159          HE22      GLN 159  -2.695  16.824 -35.370
 1313   HE22  GLN 159          HE21      GLN 159  -4.300  16.632 -36.053
 1314    H    GLU 160           H        GLU 160   1.412  19.678 -37.683
 1315    HA   GLU 160           HA       GLU 160   1.738  21.695 -39.604
 1316    HB2  GLU 160           HB2      GLU 160   3.216  21.104 -37.664
 1317    HB3  GLU 160           HB3      GLU 160   3.815  19.712 -38.573
 1318    HG2  GLU 160           HG2      GLU 160   4.750  21.218 -40.292
 1319    HG3  GLU 160           HG3      GLU 160   4.030  22.616 -39.490
 1320    H    ASN 161           H        ASN 161   1.569  18.241 -40.067
 1321    HA   ASN 161           HA       ASN 161   3.023  17.947 -42.487
 1322    HB2  ASN 161           HB2      ASN 161   2.446  16.035 -41.137
 1323    HB3  ASN 161           HB3      ASN 161   0.721  16.393 -41.248
 1324   HD21  ASN 161          HD22      ASN 161  -0.446  15.690 -43.107
 1325   HD22  ASN 161          HD21      ASN 161   0.295  14.652 -44.306
 1326    H    THR 162           H        THR 162  -0.430  18.816 -41.917
 1327    HA   THR 162           HA       THR 162  -0.720  19.363 -44.763
 1328    HB   THR 162           HB       THR 162  -3.146  18.238 -44.196
 1329    HG1  THR 162           HG1      THR 162  -2.841  16.455 -42.997
 1330   HG21  THR 162          HG21      THR 162  -2.282  16.325 -45.534
 1331   HG22  THR 162          HG22      THR 162  -1.863  17.899 -46.232
 1332   HG23  THR 162          HG23      THR 162  -0.635  16.976 -45.342
 1333    HA   PRO 163           HA       PRO 163  -4.093  22.087 -43.088
 1334    HB2  PRO 163           HB2      PRO 163  -4.815  22.142 -40.425
 1335    HB3  PRO 163           HB3      PRO 163  -5.519  21.030 -41.639
 1336    HG2  PRO 163           HG2      PRO 163  -3.256  20.486 -39.697
 1337    HG3  PRO 163           HG3      PRO 163  -4.699  19.473 -40.020
 1338    HD2  PRO 163           HD2      PRO 163  -2.335  18.913 -41.268
 1339    HD3  PRO 163           HD3      PRO 163  -3.870  18.819 -42.161
 1340    H    LYS 164           H        LYS 164  -1.339  21.673 -40.929
 1341    HA   LYS 164           HA       LYS 164  -0.126  23.058 -39.651
 1342    HB2  LYS 164           HB2      LYS 164   1.203  24.641 -40.886
 1343    HB3  LYS 164           HB3      LYS 164   1.089  23.101 -41.701
 1344    HG2  LYS 164           HG2      LYS 164  -0.198  23.901 -43.461
 1345    HG3  LYS 164           HG3      LYS 164  -0.835  25.263 -42.563
 1346    HD2  LYS 164           HD2      LYS 164   2.002  24.997 -43.631
 1347    HD3  LYS 164           HD3      LYS 164   0.720  26.014 -44.286
 1348    HE2  LYS 164           HE2      LYS 164   2.202  26.351 -41.653
 1349    HE3  LYS 164           HE3      LYS 164   2.209  27.433 -43.042
 1350    HZ1  LYS 164           HZ1      LYS 164  -0.103  26.928 -41.239
 1351    HZ2  LYS 164           HZ2      LYS 164   0.803  28.290 -41.307
 1352    HZ3  LYS 164           HZ3      LYS 164  -0.153  27.902 -42.573
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1  -1.132   1.215  -1.380
    2    H2   MET   1           H2       MET   1  -1.279   1.046  -2.999
    3    H3   MET   1           H3       MET   1  -1.272  -0.279  -2.021
    4    HA   MET   1           HA       MET   1   0.995   0.186  -1.338
    5    HB2  MET   1           HB2      MET   1   2.162  -0.574  -3.304
    6    HB3  MET   1           HB3      MET   1   0.646  -1.439  -3.148
    7    HG2  MET   1           HG2      MET   1  -0.350   0.039  -4.913
    8    HG3  MET   1           HG3      MET   1   1.215   0.823  -5.112
    9    HE1  MET   1           HE1      MET   1   3.307  -0.245  -6.272
   10    HE2  MET   1           HE2      MET   1   3.370  -1.558  -5.072
   11    HE3  MET   1           HE3      MET   1   3.399  -1.938  -6.804
   12    H    ILE   2           H        ILE   2   2.795   1.586  -1.257
   13    HA   ILE   2           HA       ILE   2   2.816   3.998  -2.953
   14    HB   ILE   2           HB       ILE   2   3.396   4.000   0.037
   15   HG12  ILE   2          HG12      ILE   2   0.958   3.878  -0.238
   16   HG13  ILE   2          HG13      ILE   2   1.487   5.388   0.460
   17   HG21  ILE   2          HG21      ILE   2   4.768   5.611  -1.199
   18   HG22  ILE   2          HG22      ILE   2   3.329   6.316  -1.941
   19   HG23  ILE   2          HG23      ILE   2   3.589   6.454  -0.191
   20   HD11  ILE   2          HD11      ILE   2   1.065   6.603  -1.607
   21   HD12  ILE   2          HD12      ILE   2   0.738   5.101  -2.486
   22   HD13  ILE   2          HD13      ILE   2  -0.362   5.643  -1.208
   23    H    ASP   3           H        ASP   3   4.988   4.465  -3.514
   24    HA   ASP   3           HA       ASP   3   6.909   2.319  -3.467
   25    HB2  ASP   3           HB2      ASP   3   6.754   3.942  -5.302
   26    HB3  ASP   3           HB3      ASP   3   7.081   5.264  -4.187
   27    H    ASP   4           H        ASP   4   8.962   2.357  -2.396
   28    HA   ASP   4           HA       ASP   4   8.698   2.748   0.364
   29    HB2  ASP   4           HB2      ASP   4  10.155   1.065  -0.667
   30    HB3  ASP   4           HB3      ASP   4  11.196   2.331  -1.318
   31    H    ASP   5           H        ASP   5   9.996   5.025  -2.025
   32    HA   ASP   5           HA       ASP   5  11.304   6.626   0.015
   33    HB2  ASP   5           HB2      ASP   5  12.181   6.372  -2.335
   34    HB3  ASP   5           HB3      ASP   5  10.831   7.382  -2.870
   35    H    GLY   6           H        GLY   6   8.151   6.146  -0.705
   36    HA2  GLY   6           HA2      GLY   6   6.372   7.134   0.386
   37    HA3  GLY   6           HA3      GLY   6   7.282   8.640   0.587
   38    H    TYR   7           H        TYR   7   6.867   6.823  -2.496
   39    HA   TYR   7           HA       TYR   7   5.481   9.221  -3.605
   40    HB2  TYR   7           HB2      TYR   7   7.565   7.374  -4.787
   41    HB3  TYR   7           HB3      TYR   7   6.408   8.197  -5.826
   42    HD1  TYR   7           HD1      TYR   7   8.936   8.856  -3.124
   43    HD2  TYR   7           HD2      TYR   7   6.695  10.457  -6.440
   44    HE1  TYR   7           HE1      TYR   7  10.119  10.980  -2.872
   45    HE2  TYR   7           HE2      TYR   7   7.837  12.624  -6.161
   46    HH   TYR   7           HH       TYR   7  10.404  13.187  -3.701
   47    H    ARG   8           H        ARG   8   3.508   8.957  -4.577
   48    HA   ARG   8           HA       ARG   8   2.326   6.246  -4.370
   49    HB2  ARG   8           HB2      ARG   8   0.999   8.234  -3.769
   50    HB3  ARG   8           HB3      ARG   8   1.131   8.825  -5.421
   51    HG2  ARG   8           HG2      ARG   8  -0.117   6.737  -6.161
   52    HG3  ARG   8           HG3      ARG   8  -0.236   6.283  -4.443
   53    HD2  ARG   8           HD2      ARG   8  -1.465   8.479  -4.067
   54    HD3  ARG   8           HD3      ARG   8  -1.479   8.678  -5.838
   55    HE   ARG   8           HE       ARG   8  -2.516   6.099  -5.042
   56   HH11  ARG   8          HH11      ARG   8  -3.468   9.529  -5.200
   57   HH12  ARG   8          HH12      ARG   8  -5.158   9.191  -5.305
   58   HH21  ARG   8          HH21      ARG   8  -4.776   5.663  -5.168
   59   HH22  ARG   8          HH22      ARG   8  -5.911   6.953  -5.280
   60    HA   PRO   9           HA       PRO   9   3.571   5.608  -8.711
   61    HB2  PRO   9           HB2      PRO   9   2.582   3.094  -9.126
   62    HB3  PRO   9           HB3      PRO   9   4.016   3.412  -8.112
   63    HG2  PRO   9           HG2      PRO   9   1.153   2.969  -7.208
   64    HG3  PRO   9           HG3      PRO   9   2.653   2.215  -6.577
   65    HD2  PRO   9           HD2      PRO   9   1.485   4.393  -5.395
   66    HD3  PRO   9           HD3      PRO   9   3.260   4.151  -5.408
   67    H    ASN  10           H        ASN  10   2.470   6.691 -10.335
   68    HA   ASN  10           HA       ASN  10  -0.461   6.272 -10.639
   69    HB2  ASN  10           HB2      ASN  10   0.992   8.954 -10.769
   70    HB3  ASN  10           HB3      ASN  10  -0.668   8.696 -11.236
   71   HD21  ASN  10          HD22      ASN  10   1.521   8.446  -8.396
   72   HD22  ASN  10          HD21      ASN  10   0.296   9.112  -7.319
   73    H    VAL  11           H        VAL  11  -1.199   7.015 -12.752
   74    HA   VAL  11           HA       VAL  11   0.829   7.199 -14.915
   75    HB   VAL  11           HB       VAL  11  -1.029   6.189 -16.354
   76   HG11  VAL  11          HG11      VAL  11   0.286   4.349 -14.317
   77   HG12  VAL  11          HG12      VAL  11  -0.340   3.891 -15.916
   78   HG13  VAL  11          HG13      VAL  11   1.059   4.976 -15.792
   79   HG21  VAL  11          HG21      VAL  11  -2.877   6.300 -14.689
   80   HG22  VAL  11          HG22      VAL  11  -2.603   4.657 -15.268
   81   HG23  VAL  11          HG23      VAL  11  -2.034   5.101 -13.670
   82    H    GLY  12           H        GLY  12   0.347   8.855 -16.395
   83    HA2  GLY  12           HA2      GLY  12  -2.133  10.475 -15.953
   84    HA3  GLY  12           HA3      GLY  12  -0.575  11.179 -16.403
   85    H    ILE  13           H        ILE  13  -3.172  11.119 -17.936
   86    HA   ILE  13           HA       ILE  13  -2.276   9.700 -20.415
   87    HB   ILE  13           HB       ILE  13  -5.041  10.239 -19.281
   88   HG12  ILE  13          HG12      ILE  13  -5.459   7.958 -20.422
   89   HG13  ILE  13          HG13      ILE  13  -3.717   7.856 -20.643
   90   HG21  ILE  13          HG21      ILE  13  -5.147  11.311 -21.437
   91   HG22  ILE  13          HG22      ILE  13  -4.437   9.879 -22.247
   92   HG23  ILE  13          HG23      ILE  13  -6.050   9.813 -21.485
   93   HD11  ILE  13          HD11      ILE  13  -4.591   6.611 -18.714
   94   HD12  ILE  13          HD12      ILE  13  -3.431   7.837 -18.187
   95   HD13  ILE  13          HD13      ILE  13  -5.192   8.099 -17.977
   96    H    VAL  14           H        VAL  14  -1.769  11.024 -22.090
   97    HA   VAL  14           HA       VAL  14  -2.628  13.885 -21.936
   98    HB   VAL  14           HB       VAL  14  -0.295  12.694 -23.508
   99   HG11  VAL  14          HG11      VAL  14  -1.082  15.596 -23.012
  100   HG12  VAL  14          HG12      VAL  14   0.332  15.014 -23.925
  101   HG13  VAL  14          HG13      VAL  14  -1.289  14.710 -24.545
  102   HG21  VAL  14          HG21      VAL  14   0.370  12.588 -21.241
  103   HG22  VAL  14          HG22      VAL  14   1.134  14.018 -21.932
  104   HG23  VAL  14          HG23      VAL  14  -0.284  14.222 -20.891
  105    H    ILE  15           H        ILE  15  -4.783  13.360 -22.795
  106    HA   ILE  15           HA       ILE  15  -4.944  11.937 -25.341
  107    HB   ILE  15           HB       ILE  15  -7.021  13.888 -24.255
  108   HG12  ILE  15          HG12      ILE  15  -6.836  11.956 -22.736
  109   HG13  ILE  15          HG13      ILE  15  -8.373  12.024 -23.577
  110   HG21  ILE  15          HG21      ILE  15  -7.272  13.696 -26.623
  111   HG22  ILE  15          HG22      ILE  15  -7.102  11.936 -26.578
  112   HG23  ILE  15          HG23      ILE  15  -8.532  12.728 -25.875
  113   HD11  ILE  15          HD11      ILE  15  -7.371   9.698 -23.473
  114   HD12  ILE  15          HD12      ILE  15  -7.751  10.260 -25.106
  115   HD13  ILE  15          HD13      ILE  15  -6.075  10.277 -24.545
  116    H    CYS  16           H        CYS  16  -4.548  12.654 -27.226
  117    HA   CYS  16           HA       CYS  16  -4.375  15.593 -27.756
  118    HB2  CYS  16           HB2      CYS  16  -2.617  13.361 -28.849
  119    HB3  CYS  16           HB3      CYS  16  -2.794  14.961 -29.645
  120    HG   CYS  16           HG       CYS  16  -1.966  14.267 -26.513
  121    H    ASN  17           H        ASN  17  -5.689  16.215 -29.440
  122    HA   ASN  17           HA       ASN  17  -7.706  14.113 -30.072
  123    HB2  ASN  17           HB2      ASN  17  -8.052  17.127 -29.900
  124    HB3  ASN  17           HB3      ASN  17  -9.320  15.935 -30.187
  125   HD21  ASN  17          HD22      ASN  17  -7.085  17.218 -27.710
  126   HD22  ASN  17          HD21      ASN  17  -7.886  16.391 -26.384
  127    H    ARG  18           H        ARG  18  -5.295  14.402 -31.734
  128    HA   ARG  18           HA       ARG  18  -4.572  14.662 -33.850
  129    HB2  ARG  18           HB2      ARG  18  -7.418  13.723 -34.374
  130    HB3  ARG  18           HB3      ARG  18  -6.152  13.812 -35.610
  131    HG2  ARG  18           HG2      ARG  18  -4.704  12.320 -34.303
  132    HG3  ARG  18           HG3      ARG  18  -5.956  12.158 -33.055
  133    HD2  ARG  18           HD2      ARG  18  -6.517  11.598 -35.980
  134    HD3  ARG  18           HD3      ARG  18  -5.796  10.360 -34.940
  135    HE   ARG  18           HE       ARG  18  -7.721  10.502 -33.446
  136   HH11  ARG  18          HH11      ARG  18  -8.258  11.582 -36.803
  137   HH12  ARG  18          HH12      ARG  18  -9.972  11.379 -36.730
  138   HH21  ARG  18          HH21      ARG  18  -9.931  10.241 -33.351
  139   HH22  ARG  18          HH22      ARG  18 -10.959  10.559 -34.714
  140    H    GLN  19           H        GLN  19  -5.999  17.107 -32.666
  141    HA   GLN  19           HA       GLN  19  -6.067  18.665 -35.220
  142    HB2  GLN  19           HB2      GLN  19  -7.428  19.103 -32.534
  143    HB3  GLN  19           HB3      GLN  19  -7.458  20.279 -33.851
  144    HG2  GLN  19           HG2      GLN  19  -8.860  18.990 -35.194
  145    HG3  GLN  19           HG3      GLN  19  -8.445  17.473 -34.401
  146   HE21  GLN  19          HE22      GLN  19  -9.510  16.846 -32.473
  147   HE22  GLN  19          HE21      GLN  19 -10.816  17.795 -31.745
  148    H    GLY  20           H        GLY  20  -3.772  17.860 -33.028
  149    HA2  GLY  20           HA2      GLY  20  -1.879  18.923 -32.229
  150    HA3  GLY  20           HA3      GLY  20  -2.368  20.420 -33.023
  151    H    GLN  21           H        GLN  21  -4.638  18.850 -30.840
  152    HA   GLN  21           HA       GLN  21  -4.304  21.109 -28.922
  153    HB2  GLN  21           HB2      GLN  21  -7.019  20.087 -29.768
  154    HB3  GLN  21           HB3      GLN  21  -6.640  21.513 -28.822
  155    HG2  GLN  21           HG2      GLN  21  -6.278  21.078 -31.784
  156    HG3  GLN  21           HG3      GLN  21  -7.358  22.195 -30.987
  157   HE21  GLN  21          HE22      GLN  21  -4.658  22.239 -32.918
  158   HE22  GLN  21          HE21      GLN  21  -3.876  23.660 -32.281
  159    H    VAL  22           H        VAL  22  -4.798  20.586 -26.801
  160    HA   VAL  22           HA       VAL  22  -4.489  17.659 -26.281
  161    HB   VAL  22           HB       VAL  22  -3.204  18.301 -24.305
  162   HG11  VAL  22          HG11      VAL  22  -1.199  19.015 -25.463
  163   HG12  VAL  22          HG12      VAL  22  -2.090  17.878 -26.481
  164   HG13  VAL  22          HG13      VAL  22  -2.146  19.622 -26.837
  165   HG21  VAL  22          HG21      VAL  22  -2.424  20.594 -23.969
  166   HG22  VAL  22          HG22      VAL  22  -3.413  21.171 -25.322
  167   HG23  VAL  22          HG23      VAL  22  -4.193  20.543 -23.863
  168    H    MET  23           H        MET  23  -5.119  16.815 -24.264
  169    HA   MET  23           HA       MET  23  -7.772  17.041 -23.486
  170    HB2  MET  23           HB2      MET  23  -6.049  15.211 -22.983
  171    HB3  MET  23           HB3      MET  23  -5.378  16.244 -21.747
  172    HG2  MET  23           HG2      MET  23  -6.865  14.590 -20.758
  173    HG3  MET  23           HG3      MET  23  -7.510  16.210 -20.517
  174    HE1  MET  23           HE1      MET  23  -9.896  15.510 -19.876
  175    HE2  MET  23           HE2      MET  23 -10.853  14.292 -20.747
  176    HE3  MET  23           HE3      MET  23  -9.368  13.811 -19.892
  177    H    TRP  24           H        TRP  24  -8.889  18.384 -22.065
  178    HA   TRP  24           HA       TRP  24  -7.698  19.296 -19.677
  179    HB2  TRP  24           HB2      TRP  24  -7.232  21.095 -21.647
  180    HB3  TRP  24           HB3      TRP  24  -8.857  21.587 -21.241
  181    HD1  TRP  24           HD1      TRP  24  -8.471  23.723 -20.002
  182    HE1  TRP  24           HE1      TRP  24  -7.182  24.527 -17.941
  183    HE3  TRP  24           HE3      TRP  24  -5.638  19.540 -19.154
  184    HZ2  TRP  24           HZ2      TRP  24  -5.213  23.424 -16.086
  185    HZ3  TRP  24           HZ3      TRP  24  -4.075  19.451 -17.266
  186    HH2  TRP  24           HH2      TRP  24  -3.866  21.369 -15.692
  187    H    ALA  25           H        ALA  25  -9.371  19.454 -18.144
  188    HA   ALA  25           HA       ALA  25 -12.150  19.669 -18.996
  189    HB1  ALA  25           HB1      ALA  25 -11.093  17.112 -17.690
  190    HB2  ALA  25           HB2      ALA  25 -12.805  17.555 -17.832
  191    HB3  ALA  25           HB3      ALA  25 -11.853  17.253 -19.301
  192    H    ARG  26           H        ARG  26 -13.477  20.263 -17.163
  193    HA   ARG  26           HA       ARG  26 -11.898  21.788 -15.234
  194    HB2  ARG  26           HB2      ARG  26 -13.923  22.718 -16.301
  195    HB3  ARG  26           HB3      ARG  26 -14.918  21.440 -15.581
  196    HG2  ARG  26           HG2      ARG  26 -14.459  22.289 -13.330
  197    HG3  ARG  26           HG3      ARG  26 -13.262  23.430 -13.968
  198    HD2  ARG  26           HD2      ARG  26 -15.263  24.644 -13.466
  199    HD3  ARG  26           HD3      ARG  26 -15.066  24.613 -15.223
  200    HE   ARG  26           HE       ARG  26 -16.688  22.442 -14.791
  201   HH11  ARG  26          HH11      ARG  26 -17.022  25.874 -13.825
  202   HH12  ARG  26          HH12      ARG  26 -18.744  25.829 -13.878
  203   HH21  ARG  26          HH21      ARG  26 -18.834  22.416 -14.941
  204   HH22  ARG  26          HH22      ARG  26 -19.846  23.783 -14.514
  205    H    ARG  27           H        ARG  27 -11.729  21.282 -12.944
  206    HA   ARG  27           HA       ARG  27 -12.002  18.453 -12.509
  207    HB2  ARG  27           HB2      ARG  27 -10.094  19.945 -11.729
  208    HB3  ARG  27           HB3      ARG  27 -11.132  20.426 -10.400
  209    HG2  ARG  27           HG2      ARG  27 -10.221  17.583 -11.051
  210    HG3  ARG  27           HG3      ARG  27  -9.532  18.653  -9.821
  211    HD2  ARG  27           HD2      ARG  27 -11.674  18.592  -8.589
  212    HD3  ARG  27           HD3      ARG  27 -12.283  17.414  -9.776
  213    HE   ARG  27           HE       ARG  27  -9.812  16.458  -8.814
  214   HH11  ARG  27          HH21      ARG  27 -13.112  17.068  -7.551
  215   HH12  ARG  27          HH22      ARG  27 -12.990  15.868  -6.309
  216   HH21  ARG  27          HH11      ARG  27  -9.793  14.682  -7.358
  217   HH22  ARG  27          HH12      ARG  27 -11.039  14.518  -6.162
  218    H    PHE  28           H        PHE  28 -13.707  17.496 -11.773
  219    HA   PHE  28           HA       PHE  28 -16.220  18.530 -11.105
  220    HB2  PHE  28           HB2      PHE  28 -15.868  16.265 -11.815
  221    HB3  PHE  28           HB3      PHE  28 -14.689  15.972 -10.552
  222    HD1  PHE  28           HD2      PHE  28 -18.338  16.485 -11.142
  223    HD2  PHE  28           HD1      PHE  28 -15.243  15.054  -8.504
  224    HE1  PHE  28           HE2      PHE  28 -20.044  15.284  -9.806
  225    HE2  PHE  28           HE1      PHE  28 -16.956  13.753  -7.214
  226    HZ   PHE  28           HZ       PHE  28 -19.357  13.903  -7.846
  227    H    GLY  29           H        GLY  29 -17.078  19.379  -9.232
  228    HA2  GLY  29           HA2      GLY  29 -17.444  19.781  -7.015
  229    HA3  GLY  29           HA3      GLY  29 -16.128  18.674  -6.604
  230    H    GLN  30           H        GLN  30 -14.071  20.140  -8.159
  231    HA   GLN  30           HA       GLN  30 -13.451  22.215  -6.197
  232    HB2  GLN  30           HB2      GLN  30 -11.902  20.390  -7.165
  233    HB3  GLN  30           HB3      GLN  30 -11.840  21.397  -8.622
  234    HG2  GLN  30           HG2      GLN  30 -10.979  23.276  -7.172
  235    HG3  GLN  30           HG3      GLN  30 -10.954  22.151  -5.813
  236   HE21  GLN  30          HE22      GLN  30  -9.410  23.031  -8.886
  237   HE22  GLN  30          HE21      GLN  30  -8.049  21.929  -8.758
  238    H    HIS  31           H        HIS  31 -14.440  21.988  -9.595
  239    HA   HIS  31           HA       HIS  31 -15.021  23.432 -11.154
  240    HB2  HIS  31           HB2      HIS  31 -15.722  25.341  -8.912
  241    HB3  HIS  31           HB3      HIS  31 -16.308  25.405 -10.570
  242    HD1  HIS  31           HD1      HIS  31 -17.977  23.277 -11.318
  243    HD2  HIS  31           HD2      HIS  31 -17.014  23.733  -7.244
  244    HE1  HIS  31           HE1      HIS  31 -19.621  21.832 -10.031
  245    H    SER  32           H        SER  32 -12.279  23.290 -10.590
  246    HA   SER  32           HA       SER  32 -11.429  25.556 -12.200
  247    HB2  SER  32           HB2      SER  32  -9.353  25.851 -10.776
  248    HB3  SER  32           HB3      SER  32 -10.854  26.479 -10.089
  249    HG   SER  32           HG       SER  32  -9.795  25.372  -8.489
  250    H    TRP  33           H        TRP  33  -9.030  24.877 -13.014
  251    HA   TRP  33           HA       TRP  33  -9.567  22.245 -14.139
  252    HB2  TRP  33           HB2      TRP  33  -7.261  24.123 -14.698
  253    HB3  TRP  33           HB3      TRP  33  -7.805  22.755 -15.666
  254    HD1  TRP  33           HD1      TRP  33  -8.606  26.394 -14.939
  255    HE1  TRP  33           HE1      TRP  33 -10.302  27.283 -16.614
  256    HE3  TRP  33           HE3      TRP  33  -9.755  22.015 -17.306
  257    HZ2  TRP  33           HZ2      TRP  33 -11.945  26.233 -18.773
  258    HZ3  TRP  33           HZ3      TRP  33 -11.340  21.997 -19.224
  259    HH2  TRP  33           HH2      TRP  33 -12.434  24.098 -19.962
  260    H    GLN  34           H        GLN  34  -7.928  20.527 -14.361
  261    HA   GLN  34           HA       GLN  34  -5.746  20.374 -12.418
  262    HB2  GLN  34           HB2      GLN  34  -7.852  19.526 -11.234
  263    HB3  GLN  34           HB3      GLN  34  -7.982  18.293 -12.492
  264    HG2  GLN  34           HG2      GLN  34  -5.491  17.707 -11.663
  265    HG3  GLN  34           HG3      GLN  34  -6.016  18.559 -10.222
  266   HE21  GLN  34          HE22      GLN  34  -6.287  15.611 -12.129
  267   HE22  GLN  34          HE21      GLN  34  -7.297  14.737 -10.975
  268    H    PHE  35           H        PHE  35  -4.164  18.756 -13.211
  269    HA   PHE  35           HA       PHE  35  -4.696  17.897 -15.946
  270    HB2  PHE  35           HB2      PHE  35  -2.474  17.337 -16.205
  271    HB3  PHE  35           HB3      PHE  35  -2.569  18.897 -15.455
  272    HD1  PHE  35           HD2      PHE  35  -2.803  16.179 -12.928
  273    HD2  PHE  35           HD1      PHE  35  -0.129  18.473 -15.409
  274    HE1  PHE  35           HE2      PHE  35  -0.898  15.452 -11.562
  275    HE2  PHE  35           HE1      PHE  35   1.776  17.775 -13.990
  276    HZ   PHE  35           HZ       PHE  35   1.386  16.260 -12.058
  277    HA   PRO  36           HA       PRO  36  -5.974  13.809 -15.067
  278    HB2  PRO  36           HB2      PRO  36  -4.036  12.829 -17.148
  279    HB3  PRO  36           HB3      PRO  36  -5.775  12.442 -16.954
  280    HG2  PRO  36           HG2      PRO  36  -5.025  14.240 -18.839
  281    HG3  PRO  36           HG3      PRO  36  -6.427  14.599 -17.783
  282    HD2  PRO  36           HD2      PRO  36  -3.547  15.545 -17.469
  283    HD3  PRO  36           HD3      PRO  36  -5.058  16.496 -17.415
  284    H    GLN  37           H        GLN  37  -5.423  12.056 -13.780
  285    HA   GLN  37           HA       GLN  37  -2.836  10.938 -13.482
  286    HB2  GLN  37           HB2      GLN  37  -2.460  11.492 -11.078
  287    HB3  GLN  37           HB3      GLN  37  -2.046  12.734 -12.242
  288    HG2  GLN  37           HG2      GLN  37  -4.024  14.046 -11.702
  289    HG3  GLN  37           HG3      GLN  37  -4.690  12.752 -10.702
  290   HE21  GLN  37          HE22      GLN  37  -3.245  12.086  -8.747
  291   HE22  GLN  37          HE21      GLN  37  -2.525  13.418  -7.881
  292    H    GLY  38           H        GLY  38  -3.094   8.871 -12.528
  293    HA2  GLY  38           HA2      GLY  38  -5.249   8.432 -10.574
  294    HA3  GLY  38           HA3      GLY  38  -5.375   7.500 -12.078
  295    H    GLY  39           H        GLY  39  -4.767   6.653  -9.209
  296    HA2  GLY  39           HA2      GLY  39  -2.023   5.925  -8.974
  297    HA3  GLY  39           HA3      GLY  39  -3.375   5.331  -8.006
  298    H    ILE  40           H        ILE  40  -1.172   3.836  -9.056
  299    HA   ILE  40           HA       ILE  40  -2.236   2.143 -11.221
  300    HB   ILE  40           HB       ILE  40   0.357   2.154  -9.652
  301   HG12  ILE  40          HG12      ILE  40  -0.444   2.796 -12.531
  302   HG13  ILE  40          HG13      ILE  40   0.087   3.937 -11.309
  303   HG21  ILE  40          HG21      ILE  40   1.178   0.344 -11.090
  304   HG22  ILE  40          HG22      ILE  40  -0.187  -0.197 -10.145
  305   HG23  ILE  40          HG23      ILE  40  -0.416   0.209 -11.862
  306   HD11  ILE  40          HD11      ILE  40   1.892   3.613 -12.815
  307   HD12  ILE  40          HD12      ILE  40   2.357   2.776 -11.328
  308   HD13  ILE  40          HD13      ILE  40   1.774   1.853 -12.739
  309    H    ASN  41           H        ASN  41  -3.115   0.128 -10.994
  310    HA   ASN  41           HA       ASN  41  -4.105  -0.613  -8.345
  311    HB2  ASN  41           HB2      ASN  41  -5.649  -0.749 -10.221
  312    HB3  ASN  41           HB3      ASN  41  -4.528  -1.769 -11.119
  313   HD21  ASN  41          HD22      ASN  41  -6.683  -1.700  -8.234
  314   HD22  ASN  41          HD21      ASN  41  -6.804  -3.436  -8.108
  315    HA   PRO  42           HA       PRO  42  -0.669  -3.058  -7.480
  316    HB2  PRO  42           HB2      PRO  42  -2.521  -4.926  -5.972
  317    HB3  PRO  42           HB3      PRO  42  -0.943  -4.248  -5.458
  318    HG2  PRO  42           HG2      PRO  42  -3.243  -3.130  -4.576
  319    HG3  PRO  42           HG3      PRO  42  -1.908  -2.075  -5.148
  320    HD2  PRO  42           HD2      PRO  42  -4.387  -2.948  -6.652
  321    HD3  PRO  42           HD3      PRO  42  -3.656  -1.322  -6.508
  322    H    GLY  43           H        GLY  43   0.303  -4.085  -8.957
  323    HA2  GLY  43           HA2      GLY  43   1.127  -6.004 -10.011
  324    HA3  GLY  43           HA3      GLY  43  -0.363  -6.880  -9.617
  325    H    GLU  44           H        GLU  44  -1.292  -3.899 -10.916
  326    HA   GLU  44           HA       GLU  44  -1.623  -5.020 -13.660
  327    HB2  GLU  44           HB2      GLU  44  -3.604  -4.118 -12.488
  328    HB3  GLU  44           HB3      GLU  44  -2.809  -2.532 -12.382
  329    HG2  GLU  44           HG2      GLU  44  -2.758  -2.300 -14.753
  330    HG3  GLU  44           HG3      GLU  44  -3.216  -3.991 -14.999
  331    H    SER  45           H        SER  45  -0.046  -4.535 -15.124
  332    HA   SER  45           HA       SER  45   2.058  -2.744 -14.455
  333    HB2  SER  45           HB2      SER  45   1.587  -3.984 -17.153
  334    HB3  SER  45           HB3      SER  45   3.111  -3.443 -16.453
  335    HG   SER  45           HG       SER  45   2.835  -5.740 -16.294
  336    H    ALA  46           H        ALA  46   2.894  -1.092 -15.882
  337    HA   ALA  46           HA       ALA  46   1.547   1.203 -15.553
  338    HB1  ALA  46           HB1      ALA  46   3.178   2.177 -17.141
  339    HB2  ALA  46           HB2      ALA  46   3.957   0.941 -16.131
  340    HB3  ALA  46           HB3      ALA  46   3.507   0.551 -17.807
  341    H    GLU  47           H        GLU  47   1.458  -0.714 -18.622
  342    HA   GLU  47           HA       GLU  47  -0.024   1.392 -19.966
  343    HB2  GLU  47           HB2      GLU  47   0.590  -1.495 -20.704
  344    HB3  GLU  47           HB3      GLU  47  -0.411  -0.448 -21.713
  345    HG2  GLU  47           HG2      GLU  47   1.397   1.132 -22.018
  346    HG3  GLU  47           HG3      GLU  47   2.432   0.263 -20.877
  347    H    GLN  48           H        GLN  48  -0.849  -1.765 -18.452
  348    HA   GLN  48           HA       GLN  48  -3.639  -1.715 -19.099
  349    HB2  GLN  48           HB2      GLN  48  -2.190  -3.131 -16.829
  350    HB3  GLN  48           HB3      GLN  48  -3.846  -3.420 -17.357
  351    HG2  GLN  48           HG2      GLN  48  -2.896  -5.094 -18.534
  352    HG3  GLN  48           HG3      GLN  48  -2.589  -3.841 -19.733
  353   HE21  GLN  48          HE22      GLN  48  -0.330  -3.273 -20.143
  354   HE22  GLN  48          HE21      GLN  48   0.991  -3.960 -19.251
  355    H    ALA  49           H        ALA  49  -1.775  -0.470 -16.297
  356    HA   ALA  49           HA       ALA  49  -4.006   0.549 -14.820
  357    HB1  ALA  49           HB1      ALA  49  -1.097   1.460 -14.894
  358    HB2  ALA  49           HB2      ALA  49  -2.299   1.886 -13.661
  359    HB3  ALA  49           HB3      ALA  49  -1.777   0.195 -13.832
  360    H    MET  50           H        MET  50  -1.986   1.971 -17.467
  361    HA   MET  50           HA       MET  50  -3.104   4.594 -17.303
  362    HB2  MET  50           HB2      MET  50  -1.056   4.167 -18.466
  363    HB3  MET  50           HB3      MET  50  -1.831   3.070 -19.591
  364    HG2  MET  50           HG2      MET  50  -2.500   6.001 -19.350
  365    HG3  MET  50           HG3      MET  50  -1.397   5.307 -20.520
  366    HE1  MET  50           HE1      MET  50  -1.910   4.147 -22.669
  367    HE2  MET  50           HE2      MET  50  -2.585   2.768 -21.758
  368    HE3  MET  50           HE3      MET  50  -3.494   3.478 -23.107
  369    H    TYR  51           H        TYR  51  -4.204   1.674 -19.156
  370    HA   TYR  51           HA       TYR  51  -6.521   3.050 -20.033
  371    HB2  TYR  51           HB2      TYR  51  -6.292   0.080 -19.533
  372    HB3  TYR  51           HB3      TYR  51  -7.563   0.929 -20.408
  373    HD1  TYR  51           HD2      TYR  51  -7.119   1.921 -22.680
  374    HD2  TYR  51           HD1      TYR  51  -4.126  -0.176 -20.473
  375    HE1  TYR  51           HE2      TYR  51  -5.874   1.553 -24.761
  376    HE2  TYR  51           HE1      TYR  51  -2.712  -0.405 -22.482
  377    HH   TYR  51           HH       TYR  51  -3.959   0.591 -25.764
  378    H    ARG  52           H        ARG  52  -5.874   1.390 -16.927
  379    HA   ARG  52           HA       ARG  52  -8.572   1.352 -15.975
  380    HB2  ARG  52           HB2      ARG  52  -6.485   0.267 -14.915
  381    HB3  ARG  52           HB3      ARG  52  -6.077   1.854 -14.290
  382    HG2  ARG  52           HG2      ARG  52  -7.116   0.761 -12.512
  383    HG3  ARG  52           HG3      ARG  52  -8.296   1.921 -13.117
  384    HD2  ARG  52           HD2      ARG  52  -9.364  -0.181 -12.550
  385    HD3  ARG  52           HD3      ARG  52  -9.487   0.082 -14.300
  386    HE   ARG  52           HE       ARG  52  -7.131  -1.456 -13.762
  387   HH11  ARG  52          HH11      ARG  52 -10.653  -1.906 -13.320
  388   HH12  ARG  52          HH12      ARG  52 -10.599  -3.604 -13.622
  389   HH21  ARG  52          HH21      ARG  52  -7.107  -3.627 -14.370
  390   HH22  ARG  52          HH22      ARG  52  -8.511  -4.637 -14.143
  391    H    ALA  53           H        ALA  53  -6.001   3.874 -15.818
  392    HA   ALA  53           HA       ALA  53  -7.646   5.821 -14.493
  393    HB1  ALA  53           HB1      ALA  53  -5.203   5.903 -14.441
  394    HB2  ALA  53           HB2      ALA  53  -5.149   6.138 -16.209
  395    HB3  ALA  53           HB3      ALA  53  -5.857   7.384 -15.165
  396    H    LEU  54           H        LEU  54  -7.084   5.054 -17.934
  397    HA   LEU  54           HA       LEU  54  -8.236   7.353 -19.149
  398    HB2  LEU  54           HB2      LEU  54  -6.912   5.590 -20.273
  399    HB3  LEU  54           HB3      LEU  54  -8.154   4.425 -19.828
  400    HG   LEU  54           HG       LEU  54  -9.780   5.477 -21.367
  401   HD11  LEU  54          HD11      LEU  54  -8.785   7.752 -21.495
  402   HD12  LEU  54          HD12      LEU  54  -7.308   7.080 -22.214
  403   HD13  LEU  54          HD13      LEU  54  -8.850   7.009 -23.104
  404   HD21  LEU  54          HD21      LEU  54  -8.779   4.456 -23.291
  405   HD22  LEU  54          HD22      LEU  54  -7.174   4.452 -22.483
  406   HD23  LEU  54          HD23      LEU  54  -8.539   3.513 -21.817
  407    H    PHE  55           H        PHE  55  -9.572   4.307 -17.975
  408    HA   PHE  55           HA       PHE  55 -12.326   4.927 -18.564
  409    HB2  PHE  55           HB2      PHE  55 -12.038   2.662 -18.486
  410    HB3  PHE  55           HB3      PHE  55 -10.808   2.729 -17.242
  411    HD1  PHE  55           HD2      PHE  55 -14.511   3.126 -17.726
  412    HD2  PHE  55           HD1      PHE  55 -11.262   2.297 -15.024
  413    HE1  PHE  55           HE2      PHE  55 -16.150   2.603 -15.925
  414    HE2  PHE  55           HE1      PHE  55 -12.904   1.742 -13.220
  415    HZ   PHE  55           HZ       PHE  55 -15.345   1.914 -13.671
  416    H    GLU  56           H        GLU  56 -10.461   5.009 -15.416
  417    HA   GLU  56           HA       GLU  56 -12.761   5.842 -13.959
  418    HB2  GLU  56           HB2      GLU  56  -9.775   6.037 -13.347
  419    HB3  GLU  56           HB3      GLU  56 -11.031   6.566 -12.223
  420    HG2  GLU  56           HG2      GLU  56 -12.045   4.289 -12.275
  421    HG3  GLU  56           HG3      GLU  56 -10.689   3.730 -13.255
  422    H    GLU  57           H        GLU  57 -10.339   7.781 -15.722
  423    HA   GLU  57           HA       GLU  57 -11.363  10.277 -14.552
  424    HB2  GLU  57           HB2      GLU  57  -9.129   9.813 -16.576
  425    HB3  GLU  57           HB3      GLU  57  -9.528  11.318 -15.759
  426    HG2  GLU  57           HG2      GLU  57  -9.051  10.161 -13.555
  427    HG3  GLU  57           HG3      GLU  57  -8.439   8.783 -14.478
  428    H    VAL  58           H        VAL  58 -11.069   8.770 -17.832
  429    HA   VAL  58           HA       VAL  58 -12.589  11.048 -18.923
  430    HB   VAL  58           HB       VAL  58 -11.209   8.999 -20.643
  431   HG11  VAL  58          HG11      VAL  58 -10.897  10.941 -22.112
  432   HG12  VAL  58          HG12      VAL  58 -12.595  10.777 -21.663
  433   HG13  VAL  58          HG13      VAL  58 -11.597  12.015 -20.882
  434   HG21  VAL  58          HG21      VAL  58  -9.131  10.401 -20.602
  435   HG22  VAL  58          HG22      VAL  58  -9.778  11.282 -19.201
  436   HG23  VAL  58          HG23      VAL  58  -9.394   9.546 -19.089
  437    H    GLY  59           H        GLY  59 -12.993   7.656 -18.166
  438    HA2  GLY  59           HA2      GLY  59 -14.795   6.264 -18.454
  439    HA3  GLY  59           HA3      GLY  59 -15.753   7.624 -19.056
  440    H    LEU  60           H        LEU  60 -12.617   6.415 -20.263
  441    HA   LEU  60           HA       LEU  60 -13.855   5.477 -22.807
  442    HB2  LEU  60           HB2      LEU  60 -11.219   6.908 -22.302
  443    HB3  LEU  60           HB3      LEU  60 -11.560   6.010 -23.764
  444    HG   LEU  60           HG       LEU  60 -12.894   8.530 -22.746
  445   HD11  LEU  60          HD11      LEU  60 -10.705   8.792 -23.881
  446   HD12  LEU  60          HD12      LEU  60 -11.312   7.887 -25.290
  447   HD13  LEU  60          HD13      LEU  60 -11.986   9.467 -24.896
  448   HD21  LEU  60          HD21      LEU  60 -13.758   6.851 -25.139
  449   HD22  LEU  60          HD22      LEU  60 -14.731   7.308 -23.732
  450   HD23  LEU  60          HD23      LEU  60 -14.239   8.537 -24.888
  451    H    SER  61           H        SER  61 -12.820   3.587 -23.696
  452    HA   SER  61           HA       SER  61 -11.657   1.871 -21.539
  453    HB2  SER  61           HB2      SER  61 -13.496   1.225 -23.860
  454    HB3  SER  61           HB3      SER  61 -12.949   0.090 -22.604
  455    HG   SER  61           HG       SER  61 -15.046   0.953 -22.146
  456    H    ARG  62           H        ARG  62 -10.864  -0.295 -22.908
  457    HA   ARG  62           HA       ARG  62  -8.320   0.608 -23.828
  458    HB2  ARG  62           HB2      ARG  62  -9.260  -2.290 -23.790
  459    HB3  ARG  62           HB3      ARG  62  -7.613  -1.661 -23.673
  460    HG2  ARG  62           HG2      ARG  62  -8.549  -0.504 -21.493
  461    HG3  ARG  62           HG3      ARG  62  -9.792  -1.742 -21.571
  462    HD2  ARG  62           HD2      ARG  62  -8.112  -3.511 -21.447
  463    HD3  ARG  62           HD3      ARG  62  -6.802  -2.308 -21.517
  464    HE   ARG  62           HE       ARG  62  -8.564  -1.702 -19.350
  465   HH11  ARG  62          HH11      ARG  62  -6.216  -4.239 -20.163
  466   HH12  ARG  62          HH12      ARG  62  -5.765  -4.533 -18.520
  467   HH21  ARG  62          HH21      ARG  62  -7.807  -1.950 -17.191
  468   HH22  ARG  62          HH22      ARG  62  -6.546  -3.063 -16.803
  469    H    LYS  63           H        LYS  63  -9.943   1.626 -25.635
  470    HA   LYS  63           HA       LYS  63  -9.235   0.398 -28.186
  471    HB2  LYS  63           HB2      LYS  63 -11.504  -0.154 -28.892
  472    HB3  LYS  63           HB3      LYS  63 -11.069  -1.060 -27.438
  473    HG2  LYS  63           HG2      LYS  63 -12.380   0.539 -26.045
  474    HG3  LYS  63           HG3      LYS  63 -12.848   1.423 -27.507
  475    HD2  LYS  63           HD2      LYS  63 -13.990  -0.566 -28.387
  476    HD3  LYS  63           HD3      LYS  63 -13.482  -1.511 -26.964
  477    HE2  LYS  63           HE2      LYS  63 -14.711   0.042 -25.480
  478    HE3  LYS  63           HE3      LYS  63 -15.183   1.033 -26.862
  479    HZ1  LYS  63           HZ1      LYS  63 -16.962  -0.481 -26.216
  480    HZ2  LYS  63           HZ2      LYS  63 -16.445  -0.870 -27.715
  481    HZ3  LYS  63           HZ3      LYS  63 -16.013  -1.793 -26.433
  482    H    ASP  64           H        ASP  64 -10.713   2.960 -26.281
  483    HA   ASP  64           HA       ASP  64 -11.798   4.390 -28.564
  484    HB2  ASP  64           HB2      ASP  64 -11.440   4.996 -25.623
  485    HB3  ASP  64           HB3      ASP  64 -12.223   6.122 -26.736
  486    H    VAL  65           H        VAL  65  -8.685   3.990 -27.671
  487    HA   VAL  65           HA       VAL  65  -7.748   6.549 -28.698
  488    HB   VAL  65           HB       VAL  65  -6.310   6.914 -26.736
  489   HG11  VAL  65          HG11      VAL  65  -9.222   6.837 -25.859
  490   HG12  VAL  65          HG12      VAL  65  -7.937   7.898 -25.261
  491   HG13  VAL  65          HG13      VAL  65  -8.538   8.071 -26.929
  492   HG21  VAL  65          HG21      VAL  65  -7.967   4.750 -25.359
  493   HG22  VAL  65          HG22      VAL  65  -6.259   4.597 -25.795
  494   HG23  VAL  65          HG23      VAL  65  -6.751   5.792 -24.585
  495    H    ARG  66           H        ARG  66  -5.234   6.405 -28.729
  496    HA   ARG  66           HA       ARG  66  -4.241   3.683 -29.462
  497    HB2  ARG  66           HB2      ARG  66  -5.100   4.565 -31.523
  498    HB3  ARG  66           HB3      ARG  66  -4.639   6.208 -31.115
  499    HG2  ARG  66           HG2      ARG  66  -3.248   5.547 -32.853
  500    HG3  ARG  66           HG3      ARG  66  -2.251   5.634 -31.420
  501    HD2  ARG  66           HD2      ARG  66  -3.460   2.952 -32.117
  502    HD3  ARG  66           HD3      ARG  66  -2.240   3.578 -33.230
  503    HE   ARG  66           HE       ARG  66  -0.901   3.878 -30.927
  504   HH11  ARG  66          HH11      ARG  66  -2.600   1.037 -32.268
  505   HH12  ARG  66          HH12      ARG  66  -1.465  -0.091 -31.624
  506   HH21  ARG  66          HH21      ARG  66   0.572   2.411 -30.106
  507   HH22  ARG  66          HH22      ARG  66   0.376   0.705 -30.341
  508    H    ILE  67           H        ILE  67  -2.213   3.535 -28.336
  509    HA   ILE  67           HA       ILE  67  -1.037   5.946 -27.201
  510    HB   ILE  67           HB       ILE  67   0.008   3.095 -27.331
  511   HG12  ILE  67          HG12      ILE  67  -1.334   4.450 -24.949
  512   HG13  ILE  67          HG13      ILE  67  -2.261   3.493 -26.098
  513   HG21  ILE  67          HG21      ILE  67   0.820   5.456 -25.562
  514   HG22  ILE  67          HG22      ILE  67   1.462   3.803 -25.440
  515   HG23  ILE  67          HG23      ILE  67   1.790   4.743 -26.882
  516   HD11  ILE  67          HD11      ILE  67   0.051   2.476 -24.378
  517   HD12  ILE  67          HD12      ILE  67  -1.664   2.089 -24.225
  518   HD13  ILE  67          HD13      ILE  67  -0.775   1.532 -25.649
  519    H    LEU  68           H        LEU  68   0.471   7.222 -28.033
  520    HA   LEU  68           HA       LEU  68   1.817   6.337 -30.583
  521    HB2  LEU  68           HB2      LEU  68   0.649   8.929 -29.736
  522    HB3  LEU  68           HB3      LEU  68   2.266   9.081 -30.383
  523    HG   LEU  68           HG       LEU  68   0.456   9.421 -32.048
  524   HD11  LEU  68          HD11      LEU  68   2.744   8.831 -32.772
  525   HD12  LEU  68          HD12      LEU  68   2.343   7.104 -32.679
  526   HD13  LEU  68          HD13      LEU  68   1.520   8.145 -33.855
  527   HD21  LEU  68          HD21      LEU  68  -0.813   7.601 -32.946
  528   HD22  LEU  68          HD22      LEU  68   0.039   6.408 -31.954
  529   HD23  LEU  68          HD23      LEU  68  -1.049   7.590 -31.182
  530    H    ALA  69           H        ALA  69   2.387   7.661 -27.305
  531    HA   ALA  69           HA       ALA  69   5.167   6.799 -27.373
  532    HB1  ALA  69           HB1      ALA  69   5.334   9.009 -28.534
  533    HB2  ALA  69           HB2      ALA  69   4.479   9.790 -27.192
  534    HB3  ALA  69           HB3      ALA  69   6.090   9.077 -26.936
  535    H    SER  70           H        SER  70   6.188   7.442 -25.145
  536    HA   SER  70           HA       SER  70   4.289   8.275 -23.116
  537    HB2  SER  70           HB2      SER  70   4.757   6.445 -21.591
  538    HB3  SER  70           HB3      SER  70   3.980   5.856 -23.060
  539    HG   SER  70           HG       SER  70   5.932   5.028 -23.785
  540    H    THR  71           H        THR  71   5.577   8.838 -21.002
  541    HA   THR  71           HA       THR  71   7.921  10.295 -21.818
  542    HB   THR  71           HB       THR  71   8.098  10.672 -19.277
  543    HG1  THR  71           HG1      THR  71   6.980   9.070 -18.360
  544   HG21  THR  71          HG21      THR  71   5.518  11.364 -20.746
  545   HG22  THR  71          HG22      THR  71   6.084  12.128 -19.246
  546   HG23  THR  71          HG23      THR  71   7.019  12.301 -20.746
  547    H    ARG  72           H        ARG  72  10.064   9.806 -21.550
  548    HA   ARG  72           HA       ARG  72  10.660   7.033 -21.824
  549    HB2  ARG  72           HB2      ARG  72  12.390   9.511 -21.445
  550    HB3  ARG  72           HB3      ARG  72  13.064   7.907 -21.796
  551    HG2  ARG  72           HG2      ARG  72  11.834   7.769 -23.897
  552    HG3  ARG  72           HG3      ARG  72  11.024   9.312 -23.595
  553    HD2  ARG  72           HD2      ARG  72  14.033   8.969 -23.867
  554    HD3  ARG  72           HD3      ARG  72  12.957   9.442 -25.191
  555    HE   ARG  72           HE       ARG  72  12.263  11.380 -23.587
  556   HH11  ARG  72          HH11      ARG  72  15.624  10.174 -23.869
  557   HH12  ARG  72          HH12      ARG  72  16.312  11.694 -23.418
  558   HH21  ARG  72          HH21      ARG  72  13.110  13.259 -23.098
  559   HH22  ARG  72          HH22      ARG  72  14.836  13.543 -22.919
  560    H    ASN  73           H        ASN  73  10.414   8.921 -18.937
  561    HA   ASN  73           HA       ASN  73  10.935   6.588 -17.346
  562    HB2  ASN  73           HB2      ASN  73  12.427   7.621 -15.745
  563    HB3  ASN  73           HB3      ASN  73  13.194   7.654 -17.320
  564   HD21  ASN  73          HD22      ASN  73  13.313   9.768 -18.486
  565   HD22  ASN  73          HD21      ASN  73  13.162  11.257 -17.588
  566    H    TRP  74           H        TRP  74  10.280   7.227 -14.952
  567    HA   TRP  74           HA       TRP  74   7.636   8.409 -15.146
  568    HB2  TRP  74           HB2      TRP  74   9.176   7.408 -12.711
  569    HB3  TRP  74           HB3      TRP  74   7.460   7.786 -12.801
  570    HD1  TRP  74           HD1      TRP  74  10.002   5.203 -14.133
  571    HE1  TRP  74           HE1      TRP  74   8.793   3.084 -14.815
  572    HE3  TRP  74           HE3      TRP  74   5.203   6.587 -13.012
  573    HZ2  TRP  74           HZ2      TRP  74   6.085   2.197 -15.179
  574    HZ3  TRP  74           HZ3      TRP  74   3.324   5.087 -13.609
  575    HH2  TRP  74           HH2      TRP  74   3.703   2.955 -14.748
  576    H    LEU  75           H        LEU  75   7.154  10.488 -14.711
  577    HA   LEU  75           HA       LEU  75   9.173  12.399 -13.785
  578    HB2  LEU  75           HB2      LEU  75   6.233  12.525 -14.577
  579    HB3  LEU  75           HB3      LEU  75   6.935  13.819 -13.636
  580    HG   LEU  75           HG       LEU  75   6.894  14.421 -15.938
  581   HD11  LEU  75          HD11      LEU  75   8.813  15.157 -14.468
  582   HD12  LEU  75          HD12      LEU  75   9.800  13.877 -15.204
  583   HD13  LEU  75          HD13      LEU  75   9.160  15.173 -16.208
  584   HD21  LEU  75          HD21      LEU  75   7.001  12.154 -16.944
  585   HD22  LEU  75          HD22      LEU  75   8.107  13.314 -17.703
  586   HD23  LEU  75          HD23      LEU  75   8.732  12.087 -16.582
  587    H    ARG  76           H        ARG  76   9.002  13.472 -11.691
  588    HA   ARG  76           HA       ARG  76   7.073  12.376  -9.789
  589    HB2  ARG  76           HB2      ARG  76   8.741  11.594  -8.166
  590    HB3  ARG  76           HB3      ARG  76   8.808  10.703  -9.664
  591    HG2  ARG  76           HG2      ARG  76  11.035  10.950  -9.279
  592    HG3  ARG  76           HG3      ARG  76  10.763  12.351 -10.302
  593    HD2  ARG  76           HD2      ARG  76  10.492  13.688  -8.057
  594    HD3  ARG  76           HD3      ARG  76  11.086  12.240  -7.273
  595    HE   ARG  76           HE       ARG  76  13.202  12.598  -8.100
  596   HH11  ARG  76          HH11      ARG  76  10.996  14.971  -9.646
  597   HH12  ARG  76          HH12      ARG  76  12.290  15.944 -10.248
  598   HH21  ARG  76          HH21      ARG  76  14.887  13.903  -8.947
  599   HH22  ARG  76          HH22      ARG  76  14.532  15.320  -9.861
  600    H    TYR  77           H        TYR  77   6.587  13.865  -8.178
  601    HA   TYR  77           HA       TYR  77   8.461  16.062  -7.621
  602    HB2  TYR  77           HB2      TYR  77   6.681  17.788  -7.804
  603    HB3  TYR  77           HB3      TYR  77   7.116  17.096  -9.353
  604    HD1  TYR  77           HD2      TYR  77   4.485  17.120  -6.679
  605    HD2  TYR  77           HD1      TYR  77   5.539  15.882 -10.663
  606    HE1  TYR  77           HE2      TYR  77   2.153  16.465  -7.089
  607    HE2  TYR  77           HE1      TYR  77   3.194  15.270 -11.119
  608    HH   TYR  77           HH       TYR  77   0.600  15.530  -8.630
  609    H    LYS  78           H        LYS  78   7.712  17.263  -5.715
  610    HA   LYS  78           HA       LYS  78   6.780  15.270  -3.711
  611    HB2  LYS  78           HB2      LYS  78   9.087  15.899  -3.527
  612    HB3  LYS  78           HB3      LYS  78   8.720  17.617  -3.570
  613    HG2  LYS  78           HG2      LYS  78   7.466  15.979  -1.377
  614    HG3  LYS  78           HG3      LYS  78   9.205  16.209  -1.299
  615    HD2  LYS  78           HD2      LYS  78   7.310  18.547  -1.671
  616    HD3  LYS  78           HD3      LYS  78   7.724  17.898  -0.070
  617    HE2  LYS  78           HE2      LYS  78  10.146  18.266  -0.554
  618    HE3  LYS  78           HE3      LYS  78   9.727  18.965  -2.120
  619    HZ1  LYS  78           HZ1      LYS  78   8.931  20.087   0.518
  620    HZ2  LYS  78           HZ2      LYS  78  10.100  20.677  -0.454
  621    HZ3  LYS  78           HZ3      LYS  78   8.547  20.742  -0.938
  622    H    LEU  79           H        LEU  79   5.087  15.773  -2.420
  623    HA   LEU  79           HA       LEU  79   3.196  17.760  -3.391
  624    HB2  LEU  79           HB2      LEU  79   3.059  15.923  -0.961
  625    HB3  LEU  79           HB3      LEU  79   1.707  16.795  -1.664
  626    HG   LEU  79           HG       LEU  79   3.254  14.558  -3.021
  627   HD11  LEU  79          HD11      LEU  79   1.887  13.740  -1.115
  628   HD12  LEU  79          HD12      LEU  79   0.444  14.453  -1.869
  629   HD13  LEU  79          HD13      LEU  79   1.316  13.132  -2.675
  630   HD21  LEU  79          HD21      LEU  79   1.477  14.533  -4.697
  631   HD22  LEU  79          HD22      LEU  79   0.704  15.944  -3.933
  632   HD23  LEU  79          HD23      LEU  79   2.316  16.089  -4.689
  633    HA   PRO  80           HA       PRO  80   4.337  20.965  -0.377
  634    HB2  PRO  80           HB2      PRO  80   1.345  21.477  -0.458
  635    HB3  PRO  80           HB3      PRO  80   2.689  22.666  -0.489
  636    HG2  PRO  80           HG2      PRO  80   1.422  22.002  -2.777
  637    HG3  PRO  80           HG3      PRO  80   3.213  22.102  -2.763
  638    HD2  PRO  80           HD2      PRO  80   1.469  19.635  -2.581
  639    HD3  PRO  80           HD3      PRO  80   2.942  19.913  -3.560
  640    H    LYS  81           H        LYS  81   3.989  21.301   2.007
  641    HA   LYS  81           HA       LYS  81   3.773  18.846   3.237
  642    HB2  LYS  81           HB2      LYS  81   4.425  21.479   4.083
  643    HB3  LYS  81           HB3      LYS  81   3.150  20.966   5.188
  644    HG2  LYS  81           HG2      LYS  81   5.726  19.482   4.584
  645    HG3  LYS  81           HG3      LYS  81   5.350  20.434   6.030
  646    HD2  LYS  81           HD2      LYS  81   3.560  18.809   6.650
  647    HD3  LYS  81           HD3      LYS  81   3.860  17.877   5.186
  648    HE2  LYS  81           HE2      LYS  81   5.015  16.734   6.943
  649    HE3  LYS  81           HE3      LYS  81   6.246  17.501   5.945
  650    HZ1  LYS  81           HZ1      LYS  81   6.668  17.780   8.323
  651    HZ2  LYS  81           HZ2      LYS  81   6.461  19.239   7.635
  652    HZ3  LYS  81           HZ3      LYS  81   5.262  18.574   8.543
  653    H    ARG  82           H        ARG  82   1.304  21.366   3.242
  654    HA   ARG  82           HA       ARG  82  -0.628  19.995   4.805
  655    HB2  ARG  82           HB2      ARG  82  -2.171  21.723   4.051
  656    HB3  ARG  82           HB3      ARG  82  -0.611  22.397   4.471
  657    HG2  ARG  82           HG2      ARG  82  -0.225  22.078   1.762
  658    HG3  ARG  82           HG3      ARG  82  -1.980  22.193   1.800
  659    HD2  ARG  82           HD2      ARG  82  -1.105  24.396   1.449
  660    HD3  ARG  82           HD3      ARG  82  -1.751  24.343   3.099
  661    HE   ARG  82           HE       ARG  82   1.071  23.691   3.066
  662   HH11  ARG  82          HH11      ARG  82  -1.126  26.477   2.754
  663   HH12  ARG  82          HH12      ARG  82   0.024  27.628   3.332
  664   HH21  ARG  82          HH21      ARG  82   2.599  25.243   3.863
  665   HH22  ARG  82          HH22      ARG  82   2.174  26.908   3.970
  666    H    LEU  83           H        LEU  83   0.428  19.250   1.656
  667    HA   LEU  83           HA       LEU  83  -2.050  17.807   0.975
  668    HB2  LEU  83           HB2      LEU  83  -1.038  19.604  -0.579
  669    HB3  LEU  83           HB3      LEU  83   0.268  18.465  -0.863
  670    HG   LEU  83           HG       LEU  83  -1.404  16.831  -1.805
  671   HD11  LEU  83          HD11      LEU  83  -3.370  19.122  -1.347
  672   HD12  LEU  83          HD12      LEU  83  -3.690  17.698  -2.362
  673   HD13  LEU  83          HD13      LEU  83  -3.455  17.496  -0.629
  674   HD21  LEU  83          HD21      LEU  83  -1.401  19.617  -3.029
  675   HD22  LEU  83          HD22      LEU  83  -0.205  18.328  -3.301
  676   HD23  LEU  83          HD23      LEU  83  -1.859  18.119  -3.875
  677    H    VAL  84           H        VAL  84   0.870  17.147   2.628
  678    HA   VAL  84           HA       VAL  84   1.520  14.616   1.440
  679    HB   VAL  84           HB       VAL  84   1.797  15.745   4.257
  680   HG11  VAL  84          HG11      VAL  84   3.264  13.840   4.802
  681   HG12  VAL  84          HG12      VAL  84   1.616  13.289   4.505
  682   HG13  VAL  84          HG13      VAL  84   2.853  13.064   3.267
  683   HG21  VAL  84          HG21      VAL  84   3.243  16.753   2.501
  684   HG22  VAL  84          HG22      VAL  84   4.202  15.813   3.658
  685   HG23  VAL  84          HG23      VAL  84   3.828  15.150   2.056
  686    H    ARG  85           H        ARG  85   0.572  12.693   1.677
  687    HA   ARG  85           HA       ARG  85  -2.198  12.666   2.779
  688    HB2  ARG  85           HB2      ARG  85  -0.676  10.754   0.997
  689    HB3  ARG  85           HB3      ARG  85  -2.316  10.444   1.581
  690    HG2  ARG  85           HG2      ARG  85  -1.676  13.025   0.132
  691    HG3  ARG  85           HG3      ARG  85  -1.885  11.536  -0.793
  692    HD2  ARG  85           HD2      ARG  85  -3.950  12.596   1.174
  693    HD3  ARG  85           HD3      ARG  85  -3.953  13.000  -0.551
  694    HE   ARG  85           HE       ARG  85  -3.830  10.361  -0.747
  695   HH11  ARG  85          HH11      ARG  85  -6.034  12.394   1.168
  696   HH12  ARG  85          HH12      ARG  85  -7.309  11.232   1.213
  697   HH21  ARG  85          HH21      ARG  85  -5.533   8.792  -0.674
  698   HH22  ARG  85          HH22      ARG  85  -7.016   9.141   0.133
  699    H    TRP  86           H        TRP  86  -2.303  12.157   4.827
  700    HA   TRP  86           HA       TRP  86  -0.172  10.492   6.062
  701    HB2  TRP  86           HB2      TRP  86  -2.294  12.158   7.419
  702    HB3  TRP  86           HB3      TRP  86  -0.931  11.343   8.175
  703    HD1  TRP  86           HD1      TRP  86  -1.749  14.439   6.081
  704    HE1  TRP  86           HE1      TRP  86   0.192  16.094   6.170
  705    HE3  TRP  86           HE3      TRP  86   1.640  11.546   8.608
  706    HZ2  TRP  86           HZ2      TRP  86   2.864  16.178   7.260
  707    HZ3  TRP  86           HZ3      TRP  86   3.888  12.439   9.147
  708    HH2  TRP  86           HH2      TRP  86   4.519  14.744   8.484
  709    H    ASP  87           H        ASP  87  -3.134   9.917   4.662
  710    HA   ASP  87           HA       ASP  87  -4.089   7.916   6.630
  711    HB2  ASP  87           HB2      ASP  87  -5.714   9.401   5.532
  712    HB3  ASP  87           HB3      ASP  87  -5.172   8.841   3.948
  713    H    THR  88           H        THR  88  -1.964   8.167   3.902
  714    HA   THR  88           HA       THR  88  -2.295   5.402   3.014
  715    HB   THR  88           HB       THR  88  -0.458   6.318   1.391
  716    HG1  THR  88           HG1      THR  88  -0.637   8.609   1.159
  717   HG21  THR  88          HG21      THR  88  -3.245   7.560   1.340
  718   HG22  THR  88          HG22      THR  88  -2.154   7.358  -0.052
  719   HG23  THR  88          HG23      THR  88  -2.835   5.934   0.740
  720    H    LYS  89           H        LYS  89  -0.391   4.010   3.021
  721    HA   LYS  89           HA       LYS  89   1.576   4.646   5.172
  722    HB2  LYS  89           HB2      LYS  89  -0.071   2.117   4.994
  723    HB3  LYS  89           HB3      LYS  89   1.306   2.394   6.080
  724    HG2  LYS  89           HG2      LYS  89   0.084   4.416   7.004
  725    HG3  LYS  89           HG3      LYS  89  -1.328   3.944   6.053
  726    HD2  LYS  89           HD2      LYS  89  -0.029   2.339   8.281
  727    HD3  LYS  89           HD3      LYS  89  -1.535   3.269   8.365
  728    HE2  LYS  89           HE2      LYS  89  -2.527   1.798   6.597
  729    HE3  LYS  89           HE3      LYS  89  -1.044   0.834   6.586
  730    HZ1  LYS  89           HZ1      LYS  89  -2.734  -0.177   7.981
  731    HZ2  LYS  89           HZ2      LYS  89  -1.476   0.267   8.921
  732    HZ3  LYS  89           HZ3      LYS  89  -2.857   1.151   8.921
  733    HA   PRO  90           HA       PRO  90   3.808   4.728   5.323
  734    HB2  PRO  90           HB2      PRO  90   5.770   5.917   3.796
  735    HB3  PRO  90           HB3      PRO  90   5.970   4.339   4.613
  736    HG2  PRO  90           HG2      PRO  90   5.148   4.842   1.729
  737    HG3  PRO  90           HG3      PRO  90   6.434   3.747   2.337
  738    HD2  PRO  90           HD2      PRO  90   4.000   2.755   1.758
  739    HD3  PRO  90           HD3      PRO  90   4.830   2.232   3.249
  740    H    VAL  91           H        VAL  91   3.561   7.035   5.572
  741    HA   VAL  91           HA       VAL  91   1.511   8.297   4.169
  742    HB   VAL  91           HB       VAL  91   2.168  10.338   5.307
  743   HG11  VAL  91          HG11      VAL  91   1.836   9.560   7.576
  744   HG12  VAL  91          HG12      VAL  91   0.915   8.519   6.486
  745   HG13  VAL  91          HG13      VAL  91   2.442   7.944   7.180
  746   HG21  VAL  91          HG21      VAL  91   4.612  10.281   5.208
  747   HG22  VAL  91          HG22      VAL  91   4.060  10.442   6.874
  748   HG23  VAL  91          HG23      VAL  91   4.653   8.875   6.294
  749    H    CYS  92           H        CYS  92   1.404   9.539   2.407
  750    HA   CYS  92           HA       CYS  92   3.735   9.124   0.629
  751    HB2  CYS  92           HB2      CYS  92   1.526   8.225   0.052
  752    HB3  CYS  92           HB3      CYS  92   0.915   9.908  -0.100
  753    HG   CYS  92           HG       CYS  92   1.339   9.525  -2.480
  754    H    ILE  93           H        ILE  93   4.971  10.655  -0.068
  755    HA   ILE  93           HA       ILE  93   4.311  13.489   0.518
  756    HB   ILE  93           HB       ILE  93   6.714  13.848   0.844
  757   HG12  ILE  93          HG12      ILE  93   8.187  11.879   1.374
  758   HG13  ILE  93          HG13      ILE  93   7.003  10.819   0.617
  759   HG21  ILE  93          HG21      ILE  93   5.636  11.657   2.670
  760   HG22  ILE  93          HG22      ILE  93   6.873  12.863   3.058
  761   HG23  ILE  93          HG23      ILE  93   5.212  13.381   2.760
  762   HD11  ILE  93          HD11      ILE  93   7.481  11.723  -1.557
  763   HD12  ILE  93          HD12      ILE  93   8.370  13.105  -0.857
  764   HD13  ILE  93          HD13      ILE  93   9.031  11.462  -0.758
  765    H    GLY  94           H        GLY  94   4.687  11.325  -2.132
  766    HA2  GLY  94           HA2      GLY  94   5.025  13.674  -3.921
  767    HA3  GLY  94           HA3      GLY  94   6.262  12.435  -3.958
  768    H    GLN  95           H        GLN  95   4.774  13.124  -6.231
  769    HA   GLN  95           HA       GLN  95   2.869  10.834  -6.595
  770    HB2  GLN  95           HB2      GLN  95   2.278  13.509  -6.812
  771    HB3  GLN  95           HB3      GLN  95   2.848  13.203  -8.438
  772    HG2  GLN  95           HG2      GLN  95   0.504  12.947  -8.540
  773    HG3  GLN  95           HG3      GLN  95   1.125  11.317  -8.590
  774   HE21  GLN  95          HE22      GLN  95  -0.280  13.800  -6.271
  775   HE22  GLN  95          HE21      GLN  95  -0.961  12.584  -5.208
  776    H    LYS  96           H        LYS  96   4.107   9.214  -7.591
  777    HA   LYS  96           HA       LYS  96   6.205   9.930  -9.594
  778    HB2  LYS  96           HB2      LYS  96   6.817   8.100  -8.158
  779    HB3  LYS  96           HB3      LYS  96   5.236   7.348  -8.289
  780    HG2  LYS  96           HG2      LYS  96   5.685   6.813 -10.700
  781    HG3  LYS  96           HG3      LYS  96   7.300   7.529 -10.533
  782    HD2  LYS  96           HD2      LYS  96   7.900   5.839  -8.873
  783    HD3  LYS  96           HD3      LYS  96   6.242   5.193  -8.879
  784    HE2  LYS  96           HE2      LYS  96   6.479   4.524 -11.258
  785    HE3  LYS  96           HE3      LYS  96   8.102   5.243 -11.304
  786    HZ1  LYS  96           HZ1      LYS  96   7.332   2.906  -9.635
  787    HZ2  LYS  96           HZ2      LYS  96   8.232   2.861 -10.995
  788    HZ3  LYS  96           HZ3      LYS  96   8.824   3.592  -9.663
  789    H    GLN  97           H        GLN  97   5.601   9.992 -11.818
  790    HA   GLN  97           HA       GLN  97   3.223   8.518 -12.597
  791    HB2  GLN  97           HB2      GLN  97   2.621  10.921 -13.865
  792    HB3  GLN  97           HB3      GLN  97   1.727  10.093 -12.624
  793    HG2  GLN  97           HG2      GLN  97   1.878  12.346 -11.952
  794    HG3  GLN  97           HG3      GLN  97   2.930  11.468 -10.868
  795   HE21  GLN  97          HE21      GLN  97   4.805  12.649 -10.467
  796   HE22  GLN  97          HE22      GLN  97   5.584  13.681 -11.653
  797    H    LYS  98           H        LYS  98   3.400   7.601 -14.527
  798    HA   LYS  98           HA       LYS  98   5.392   8.732 -16.451
  799    HB2  LYS  98           HB2      LYS  98   5.805   6.387 -15.987
  800    HB3  LYS  98           HB3      LYS  98   4.093   5.983 -16.255
  801    HG2  LYS  98           HG2      LYS  98   4.352   6.553 -18.650
  802    HG3  LYS  98           HG3      LYS  98   6.060   6.960 -18.368
  803    HD2  LYS  98           HD2      LYS  98   6.507   4.631 -17.629
  804    HD3  LYS  98           HD3      LYS  98   4.792   4.247 -17.786
  805    HE2  LYS  98           HE2      LYS  98   5.762   3.342 -19.735
  806    HE3  LYS  98           HE3      LYS  98   4.962   4.819 -20.261
  807    HZ1  LYS  98           HZ1      LYS  98   7.080   4.756 -21.264
  808    HZ2  LYS  98           HZ2      LYS  98   7.260   5.890 -20.113
  809    HZ3  LYS  98           HZ3      LYS  98   7.876   4.384 -19.873
  810    H    TRP  99           H        TRP  99   4.550   9.475 -18.398
  811    HA   TRP  99           HA       TRP  99   1.583   9.633 -18.459
  812    HB2  TRP  99           HB2      TRP  99   3.704  11.519 -19.485
  813    HB3  TRP  99           HB3      TRP  99   2.001  11.631 -19.897
  814    HD1  TRP  99           HD1      TRP  99   4.243  11.761 -16.731
  815    HE1  TRP  99           HE1      TRP  99   3.158  13.323 -15.034
  816    HE3  TRP  99           HE3      TRP  99  -0.201  12.583 -19.135
  817    HZ2  TRP  99           HZ2      TRP  99   0.712  14.925 -14.863
  818    HZ3  TRP  99           HZ3      TRP  99  -1.888  14.112 -18.190
  819    HH2  TRP  99           HH2      TRP  99  -1.445  15.266 -16.030
  820    H    PHE 100           H        PHE 100   0.533   9.106 -20.340
  821    HA   PHE 100           HA       PHE 100   2.184   7.927 -22.539
  822    HB2  PHE 100           HB2      PHE 100  -0.536   7.095 -21.489
  823    HB3  PHE 100           HB3      PHE 100   0.167   6.537 -23.002
  824    HD1  PHE 100           HD2      PHE 100   0.704   6.498 -19.272
  825    HD2  PHE 100           HD1      PHE 100   1.753   4.785 -23.100
  826    HE1  PHE 100           HE2      PHE 100   1.840   4.613 -18.130
  827    HE2  PHE 100           HE1      PHE 100   2.925   2.939 -21.949
  828    HZ   PHE 100           HZ       PHE 100   2.944   2.821 -19.465
  829    H    LEU 101           H        LEU 101   1.893   8.799 -24.474
  830    HA   LEU 101           HA       LEU 101  -0.003  11.031 -24.853
  831    HB2  LEU 101           HB2      LEU 101   2.204  11.378 -25.749
  832    HB3  LEU 101           HB3      LEU 101   2.202   9.796 -26.531
  833    HG   LEU 101           HG       LEU 101   0.353  10.542 -28.034
  834   HD11  LEU 101          HD11      LEU 101  -0.671  12.277 -26.597
  835   HD12  LEU 101          HD12      LEU 101   0.794  13.278 -26.775
  836   HD13  LEU 101          HD13      LEU 101  -0.224  12.881 -28.186
  837   HD21  LEU 101          HD21      LEU 101   2.713  10.709 -28.731
  838   HD22  LEU 101          HD22      LEU 101   1.728  12.014 -29.429
  839   HD23  LEU 101          HD23      LEU 101   2.805  12.342 -28.055
  840    H    LEU 102           H        LEU 102  -1.996  10.468 -25.338
  841    HA   LEU 102           HA       LEU 102  -2.509   7.987 -26.907
  842    HB2  LEU 102           HB2      LEU 102  -4.007   9.439 -24.702
  843    HB3  LEU 102           HB3      LEU 102  -4.932   8.580 -25.920
  844    HG   LEU 102           HG       LEU 102  -4.718   7.148 -24.054
  845   HD11  LEU 102          HD11      LEU 102  -4.003   5.190 -25.170
  846   HD12  LEU 102          HD12      LEU 102  -4.259   6.317 -26.549
  847   HD13  LEU 102          HD13      LEU 102  -2.656   6.028 -25.942
  848   HD21  LEU 102          HD21      LEU 102  -2.574   6.406 -23.133
  849   HD22  LEU 102          HD22      LEU 102  -1.689   7.395 -24.290
  850   HD23  LEU 102          HD23      LEU 102  -2.677   8.172 -23.040
  851    H    GLN 103           H        GLN 103  -3.341   8.227 -28.895
  852    HA   GLN 103           HA       GLN 103  -4.291  10.966 -29.640
  853    HB2  GLN 103           HB2      GLN 103  -3.713   8.528 -31.358
  854    HB3  GLN 103           HB3      GLN 103  -4.486   9.998 -31.960
  855    HG2  GLN 103           HG2      GLN 103  -1.725   9.861 -30.664
  856    HG3  GLN 103           HG3      GLN 103  -2.037   9.948 -32.399
  857   HE21  GLN 103          HE22      GLN 103  -0.355  11.797 -31.110
  858   HE22  GLN 103          HE21      GLN 103  -1.150  13.357 -31.194
  859    H    LEU 104           H        LEU 104  -6.368  11.390 -29.761
  860    HA   LEU 104           HA       LEU 104  -8.350   9.674 -28.629
  861    HB2  LEU 104           HB2      LEU 104  -8.478  12.162 -28.724
  862    HB3  LEU 104           HB3      LEU 104  -8.562  12.071 -30.488
  863    HG   LEU 104           HG       LEU 104 -10.719  10.828 -30.298
  864   HD11  LEU 104          HD11      LEU 104 -10.561   9.904 -28.024
  865   HD12  LEU 104          HD12      LEU 104 -10.449  11.540 -27.336
  866   HD13  LEU 104          HD13      LEU 104 -11.949  10.991 -28.092
  867   HD21  LEU 104          HD21      LEU 104 -10.963  13.479 -28.871
  868   HD22  LEU 104          HD22      LEU 104 -10.407  13.397 -30.559
  869   HD23  LEU 104          HD23      LEU 104 -11.992  12.785 -30.132
  870    H    VAL 105           H        VAL 105  -9.418   7.891 -29.598
  871    HA   VAL 105           HA       VAL 105  -9.417   7.781 -32.594
  872    HB   VAL 105           HB       VAL 105  -9.634   5.562 -30.552
  873   HG11  VAL 105          HG11      VAL 105  -9.631   4.018 -32.456
  874   HG12  VAL 105          HG12      VAL 105 -11.082   5.018 -32.426
  875   HG13  VAL 105          HG13      VAL 105  -9.773   5.391 -33.581
  876   HG21  VAL 105          HG21      VAL 105  -7.520   4.790 -31.523
  877   HG22  VAL 105          HG22      VAL 105  -7.509   6.160 -32.657
  878   HG23  VAL 105          HG23      VAL 105  -7.309   6.437 -30.916
  879    H    SER 106           H        SER 106 -11.410   7.549 -29.608
  880    HA   SER 106           HA       SER 106 -13.873   7.687 -31.224
  881    HB2  SER 106           HB2      SER 106 -13.475   7.500 -28.227
  882    HB3  SER 106           HB3      SER 106 -15.015   7.368 -29.114
  883    HG   SER 106           HG       SER 106 -14.021   5.338 -28.612
  884    H    GLY 107           H        GLY 107 -14.628   9.526 -28.506
  885    HA2  GLY 107           HA2      GLY 107 -13.687  12.101 -29.127
  886    HA3  GLY 107           HA3      GLY 107 -15.128  11.820 -30.105
  887    H    ASP 108           H        ASP 108 -15.371  13.826 -28.452
  888    HA   ASP 108           HA       ASP 108 -16.049  13.649 -25.825
  889    HB2  ASP 108           HB2      ASP 108 -15.947  15.711 -27.051
  890    HB3  ASP 108           HB3      ASP 108 -17.349  15.259 -28.026
  891    H    ALA 109           H        ALA 109 -18.046  12.541 -28.570
  892    HA   ALA 109           HA       ALA 109 -20.491  12.246 -27.121
  893    HB1  ALA 109           HB1      ALA 109 -20.376  12.362 -29.586
  894    HB2  ALA 109           HB2      ALA 109 -19.507  10.807 -29.630
  895    HB3  ALA 109           HB3      ALA 109 -21.186  10.875 -29.055
  896    H    GLU 110           H        GLU 110 -17.630  10.167 -27.349
  897    HA   GLU 110           HA       GLU 110 -19.055   7.918 -26.085
  898    HB2  GLU 110           HB2      GLU 110 -16.287   8.059 -27.312
  899    HB3  GLU 110           HB3      GLU 110 -17.024   6.619 -26.613
  900    HG2  GLU 110           HG2      GLU 110 -17.919   8.118 -29.109
  901    HG3  GLU 110           HG3      GLU 110 -17.209   6.509 -29.028
  902    H    ILE 111           H        ILE 111 -16.659  10.401 -25.528
  903    HA   ILE 111           HA       ILE 111 -15.547   9.509 -23.043
  904    HB   ILE 111           HB       ILE 111 -15.963  12.126 -24.458
  905   HG12  ILE 111          HG12      ILE 111 -13.499  10.596 -23.688
  906   HG13  ILE 111          HG13      ILE 111 -14.213  10.720 -25.298
  907   HG21  ILE 111          HG21      ILE 111 -14.775  13.383 -22.747
  908   HG22  ILE 111          HG22      ILE 111 -16.239  12.715 -22.074
  909   HG23  ILE 111          HG23      ILE 111 -14.675  11.935 -21.710
  910   HD11  ILE 111          HD11      ILE 111 -13.731  13.188 -25.247
  911   HD12  ILE 111          HD12      ILE 111 -12.788  12.909 -23.758
  912   HD13  ILE 111          HD13      ILE 111 -12.307  12.132 -25.270
  913    H    ASN 112           H        ASN 112 -16.240   9.867 -20.950
  914    HA   ASN 112           HA       ASN 112 -19.138  10.548 -20.581
  915    HB2  ASN 112           HB2      ASN 112 -19.239   8.234 -20.835
  916    HB3  ASN 112           HB3      ASN 112 -17.688   7.949 -20.068
  917   HD21  ASN 112          HD22      ASN 112 -21.020   7.614 -19.459
  918   HD22  ASN 112          HD21      ASN 112 -20.838   7.542 -17.712
  919    H    MET 113           H        MET 113 -15.966  10.033 -19.013
  920    HA   MET 113           HA       MET 113 -15.003  10.815 -17.192
  921    HB2  MET 113           HB2      MET 113 -16.635  13.347 -17.527
  922    HB3  MET 113           HB3      MET 113 -15.059  13.146 -16.769
  923    HG2  MET 113           HG2      MET 113 -14.305  12.281 -19.107
  924    HG3  MET 113           HG3      MET 113 -15.763  13.114 -19.678
  925    HE1  MET 113           HE1      MET 113 -14.799  15.109 -21.119
  926    HE2  MET 113           HE2      MET 113 -13.328  16.007 -20.699
  927    HE3  MET 113           HE3      MET 113 -13.227  14.263 -21.065
  928    H    GLN 114           H        GLN 114 -18.038   9.746 -16.657
  929    HA   GLN 114           HA       GLN 114 -17.872  10.419 -13.786
  930    HB2  GLN 114           HB2      GLN 114 -20.451  10.332 -15.421
  931    HB3  GLN 114           HB3      GLN 114 -20.325  10.632 -13.683
  932    HG2  GLN 114           HG2      GLN 114 -18.998  12.715 -14.189
  933    HG3  GLN 114           HG3      GLN 114 -19.290  12.450 -15.905
  934   HE21  GLN 114          HE22      GLN 114 -20.928  13.063 -12.774
  935   HE22  GLN 114          HE21      GLN 114 -22.370  13.769 -13.470
  936    H    THR 115           H        THR 115 -17.093   8.160 -15.560
  937    HA   THR 115           HA       THR 115 -18.703   5.888 -15.121
  938    HB   THR 115           HB       THR 115 -16.128   4.963 -15.395
  939    HG1  THR 115           HG1      THR 115 -14.828   6.467 -16.218
  940   HG21  THR 115          HG21      THR 115 -16.509   4.844 -17.769
  941   HG22  THR 115          HG22      THR 115 -18.053   4.581 -16.954
  942   HG23  THR 115          HG23      THR 115 -17.694   6.157 -17.693
  943    H    SER 116           H        SER 116 -16.241   7.441 -13.111
  944    HA   SER 116           HA       SER 116 -15.851   5.255 -11.293
  945    HB2  SER 116           HB2      SER 116 -14.708   7.424 -10.152
  946    HB3  SER 116           HB3      SER 116 -13.966   6.502 -11.482
  947    HG   SER 116           HG       SER 116 -13.981   8.345 -12.512
  948    H    SER 117           H        SER 117 -18.319   7.481 -11.549
  949    HA   SER 117           HA       SER 117 -20.063   8.156 -10.339
  950    HB2  SER 117           HB2      SER 117 -19.185   6.317  -8.101
  951    HB3  SER 117           HB3      SER 117 -20.781   7.044  -8.331
  952    HG   SER 117           HG       SER 117 -20.711   4.878  -9.114
  953    H    THR 118           H        THR 118 -17.023   8.176  -8.472
  954    HA   THR 118           HA       THR 118 -17.574  11.012  -7.742
  955    HB   THR 118           HB       THR 118 -15.942  10.530  -5.834
  956    HG1  THR 118           HG1      THR 118 -15.189   8.483  -6.377
  957   HG21  THR 118          HG21      THR 118 -18.379  10.863  -5.511
  958   HG22  THR 118          HG22      THR 118 -18.660   9.131  -5.773
  959   HG23  THR 118          HG23      THR 118 -17.719   9.684  -4.368
  960    HA   PRO 119           HA       PRO 119 -14.167  10.367 -10.848
  961    HB2  PRO 119           HB2      PRO 119 -14.957  12.118 -12.770
  962    HB3  PRO 119           HB3      PRO 119 -15.828  10.580 -12.526
  963    HG2  PRO 119           HG2      PRO 119 -16.536  13.302 -11.356
  964    HG3  PRO 119           HG3      PRO 119 -17.585  12.225 -12.339
  965    HD2  PRO 119           HD2      PRO 119 -17.672  12.133  -9.641
  966    HD3  PRO 119           HD3      PRO 119 -17.749  10.630 -10.614
  967    H    GLU 120           H        GLU 120 -12.796  12.224 -12.041
  968    HA   GLU 120           HA       GLU 120 -12.436  14.508 -10.139
  969    HB2  GLU 120           HB2      GLU 120 -10.427  13.316 -12.082
  970    HB3  GLU 120           HB3      GLU 120 -10.204  14.778 -11.115
  971    HG2  GLU 120           HG2      GLU 120 -10.947  13.154  -9.108
  972    HG3  GLU 120           HG3      GLU 120 -10.304  11.914 -10.191
  973    H    PHE 121           H        PHE 121 -13.827  13.822 -13.236
  974    HA   PHE 121           HA       PHE 121 -13.295  16.637 -14.046
  975    HB2  PHE 121           HB2      PHE 121 -13.151  14.154 -15.748
  976    HB3  PHE 121           HB3      PHE 121 -13.213  15.791 -16.377
  977    HD1  PHE 121           HD1      PHE 121 -11.429  17.418 -14.825
  978    HD2  PHE 121           HD2      PHE 121 -10.977  13.302 -16.046
  979    HE1  PHE 121           HE1      PHE 121  -8.987  17.656 -14.708
  980    HE2  PHE 121           HE2      PHE 121  -8.505  13.556 -15.929
  981    HZ   PHE 121           HZ       PHE 121  -7.511  15.733 -15.247
  982    H    ASP 122           H        ASP 122 -14.573  17.756 -15.101
  983    HA   ASP 122           HA       ASP 122 -17.365  16.961 -15.720
  984    HB2  ASP 122           HB2      ASP 122 -17.529  18.570 -13.965
  985    HB3  ASP 122           HB3      ASP 122 -16.155  19.500 -14.568
  986    H    GLY 123           H        GLY 123 -17.334  16.693 -17.878
  987    HA2  GLY 123           HA2      GLY 123 -15.060  17.242 -19.445
  988    HA3  GLY 123           HA3      GLY 123 -16.608  16.655 -20.064
  989    H    TRP 124           H        TRP 124 -14.521  18.724 -20.962
  990    HA   TRP 124           HA       TRP 124 -16.336  21.016 -21.493
  991    HB2  TRP 124           HB2      TRP 124 -13.688  21.062 -20.098
  992    HB3  TRP 124           HB3      TRP 124 -14.082  22.391 -21.180
  993    HD1  TRP 124           HD1      TRP 124 -16.042  20.670 -18.325
  994    HE1  TRP 124           HE1      TRP 124 -17.251  22.376 -16.965
  995    HE3  TRP 124           HE3      TRP 124 -14.581  24.820 -20.933
  996    HZ2  TRP 124           HZ2      TRP 124 -17.563  25.310 -16.975
  997    HZ3  TRP 124           HZ3      TRP 124 -15.369  27.061 -20.237
  998    HH2  TRP 124           HH2      TRP 124 -16.858  27.318 -18.262
  999    H    ARG 125           H        ARG 125 -13.021  21.358 -22.541
 1000    HA   ARG 125           HA       ARG 125 -13.616  20.403 -25.255
 1001    HB2  ARG 125           HB2      ARG 125 -13.303  22.627 -26.243
 1002    HB3  ARG 125           HB3      ARG 125 -14.740  22.586 -25.236
 1003    HG2  ARG 125           HG2      ARG 125 -13.844  23.984 -23.596
 1004    HG3  ARG 125           HG3      ARG 125 -12.167  23.634 -24.005
 1005    HD2  ARG 125           HD2      ARG 125 -14.054  25.168 -25.822
 1006    HD3  ARG 125           HD3      ARG 125 -12.922  25.921 -24.678
 1007    HE   ARG 125           HE       ARG 125 -11.335  24.188 -26.155
 1008   HH11  ARG 125          HH21      ARG 125 -13.351  27.010 -26.952
 1009   HH12  ARG 125          HH22      ARG 125 -12.435  27.429 -28.356
 1010   HH21  ARG 125          HH12      ARG 125 -10.179  24.682 -27.982
 1011   HH22  ARG 125          HH11      ARG 125 -10.559  26.067 -28.963
 1012    H    TRP 126           H        TRP 126 -11.697  20.708 -26.726
 1013    HA   TRP 126           HA       TRP 126  -9.242  20.330 -25.198
 1014    HB2  TRP 126           HB2      TRP 126  -9.522  20.339 -28.198
 1015    HB3  TRP 126           HB3      TRP 126  -8.373  19.454 -27.197
 1016    HD1  TRP 126           HD1      TRP 126 -10.946  18.599 -29.345
 1017    HE1  TRP 126           HE1      TRP 126 -12.472  16.673 -28.650
 1018    HE3  TRP 126           HE3      TRP 126  -9.777  18.392 -24.355
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.243  15.328 -26.193
 1020    HZ3  TRP 126           HZ3      TRP 126 -11.028  16.884 -22.845
 1021    HH2  TRP 126           HH2      TRP 126 -12.781  15.383 -23.738
 1022    H    VAL 127           H        VAL 127  -7.243  21.483 -25.686
 1023    HA   VAL 127           HA       VAL 127  -7.657  24.364 -26.352
 1024    HB   VAL 127           HB       VAL 127  -6.452  24.952 -24.283
 1025   HG11  VAL 127          HG11      VAL 127  -8.239  24.636 -22.697
 1026   HG12  VAL 127          HG12      VAL 127  -8.953  24.901 -24.291
 1027   HG13  VAL 127          HG13      VAL 127  -8.895  23.262 -23.603
 1028   HG21  VAL 127          HG21      VAL 127  -6.198  23.264 -22.459
 1029   HG22  VAL 127          HG22      VAL 127  -6.624  21.984 -23.603
 1030   HG23  VAL 127          HG23      VAL 127  -5.152  22.936 -23.854
 1031    H    SER 128           H        SER 128  -5.456  25.541 -26.421
 1032    HA   SER 128           HA       SER 128  -3.811  24.343 -28.330
 1033    HB2  SER 128           HB2      SER 128  -2.900  26.464 -26.367
 1034    HB3  SER 128           HB3      SER 128  -2.309  26.197 -28.004
 1035    HG   SER 128           HG       SER 128  -4.306  26.945 -28.809
 1036    H    TYR 129           H        TYR 129  -1.662  23.593 -28.290
 1037    HA   TYR 129           HA       TYR 129  -0.917  21.889 -26.101
 1038    HB2  TYR 129           HB2      TYR 129  -0.318  21.929 -28.700
 1039    HB3  TYR 129           HB3      TYR 129   1.004  22.970 -28.170
 1040    HD1  TYR 129           HD2      TYR 129   2.728  22.031 -26.598
 1041    HD2  TYR 129           HD1      TYR 129  -0.350  19.576 -28.339
 1042    HE1  TYR 129           HE2      TYR 129   4.026  20.012 -26.010
 1043    HE2  TYR 129           HE1      TYR 129   0.883  17.542 -27.616
 1044    HH   TYR 129           HH       TYR 129   4.027  17.702 -25.938
 1045    H    TRP 130           H        TRP 130   0.964  22.336 -24.690
 1046    HA   TRP 130           HA       TRP 130   2.064  23.487 -23.127
 1047    HB2  TRP 130           HB2      TRP 130   1.965  26.039 -24.720
 1048    HB3  TRP 130           HB3      TRP 130   3.136  25.527 -23.519
 1049    HD1  TRP 130           HD1      TRP 130   2.432  25.498 -27.159
 1050    HE1  TRP 130           HE1      TRP 130   4.051  24.075 -28.463
 1051    HE3  TRP 130           HE3      TRP 130   4.774  23.266 -23.213
 1052    HZ2  TRP 130           HZ2      TRP 130   6.349  22.291 -27.836
 1053    HZ3  TRP 130           HZ3      TRP 130   6.647  21.682 -23.573
 1054    HH2  TRP 130           HH2      TRP 130   7.438  21.191 -25.864
 1055    H    TYR 131           H        TYR 131  -0.936  25.113 -24.215
 1056    HA   TYR 131           HA       TYR 131  -1.078  27.032 -22.223
 1057    HB2  TYR 131           HB2      TYR 131  -2.575  27.099 -24.037
 1058    HB3  TYR 131           HB3      TYR 131  -3.264  25.536 -23.685
 1059    HD1  TYR 131           HD1      TYR 131  -3.172  29.088 -22.647
 1060    HD2  TYR 131           HD2      TYR 131  -5.000  25.228 -22.009
 1061    HE1  TYR 131           HE1      TYR 131  -5.017  30.169 -21.405
 1062    HE2  TYR 131           HE2      TYR 131  -6.853  26.305 -20.778
 1063    HH   TYR 131           HH       TYR 131  -7.061  29.862 -20.285
 1064    HA   PRO 132           HA       PRO 132  -3.162  24.010 -19.114
 1065    HB2  PRO 132           HB2      PRO 132  -1.848  21.438 -19.970
 1066    HB3  PRO 132           HB3      PRO 132  -3.384  21.698 -19.115
 1067    HG2  PRO 132           HG2      PRO 132  -3.424  21.186 -21.746
 1068    HG3  PRO 132           HG3      PRO 132  -4.456  22.500 -21.090
 1069    HD2  PRO 132           HD2      PRO 132  -1.741  22.749 -22.440
 1070    HD3  PRO 132           HD3      PRO 132  -3.224  23.694 -22.708
 1071    H    VAL 133           H        VAL 133   0.225  23.741 -20.250
 1072    HA   VAL 133           HA       VAL 133   1.406  22.972 -17.739
 1073    HB   VAL 133           HB       VAL 133   2.597  24.677 -19.970
 1074   HG11  VAL 133          HG11      VAL 133   3.990  22.971 -17.877
 1075   HG12  VAL 133          HG12      VAL 133   4.743  23.867 -19.232
 1076   HG13  VAL 133          HG13      VAL 133   3.955  24.749 -17.934
 1077   HG21  VAL 133          HG21      VAL 133   3.577  22.554 -20.826
 1078   HG22  VAL 133          HG22      VAL 133   2.641  21.641 -19.618
 1079   HG23  VAL 133          HG23      VAL 133   1.824  22.547 -20.915
 1080    H    ARG 134           H        ARG 134   0.209  26.055 -19.106
 1081    HA   ARG 134           HA       ARG 134   1.261  27.499 -16.742
 1082    HB2  ARG 134           HB2      ARG 134  -0.301  28.543 -19.143
 1083    HB3  ARG 134           HB3      ARG 134   0.499  29.508 -17.901
 1084    HG2  ARG 134           HG2      ARG 134   1.792  27.809 -20.060
 1085    HG3  ARG 134           HG3      ARG 134   1.885  29.548 -19.840
 1086    HD2  ARG 134           HD2      ARG 134   3.215  27.381 -18.167
 1087    HD3  ARG 134           HD3      ARG 134   4.005  28.568 -19.182
 1088    HE   ARG 134           HE       ARG 134   3.059  28.879 -16.451
 1089   HH11  ARG 134          HH11      ARG 134   3.983  30.701 -19.375
 1090   HH12  ARG 134          HH12      ARG 134   4.226  32.191 -18.536
 1091   HH21  ARG 134          HH21      ARG 134   3.264  30.912 -15.364
 1092   HH22  ARG 134          HH22      ARG 134   3.832  32.297 -16.214
 1093    H    GLN 135           H        GLN 135  -1.706  25.916 -17.723
 1094    HA   GLN 135           HA       GLN 135  -3.288  27.553 -15.845
 1095    HB2  GLN 135           HB2      GLN 135  -3.983  24.989 -17.315
 1096    HB3  GLN 135           HB3      GLN 135  -5.088  25.918 -16.299
 1097    HG2  GLN 135           HG2      GLN 135  -3.868  26.768 -18.935
 1098    HG3  GLN 135           HG3      GLN 135  -5.558  26.470 -18.562
 1099   HE21  GLN 135          HE22      GLN 135  -3.364  28.952 -19.072
 1100   HE22  GLN 135          HE21      GLN 135  -4.129  30.216 -18.138
 1101    H    VAL 136           H        VAL 136  -1.462  24.502 -15.720
 1102    HA   VAL 136           HA       VAL 136  -2.695  23.665 -13.264
 1103    HB   VAL 136           HB       VAL 136  -1.503  22.287 -15.116
 1104   HG11  VAL 136          HG11      VAL 136   0.661  23.365 -15.097
 1105   HG12  VAL 136          HG12      VAL 136   0.896  22.930 -13.399
 1106   HG13  VAL 136          HG13      VAL 136   0.820  21.655 -14.626
 1107   HG21  VAL 136          HG21      VAL 136  -2.558  21.277 -13.181
 1108   HG22  VAL 136          HG22      VAL 136  -1.035  20.466 -13.574
 1109   HG23  VAL 136          HG23      VAL 136  -1.109  21.586 -12.196
 1110    H    VAL 137           H        VAL 137  -1.435  23.362 -11.174
 1111    HA   VAL 137           HA       VAL 137  -0.397  25.870 -10.258
 1112    HB   VAL 137           HB       VAL 137   0.091  24.565  -8.151
 1113   HG11  VAL 137          HG11      VAL 137  -2.008  25.818  -8.498
 1114   HG12  VAL 137          HG12      VAL 137  -2.748  24.402  -9.273
 1115   HG13  VAL 137          HG13      VAL 137  -2.292  24.346  -7.558
 1116   HG21  VAL 137          HG21      VAL 137  -1.369  22.270  -9.541
 1117   HG22  VAL 137          HG22      VAL 137   0.371  22.298  -9.138
 1118   HG23  VAL 137          HG23      VAL 137  -0.839  22.347  -7.854
 1119    H    SER 138           H        SER 138   1.647  26.386  -9.379
 1120    HA   SER 138           HA       SER 138   3.642  26.243 -11.153
 1121    HB2  SER 138           HB2      SER 138   4.022  26.660  -8.165
 1122    HB3  SER 138           HB3      SER 138   4.932  27.415  -9.488
 1123    HG   SER 138           HG       SER 138   3.299  28.819  -8.652
 1124    H    PHE 139           H        PHE 139   3.281  23.843  -8.504
 1125    HA   PHE 139           HA       PHE 139   5.989  22.809  -9.015
 1126    HB2  PHE 139           HB2      PHE 139   5.556  21.212  -7.273
 1127    HB3  PHE 139           HB3      PHE 139   5.212  22.841  -6.748
 1128    HD1  PHE 139           HD1      PHE 139   2.909  23.554  -6.180
 1129    HD2  PHE 139           HD2      PHE 139   3.775  19.521  -7.460
 1130    HE1  PHE 139           HE1      PHE 139   0.701  22.807  -5.337
 1131    HE2  PHE 139           HE2      PHE 139   1.583  18.777  -6.563
 1132    HZ   PHE 139           HZ       PHE 139   0.031  20.423  -5.519
 1133    H    LYS 140           H        LYS 140   2.635  21.864  -9.837
 1134    HA   LYS 140           HA       LYS 140   3.446  19.371 -11.138
 1135    HB2  LYS 140           HB2      LYS 140   0.919  21.063 -11.339
 1136    HB3  LYS 140           HB3      LYS 140   1.139  19.511 -12.153
 1137    HG2  LYS 140           HG2      LYS 140   1.567  18.445  -9.913
 1138    HG3  LYS 140           HG3      LYS 140   1.175  19.992  -9.147
 1139    HD2  LYS 140           HD2      LYS 140  -1.113  19.891 -10.197
 1140    HD3  LYS 140           HD3      LYS 140  -0.691  18.306 -10.869
 1141    HE2  LYS 140           HE2      LYS 140  -0.170  17.573  -8.453
 1142    HE3  LYS 140           HE3      LYS 140  -0.896  19.095  -7.928
 1143    HZ1  LYS 140           HZ1      LYS 140  -2.980  18.354  -9.068
 1144    HZ2  LYS 140           HZ2      LYS 140  -2.293  16.875  -9.374
 1145    HZ3  LYS 140           HZ3      LYS 140  -2.547  17.368  -7.841
 1146    H    ARG 141           H        ARG 141   2.814  22.709 -12.254
 1147    HA   ARG 141           HA       ARG 141   3.263  22.657 -14.964
 1148    HB2  ARG 141           HB2      ARG 141   2.864  24.705 -13.785
 1149    HB3  ARG 141           HB3      ARG 141   4.276  24.473 -12.779
 1150    HG2  ARG 141           HG2      ARG 141   5.681  24.792 -14.967
 1151    HG3  ARG 141           HG3      ARG 141   4.167  25.389 -15.659
 1152    HD2  ARG 141           HD2      ARG 141   5.486  27.246 -14.869
 1153    HD3  ARG 141           HD3      ARG 141   4.055  27.097 -13.826
 1154    HE   ARG 141           HE       ARG 141   6.001  25.607 -12.519
 1155   HH11  ARG 141          HH21      ARG 141   5.873  29.002 -13.609
 1156   HH12  ARG 141          HH22      ARG 141   6.904  29.573 -12.347
 1157   HH21  ARG 141          HH11      ARG 141   7.328  26.367 -10.855
 1158   HH22  ARG 141          HH12      ARG 141   7.775  28.032 -10.765
 1159    H    ASP 142           H        ASP 142   5.882  22.384 -12.469
 1160    HA   ASP 142           HA       ASP 142   8.006  22.554 -14.309
 1161    HB2  ASP 142           HB2      ASP 142   8.295  22.868 -11.908
 1162    HB3  ASP 142           HB3      ASP 142   7.899  21.166 -11.619
 1163    H    VAL 143           H        VAL 143   6.185  19.578 -13.252
 1164    HA   VAL 143           HA       VAL 143   7.960  17.965 -14.929
 1165    HB   VAL 143           HB       VAL 143   6.596  16.148 -14.310
 1166   HG11  VAL 143          HG11      VAL 143   7.257  17.717 -11.796
 1167   HG12  VAL 143          HG12      VAL 143   7.302  15.951 -12.030
 1168   HG13  VAL 143          HG13      VAL 143   8.478  16.976 -12.847
 1169   HG21  VAL 143          HG21      VAL 143   4.857  17.868 -12.534
 1170   HG22  VAL 143          HG22      VAL 143   4.356  17.183 -14.106
 1171   HG23  VAL 143          HG23      VAL 143   4.783  16.109 -12.799
 1172    H    TYR 144           H        TYR 144   4.719  19.490 -15.088
 1173    HA   TYR 144           HA       TYR 144   3.883  17.977 -17.282
 1174    HB2  TYR 144           HB2      TYR 144   2.538  19.428 -15.631
 1175    HB3  TYR 144           HB3      TYR 144   2.897  20.788 -16.674
 1176    HD1  TYR 144           HD2      TYR 144   2.129  17.391 -18.154
 1177    HD2  TYR 144           HD1      TYR 144   0.478  21.168 -16.834
 1178    HE1  TYR 144           HE2      TYR 144  -0.035  16.753 -19.047
 1179    HE2  TYR 144           HE1      TYR 144  -1.707  20.520 -17.737
 1180    HH   TYR 144           HH       TYR 144  -2.267  17.396 -19.437
 1181    H    ARG 145           H        ARG 145   5.750  21.033 -17.211
 1182    HA   ARG 145           HA       ARG 145   5.760  21.452 -20.046
 1183    HB2  ARG 145           HB2      ARG 145   7.830  22.692 -19.751
 1184    HB3  ARG 145           HB3      ARG 145   6.656  23.141 -18.527
 1185    HG2  ARG 145           HG2      ARG 145   7.782  21.893 -16.820
 1186    HG3  ARG 145           HG3      ARG 145   8.958  21.245 -17.966
 1187    HD2  ARG 145           HD2      ARG 145   8.612  24.214 -17.397
 1188    HD3  ARG 145           HD3      ARG 145   9.760  23.161 -16.546
 1189    HE   ARG 145           HE       ARG 145  10.148  22.867 -19.359
 1190   HH11  ARG 145          HH11      ARG 145  10.713  25.287 -16.803
 1191   HH12  ARG 145          HH12      ARG 145  12.063  26.007 -17.604
 1192   HH21  ARG 145          HH21      ARG 145  11.925  23.849 -20.423
 1193   HH22  ARG 145          HH22      ARG 145  12.757  25.172 -19.698
 1194    H    ARG 146           H        ARG 146   7.560  19.104 -18.065
 1195    HA   ARG 146           HA       ARG 146   9.390  18.387 -20.243
 1196    HB2  ARG 146           HB2      ARG 146   8.730  16.530 -17.949
 1197    HB3  ARG 146           HB3      ARG 146  10.240  16.696 -18.831
 1198    HG2  ARG 146           HG2      ARG 146   9.072  18.647 -16.830
 1199    HG3  ARG 146           HG3      ARG 146  10.358  17.507 -16.489
 1200    HD2  ARG 146           HD2      ARG 146  11.911  18.672 -17.864
 1201    HD3  ARG 146           HD3      ARG 146  10.649  19.686 -18.590
 1202    HE   ARG 146           HE       ARG 146  10.413  20.212 -15.889
 1203   HH11  ARG 146          HH11      ARG 146  13.105  20.461 -18.221
 1204   HH12  ARG 146          HH12      ARG 146  13.900  21.736 -17.373
 1205   HH21  ARG 146          HH21      ARG 146  11.496  21.899 -14.740
 1206   HH22  ARG 146          HH22      ARG 146  12.965  22.564 -15.372
 1207    H    VAL 147           H        VAL 147   6.415  16.994 -18.792
 1208    HA   VAL 147           HA       VAL 147   6.056  14.786 -20.505
 1209    HB   VAL 147           HB       VAL 147   4.015  16.654 -19.241
 1210   HG11  VAL 147          HG11      VAL 147   2.906  15.341 -20.965
 1211   HG12  VAL 147          HG12      VAL 147   3.623  13.845 -20.320
 1212   HG13  VAL 147          HG13      VAL 147   2.424  14.770 -19.368
 1213   HG21  VAL 147          HG21      VAL 147   5.044  13.971 -18.218
 1214   HG22  VAL 147          HG22      VAL 147   5.561  15.532 -17.581
 1215   HG23  VAL 147          HG23      VAL 147   3.887  15.061 -17.415
 1216    H    MET 148           H        MET 148   4.960  18.217 -20.963
 1217    HA   MET 148           HA       MET 148   3.817  17.637 -23.508
 1218    HB2  MET 148           HB2      MET 148   4.646  20.260 -22.211
 1219    HB3  MET 148           HB3      MET 148   3.831  20.143 -23.770
 1220    HG2  MET 148           HG2      MET 148   2.270  18.490 -22.147
 1221    HG3  MET 148           HG3      MET 148   2.729  19.794 -21.066
 1222    HE1  MET 148           HE1      MET 148  -0.919  20.724 -21.894
 1223    HE2  MET 148           HE2      MET 148  -0.133  19.212 -21.407
 1224    HE3  MET 148           HE3      MET 148   0.318  20.745 -20.615
 1225    H    LYS 149           H        LYS 149   7.111  18.846 -22.596
 1226    HA   LYS 149           HA       LYS 149   8.027  19.215 -25.258
 1227    HB2  LYS 149           HB2      LYS 149   9.139  20.040 -23.213
 1228    HB3  LYS 149           HB3      LYS 149   9.619  18.401 -22.775
 1229    HG2  LYS 149           HG2      LYS 149  10.406  19.535 -25.475
 1230    HG3  LYS 149           HG3      LYS 149  11.248  20.083 -24.031
 1231    HD2  LYS 149           HD2      LYS 149  11.938  17.775 -23.486
 1232    HD3  LYS 149           HD3      LYS 149  11.108  17.163 -24.928
 1233    HE2  LYS 149           HE2      LYS 149  12.519  18.619 -26.370
 1234    HE3  LYS 149           HE3      LYS 149  13.351  19.244 -24.939
 1235    HZ1  LYS 149           HZ1      LYS 149  14.615  17.492 -26.025
 1236    HZ2  LYS 149           HZ2      LYS 149  14.193  16.993 -24.531
 1237    HZ3  LYS 149           HZ3      LYS 149  13.408  16.413 -25.854
 1238    H    GLU 150           H        GLU 150   7.947  16.292 -23.236
 1239    HA   GLU 150           HA       GLU 150   9.483  14.591 -24.896
 1240    HB2  GLU 150           HB2      GLU 150   7.216  14.107 -22.927
 1241    HB3  GLU 150           HB3      GLU 150   7.999  12.770 -23.742
 1242    HG2  GLU 150           HG2      GLU 150   9.715  14.775 -22.254
 1243    HG3  GLU 150           HG3      GLU 150   8.798  13.585 -21.349
 1244    H    PHE 151           H        PHE 151   6.131  15.670 -25.202
 1245    HA   PHE 151           HA       PHE 151   5.661  13.737 -27.428
 1246    HB2  PHE 151           HB2      PHE 151   3.769  15.249 -25.616
 1247    HB3  PHE 151           HB3      PHE 151   3.260  14.156 -26.884
 1248    HD1  PHE 151           HD2      PHE 151   5.468  11.959 -26.250
 1249    HD2  PHE 151           HD1      PHE 151   2.717  14.214 -23.797
 1250    HE1  PHE 151           HE2      PHE 151   5.549  10.212 -24.553
 1251    HE2  PHE 151           HE1      PHE 151   2.767  12.398 -22.102
 1252    HZ   PHE 151           HZ       PHE 151   4.169  10.403 -22.467
 1253    H    ALA 152           H        ALA 152   6.345  17.046 -26.987
 1254    HA   ALA 152           HA       ALA 152   4.530  18.397 -28.481
 1255    HB1  ALA 152           HB1      ALA 152   6.313  20.056 -28.936
 1256    HB2  ALA 152           HB2      ALA 152   6.336  19.483 -27.258
 1257    HB3  ALA 152           HB3      ALA 152   7.542  18.878 -28.415
 1258    H    SER 153           H        SER 153   7.611  17.217 -30.005
 1259    HA   SER 153           HA       SER 153   6.697  17.837 -32.586
 1260    HB2  SER 153           HB2      SER 153   8.749  15.695 -31.957
 1261    HB3  SER 153           HB3      SER 153   8.656  16.768 -33.373
 1262    HG   SER 153           HG       SER 153  10.227  17.512 -31.853
 1263    H    VAL 154           H        VAL 154   5.788  15.121 -30.587
 1264    HA   VAL 154           HA       VAL 154   5.383  13.261 -32.828
 1265    HB   VAL 154           HB       VAL 154   4.340  13.007 -29.983
 1266   HG11  VAL 154          HG11      VAL 154   3.414  11.398 -31.623
 1267   HG12  VAL 154          HG12      VAL 154   5.058  10.936 -32.114
 1268   HG13  VAL 154          HG13      VAL 154   4.482  10.574 -30.476
 1269   HG21  VAL 154          HG21      VAL 154   6.386  11.659 -29.494
 1270   HG22  VAL 154          HG22      VAL 154   7.087  12.198 -31.038
 1271   HG23  VAL 154          HG23      VAL 154   6.750  13.362 -29.737
 1272    H    VAL 155           H        VAL 155   3.552  15.551 -30.822
 1273    HA   VAL 155           HA       VAL 155   1.014  14.918 -32.134
 1274    HB   VAL 155           HB       VAL 155   1.860  17.036 -30.112
 1275   HG11  VAL 155          HG11      VAL 155  -0.601  17.188 -29.614
 1276   HG12  VAL 155          HG12      VAL 155  -0.178  17.780 -31.225
 1277   HG13  VAL 155          HG13      VAL 155  -0.929  16.174 -31.037
 1278   HG21  VAL 155          HG21      VAL 155   0.383  14.386 -29.756
 1279   HG22  VAL 155          HG22      VAL 155   2.070  14.672 -29.280
 1280   HG23  VAL 155          HG23      VAL 155   0.790  15.532 -28.464
 1281    H    MET 156           H        MET 156   3.468  17.562 -32.235
 1282    HA   MET 156           HA       MET 156   1.928  19.174 -34.010
 1283    HB2  MET 156           HB2      MET 156   4.910  19.114 -33.406
 1284    HB3  MET 156           HB3      MET 156   4.140  20.336 -34.428
 1285    HG2  MET 156           HG2      MET 156   3.427  19.813 -31.517
 1286    HG3  MET 156           HG3      MET 156   4.457  21.113 -32.109
 1287    HE1  MET 156           HE1      MET 156   1.238  22.938 -30.821
 1288    HE2  MET 156           HE2      MET 156   2.005  21.474 -30.159
 1289    HE3  MET 156           HE3      MET 156   3.012  22.829 -30.726
 1290    H    SER 157           H        SER 157   4.211  16.502 -34.717
 1291    HA   SER 157           HA       SER 157   4.602  16.949 -37.454
 1292    HB2  SER 157           HB2      SER 157   4.137  14.352 -35.929
 1293    HB3  SER 157           HB3      SER 157   4.681  14.423 -37.612
 1294    HG   SER 157           HG       SER 157   6.035  15.336 -35.285
 1295    H    LEU 158           H        LEU 158   1.653  15.878 -35.818
 1296    HA   LEU 158           HA       LEU 158   0.365  14.774 -38.162
 1297    HB2  LEU 158           HB2      LEU 158  -0.848  15.880 -35.605
 1298    HB3  LEU 158           HB3      LEU 158  -1.669  14.858 -36.791
 1299    HG   LEU 158           HG       LEU 158   0.682  13.992 -35.042
 1300   HD11  LEU 158          HD11      LEU 158  -0.998  12.681 -33.822
 1301   HD12  LEU 158          HD12      LEU 158  -1.357  14.425 -33.726
 1302   HD13  LEU 158          HD13      LEU 158  -2.294  13.373 -34.821
 1303   HD21  LEU 158          HD21      LEU 158  -1.114  12.364 -36.897
 1304   HD22  LEU 158          HD22      LEU 158   0.619  12.692 -37.128
 1305   HD23  LEU 158          HD23      LEU 158   0.091  11.700 -35.768
 1306    H    GLN 159           H        GLN 159   0.474  18.024 -36.649
 1307    HA   GLN 159           HA       GLN 159  -1.525  19.035 -38.599
 1308    HB2  GLN 159           HB2      GLN 159  -0.277  20.555 -36.273
 1309    HB3  GLN 159           HB3      GLN 159  -1.693  21.003 -37.216
 1310    HG2  GLN 159           HG2      GLN 159  -1.421  18.780 -35.192
 1311    HG3  GLN 159           HG3      GLN 159  -2.464  20.191 -35.182
 1312   HE21  GLN 159          HE22      GLN 159  -2.512  16.850 -35.689
 1313   HE22  GLN 159          HE21      GLN 159  -4.029  16.779 -36.566
 1314    H    GLU 160           H        GLU 160   1.905  18.899 -38.125
 1315    HA   GLU 160           HA       GLU 160   2.427  20.924 -40.187
 1316    HB2  GLU 160           HB2      GLU 160   3.708  20.624 -37.974
 1317    HB3  GLU 160           HB3      GLU 160   4.441  19.194 -38.697
 1318    HG2  GLU 160           HG2      GLU 160   5.349  20.652 -40.538
 1319    HG3  GLU 160           HG3      GLU 160   4.531  22.039 -39.821
 1320    H    ASN 161           H        ASN 161   0.830  18.652 -40.993
 1321    HA   ASN 161           HA       ASN 161   2.717  17.063 -42.698
 1322    HB2  ASN 161           HB2      ASN 161   1.366  15.756 -41.031
 1323    HB3  ASN 161           HB3      ASN 161  -0.095  16.289 -41.867
 1324   HD21  ASN 161          HD21      ASN 161  -0.606  14.032 -42.405
 1325   HD22  ASN 161          HD22      ASN 161   0.304  13.176 -43.629
 1326    H    THR 162           H        THR 162   1.939  19.707 -43.290
 1327    HA   THR 162           HA       THR 162   0.827  21.120 -44.556
 1328    HB   THR 162           HB       THR 162   0.863  20.533 -47.048
 1329    HG1  THR 162           HG1      THR 162   0.855  18.206 -46.757
 1330   HG21  THR 162          HG21      THR 162   3.303  20.682 -47.125
 1331   HG22  THR 162          HG22      THR 162   2.644  21.772 -45.897
 1332   HG23  THR 162          HG23      THR 162   3.415  20.246 -45.407
 1333    HA   PRO 163           HA       PRO 163  -3.533  19.461 -44.842
 1334    HB2  PRO 163           HB2      PRO 163  -4.628  19.809 -42.396
 1335    HB3  PRO 163           HB3      PRO 163  -3.770  18.293 -42.822
 1336    HG2  PRO 163           HG2      PRO 163  -2.668  20.681 -41.297
 1337    HG3  PRO 163           HG3      PRO 163  -2.587  18.949 -40.856
 1338    HD2  PRO 163           HD2      PRO 163  -0.530  20.197 -42.166
 1339    HD3  PRO 163           HD3      PRO 163  -0.990  18.485 -42.456
 1340    H    LYS 164           H        LYS 164  -1.838  21.953 -43.003
 1341    HA   LYS 164           HA       LYS 164  -2.112  24.180 -42.662
 1342    HB2  LYS 164           HB2      LYS 164  -3.199  24.146 -45.502
 1343    HB3  LYS 164           HB3      LYS 164  -2.766  25.587 -44.582
 1344    HG2  LYS 164           HG2      LYS 164  -0.427  24.816 -44.410
 1345    HG3  LYS 164           HG3      LYS 164  -0.824  23.368 -45.363
 1346    HD2  LYS 164           HD2      LYS 164  -1.517  24.771 -47.260
 1347    HD3  LYS 164           HD3      LYS 164  -1.166  26.242 -46.356
 1348    HE2  LYS 164           HE2      LYS 164   0.909  24.102 -47.034
 1349    HE3  LYS 164           HE3      LYS 164   0.594  25.520 -48.031
 1350    HZ1  LYS 164           HZ1      LYS 164   2.458  25.915 -46.579
 1351    HZ2  LYS 164           HZ2      LYS 164   1.258  26.933 -46.167
 1352    HZ3  LYS 164           HZ3      LYS 164   1.583  25.621 -45.235
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1   3.218  -1.685   0.162
    2    H2   MET   1           H2       MET   1   3.053  -2.800  -1.036
    3    H3   MET   1           H3       MET   1   4.472  -2.009  -0.829
    4    HA   MET   1           HA       MET   1   3.306  -1.136  -2.726
    5    HB2  MET   1           HB2      MET   1   1.021  -1.706  -1.650
    6    HB3  MET   1           HB3      MET   1   1.141  -0.166  -0.807
    7    HG2  MET   1           HG2      MET   1  -0.221  -0.072  -2.878
    8    HG3  MET   1           HG3      MET   1   1.143   1.022  -2.948
    9    HE1  MET   1           HE1      MET   1   0.112   0.980  -5.586
   10    HE2  MET   1           HE2      MET   1   1.837   1.401  -5.426
   11    HE3  MET   1           HE3      MET   1   1.318   0.268  -6.688
   12    H    ILE   2           H        ILE   2   3.023   1.342  -3.104
   13    HA   ILE   2           HA       ILE   2   3.852   3.382  -3.088
   14    HB   ILE   2           HB       ILE   2   4.630   3.018  -0.173
   15   HG12  ILE   2          HG12      ILE   2   2.923   4.869   0.099
   16   HG13  ILE   2          HG13      ILE   2   2.443   4.609  -1.587
   17   HG21  ILE   2          HG21      ILE   2   6.188   4.593  -1.191
   18   HG22  ILE   2          HG22      ILE   2   4.830   5.512  -1.889
   19   HG23  ILE   2          HG23      ILE   2   5.061   5.431  -0.141
   20   HD11  ILE   2          HD11      ILE   2   0.952   3.663   0.158
   21   HD12  ILE   2          HD12      ILE   2   1.509   2.464  -1.013
   22   HD13  ILE   2          HD13      ILE   2   2.253   2.538   0.618
   23    H    ASP   3           H        ASP   3   5.732   4.191  -3.969
   24    HA   ASP   3           HA       ASP   3   7.724   2.203  -4.708
   25    HB2  ASP   3           HB2      ASP   3   6.910   3.978  -6.258
   26    HB3  ASP   3           HB3      ASP   3   7.625   5.199  -5.208
   27    H    ASP   4           H        ASP   4   9.964   2.328  -4.047
   28    HA   ASP   4           HA       ASP   4  10.335   2.428  -1.343
   29    HB2  ASP   4           HB2      ASP   4  11.782   1.240  -2.916
   30    HB3  ASP   4           HB3      ASP   4  12.439   2.776  -3.503
   31    H    ASP   5           H        ASP   5  10.822   5.220  -3.494
   32    HA   ASP   5           HA       ASP   5  12.295   6.701  -1.504
   33    HB2  ASP   5           HB2      ASP   5  12.622   6.885  -3.987
   34    HB3  ASP   5           HB3      ASP   5  11.083   7.749  -4.068
   35    H    GLY   6           H        GLY   6   9.025   5.995  -1.731
   36    HA2  GLY   6           HA2      GLY   6   7.416   6.617  -0.175
   37    HA3  GLY   6           HA3      GLY   6   8.202   8.193   0.063
   38    H    TYR   7           H        TYR   7   7.473   6.600  -3.098
   39    HA   TYR   7           HA       TYR   7   5.813   9.005  -3.757
   40    HB2  TYR   7           HB2      TYR   7   7.850   7.458  -5.365
   41    HB3  TYR   7           HB3      TYR   7   6.507   8.280  -6.147
   42    HD1  TYR   7           HD1      TYR   7   9.097   9.050  -3.504
   43    HD2  TYR   7           HD2      TYR   7   6.820  10.446  -6.882
   44    HE1  TYR   7           HE1      TYR   7  10.277  11.200  -3.401
   45    HE2  TYR   7           HE2      TYR   7   7.963  12.610  -6.764
   46    HH   TYR   7           HH       TYR   7   9.711  13.852  -5.769
   47    H    ARG   8           H        ARG   8   3.928   8.724  -4.940
   48    HA   ARG   8           HA       ARG   8   2.778   5.982  -4.608
   49    HB2  ARG   8           HB2      ARG   8   1.749   8.186  -3.772
   50    HB3  ARG   8           HB3      ARG   8   1.283   8.482  -5.433
   51    HG2  ARG   8           HG2      ARG   8   0.489   6.059  -3.763
   52    HG3  ARG   8           HG3      ARG   8  -0.481   7.522  -3.967
   53    HD2  ARG   8           HD2      ARG   8  -0.754   7.083  -6.358
   54    HD3  ARG   8           HD3      ARG   8   0.295   5.663  -6.231
   55    HE   ARG   8           HE       ARG   8  -2.176   5.865  -4.581
   56   HH11  ARG   8          HH21      ARG   8  -0.466   4.198  -7.231
   57   HH12  ARG   8          HH22      ARG   8  -1.522   2.808  -7.201
   58   HH21  ARG   8          HH11      ARG   8  -3.541   4.018  -4.545
   59   HH22  ARG   8          HH12      ARG   8  -3.307   2.729  -5.669
   60    HA   PRO   9           HA       PRO   9   3.645   5.691  -9.070
   61    HB2  PRO   9           HB2      PRO   9   2.137   3.083  -8.853
   62    HB3  PRO   9           HB3      PRO   9   3.722   3.413  -9.621
   63    HG2  PRO   9           HG2      PRO   9   3.600   2.205  -7.208
   64    HG3  PRO   9           HG3      PRO   9   4.795   3.512  -7.480
   65    HD2  PRO   9           HD2      PRO   9   2.067   3.731  -6.161
   66    HD3  PRO   9           HD3      PRO   9   3.652   4.308  -5.580
   67    H    ASN  10           H        ASN  10   2.520   6.579 -10.748
   68    HA   ASN  10           HA       ASN  10  -0.466   6.585 -10.775
   69    HB2  ASN  10           HB2      ASN  10   1.468   8.935 -10.674
   70    HB3  ASN  10           HB3      ASN  10  -0.089   9.107 -11.466
   71   HD21  ASN  10          HD22      ASN  10   1.460   8.392  -8.339
   72   HD22  ASN  10          HD21      ASN  10   0.145   9.084  -7.416
   73    H    VAL  11           H        VAL  11  -1.386   7.181 -12.827
   74    HA   VAL  11           HA       VAL  11   0.419   7.452 -15.186
   75    HB   VAL  11           HB       VAL  11  -1.556   6.370 -16.441
   76   HG11  VAL  11          HG11      VAL  11  -0.590   4.131 -16.215
   77   HG12  VAL  11          HG12      VAL  11   0.681   5.366 -16.271
   78   HG13  VAL  11          HG13      VAL  11   0.246   4.608 -14.728
   79   HG21  VAL  11          HG21      VAL  11  -3.124   6.220 -14.468
   80   HG22  VAL  11          HG22      VAL  11  -2.863   4.705 -15.311
   81   HG23  VAL  11          HG23      VAL  11  -2.064   4.985 -13.761
   82    H    GLY  12           H        GLY  12   0.061   9.565 -15.971
   83    HA2  GLY  12           HA2      GLY  12  -2.638  10.814 -15.615
   84    HA3  GLY  12           HA3      GLY  12  -1.138  11.658 -16.011
   85    H    ILE  13           H        ILE  13  -3.999  10.637 -17.421
   86    HA   ILE  13           HA       ILE  13  -2.814   9.655 -19.920
   87    HB   ILE  13           HB       ILE  13  -5.675  10.557 -19.470
   88   HG12  ILE  13          HG12      ILE  13  -5.439   8.696 -17.920
   89   HG13  ILE  13          HG13      ILE  13  -6.297   8.143 -19.345
   90   HG21  ILE  13          HG21      ILE  13  -6.066   9.113 -21.458
   91   HG22  ILE  13          HG22      ILE  13  -4.947  10.435 -21.805
   92   HG23  ILE  13          HG23      ILE  13  -4.308   8.814 -21.567
   93   HD11  ILE  13          HD11      ILE  13  -3.330   7.686 -18.806
   94   HD12  ILE  13          HD12      ILE  13  -4.630   6.539 -18.495
   95   HD13  ILE  13          HD13      ILE  13  -4.284   7.024 -20.163
   96    H    VAL  14           H        VAL  14  -1.871  11.048 -21.381
   97    HA   VAL  14           HA       VAL  14  -2.870  13.847 -21.467
   98    HB   VAL  14           HB       VAL  14  -0.547  12.639 -23.032
   99   HG11  VAL  14          HG11      VAL  14  -0.048  14.988 -23.556
  100   HG12  VAL  14          HG12      VAL  14  -1.673  14.574 -24.116
  101   HG13  VAL  14          HG13      VAL  14  -1.461  15.528 -22.632
  102   HG21  VAL  14          HG21      VAL  14   0.851  14.093 -21.526
  103   HG22  VAL  14          HG22      VAL  14  -0.564  14.277 -20.480
  104   HG23  VAL  14          HG23      VAL  14   0.146  12.655 -20.769
  105    H    ILE  15           H        ILE  15  -5.002  13.214 -22.217
  106    HA   ILE  15           HA       ILE  15  -5.207  11.799 -24.777
  107    HB   ILE  15           HB       ILE  15  -7.171  13.683 -23.386
  108   HG12  ILE  15          HG12      ILE  15  -6.880  11.483 -22.264
  109   HG13  ILE  15          HG13      ILE  15  -8.491  11.807 -22.851
  110   HG21  ILE  15          HG21      ILE  15  -7.666  13.916 -25.708
  111   HG22  ILE  15          HG22      ILE  15  -7.527  12.156 -25.986
  112   HG23  ILE  15          HG23      ILE  15  -8.871  12.835 -25.025
  113   HD11  ILE  15          HD11      ILE  15  -7.659   9.434 -23.297
  114   HD12  ILE  15          HD12      ILE  15  -8.257  10.287 -24.724
  115   HD13  ILE  15          HD13      ILE  15  -6.518  10.132 -24.466
  116    H    CYS  16           H        CYS  16  -4.941  12.720 -26.798
  117    HA   CYS  16           HA       CYS  16  -4.658  15.679 -26.899
  118    HB2  CYS  16           HB2      CYS  16  -2.440  14.757 -27.228
  119    HB3  CYS  16           HB3      CYS  16  -3.058  13.557 -28.392
  120    HG   CYS  16           HG       CYS  16  -3.462  16.859 -28.662
  121    H    ASN  17           H        ASN  17  -6.240  16.478 -28.180
  122    HA   ASN  17           HA       ASN  17  -7.941  14.590 -29.665
  123    HB2  ASN  17           HB2      ASN  17  -9.036  16.524 -28.489
  124    HB3  ASN  17           HB3      ASN  17  -8.114  17.642 -29.513
  125   HD21  ASN  17          HD22      ASN  17 -11.024  15.866 -29.341
  126   HD22  ASN  17          HD21      ASN  17 -11.398  15.801 -31.054
  127    H    ARG  18           H        ARG  18  -7.295  14.145 -31.644
  128    HA   ARG  18           HA       ARG  18  -4.862  14.528 -32.764
  129    HB2  ARG  18           HB2      ARG  18  -6.068  13.995 -34.952
  130    HB3  ARG  18           HB3      ARG  18  -6.299  12.878 -33.574
  131    HG2  ARG  18           HG2      ARG  18  -8.515  13.933 -33.097
  132    HG3  ARG  18           HG3      ARG  18  -8.295  14.995 -34.490
  133    HD2  ARG  18           HD2      ARG  18  -8.174  12.965 -35.957
  134    HD3  ARG  18           HD3      ARG  18  -8.470  11.937 -34.557
  135    HE   ARG  18           HE       ARG  18 -10.351  13.650 -36.010
  136   HH11  ARG  18          HH11      ARG  18  -9.957  11.677 -33.010
  137   HH12  ARG  18          HH12      ARG  18 -11.664  11.639 -32.714
  138   HH21  ARG  18          HH21      ARG  18 -12.587  13.502 -35.562
  139   HH22  ARG  18          HH22      ARG  18 -13.155  12.653 -34.170
  140    H    GLN  19           H        GLN  19  -7.453  16.920 -32.943
  141    HA   GLN  19           HA       GLN  19  -6.313  18.411 -35.094
  142    HB2  GLN  19           HB2      GLN  19  -7.984  20.030 -34.661
  143    HB3  GLN  19           HB3      GLN  19  -8.697  18.454 -34.333
  144    HG2  GLN  19           HG2      GLN  19  -8.096  18.923 -31.828
  145    HG3  GLN  19           HG3      GLN  19  -7.798  20.571 -32.350
  146   HE21  GLN  19          HE22      GLN  19 -10.298  17.994 -32.391
  147   HE22  GLN  19          HE21      GLN  19 -11.673  19.091 -32.236
  148    H    GLY  20           H        GLY  20  -4.854  17.881 -32.184
  149    HA2  GLY  20           HA2      GLY  20  -2.666  18.684 -31.823
  150    HA3  GLY  20           HA3      GLY  20  -3.047  20.199 -32.642
  151    H    GLN  21           H        GLN  21  -4.988  18.665 -30.041
  152    HA   GLN  21           HA       GLN  21  -4.347  20.878 -28.191
  153    HB2  GLN  21           HB2      GLN  21  -7.058  20.317 -29.465
  154    HB3  GLN  21           HB3      GLN  21  -6.956  20.906 -27.821
  155    HG2  GLN  21           HG2      GLN  21  -7.074  22.928 -28.771
  156    HG3  GLN  21           HG3      GLN  21  -5.341  22.753 -28.888
  157   HE21  GLN  21          HE22      GLN  21  -4.371  22.329 -31.062
  158   HE22  GLN  21          HE21      GLN  21  -5.320  22.551 -32.512
  159    H    VAL  22           H        VAL  22  -5.276  20.295 -25.953
  160    HA   VAL  22           HA       VAL  22  -5.046  17.339 -25.598
  161    HB   VAL  22           HB       VAL  22  -3.592  18.042 -23.539
  162   HG11  VAL  22          HG11      VAL  22  -2.772  16.681 -25.358
  163   HG12  VAL  22          HG12      VAL  22  -2.557  18.107 -26.395
  164   HG13  VAL  22          HG13      VAL  22  -1.568  17.895 -24.919
  165   HG21  VAL  22          HG21      VAL  22  -3.917  20.505 -23.808
  166   HG22  VAL  22          HG22      VAL  22  -2.215  19.998 -23.820
  167   HG23  VAL  22          HG23      VAL  22  -3.020  20.438 -25.334
  168    H    MET  23           H        MET  23  -5.372  16.585 -23.463
  169    HA   MET  23           HA       MET  23  -7.966  16.747 -22.592
  170    HB2  MET  23           HB2      MET  23  -6.131  15.004 -22.105
  171    HB3  MET  23           HB3      MET  23  -5.551  16.053 -20.845
  172    HG2  MET  23           HG2      MET  23  -6.950  14.368 -19.865
  173    HG3  MET  23           HG3      MET  23  -7.784  15.911 -19.724
  174    HE1  MET  23           HE1      MET  23 -10.694  13.254 -20.112
  175    HE2  MET  23           HE2      MET  23  -9.167  13.115 -19.211
  176    HE3  MET  23           HE3      MET  23 -10.107  14.624 -19.146
  177    H    TRP  24           H        TRP  24  -9.093  18.287 -21.426
  178    HA   TRP  24           HA       TRP  24  -8.038  19.270 -18.969
  179    HB2  TRP  24           HB2      TRP  24  -7.229  20.965 -20.784
  180    HB3  TRP  24           HB3      TRP  24  -8.902  21.494 -20.845
  181    HD1  TRP  24           HD1      TRP  24  -9.271  23.513 -19.271
  182    HE1  TRP  24           HE1      TRP  24  -8.199  24.479 -17.173
  183    HE3  TRP  24           HE3      TRP  24  -5.774  19.873 -18.399
  184    HZ2  TRP  24           HZ2      TRP  24  -6.023  23.795 -15.357
  185    HZ3  TRP  24           HZ3      TRP  24  -4.213  20.069 -16.489
  186    HH2  TRP  24           HH2      TRP  24  -4.318  22.031 -14.969
  187    H    ALA  25           H        ALA  25  -9.816  19.304 -17.606
  188    HA   ALA  25           HA       ALA  25 -12.529  19.558 -18.676
  189    HB1  ALA  25           HB1      ALA  25 -13.192  17.366 -17.643
  190    HB2  ALA  25           HB2      ALA  25 -12.117  17.166 -19.038
  191    HB3  ALA  25           HB3      ALA  25 -11.477  16.995 -17.391
  192    H    ARG  26           H        ARG  26 -14.034  19.979 -16.958
  193    HA   ARG  26           HA       ARG  26 -12.756  21.417 -14.761
  194    HB2  ARG  26           HB2      ARG  26 -14.793  22.206 -15.985
  195    HB3  ARG  26           HB3      ARG  26 -15.705  20.854 -15.301
  196    HG2  ARG  26           HG2      ARG  26 -15.348  21.758 -13.026
  197    HG3  ARG  26           HG3      ARG  26 -14.284  23.023 -13.673
  198    HD2  ARG  26           HD2      ARG  26 -16.527  23.913 -13.187
  199    HD3  ARG  26           HD3      ARG  26 -16.123  24.034 -14.907
  200    HE   ARG  26           HE       ARG  26 -17.494  21.598 -14.599
  201   HH11  ARG  26          HH11      ARG  26 -18.277  25.056 -14.193
  202   HH12  ARG  26          HH12      ARG  26 -19.930  24.858 -14.644
  203   HH21  ARG  26          HH21      ARG  26 -19.603  21.347 -15.241
  204   HH22  ARG  26          HH22      ARG  26 -20.732  22.679 -15.229
  205    H    ARG  27           H        ARG  27 -12.613  20.664 -12.561
  206    HA   ARG  27           HA       ARG  27 -12.684  17.780 -12.425
  207    HB2  ARG  27           HB2      ARG  27 -10.860  19.284 -11.550
  208    HB3  ARG  27           HB3      ARG  27 -11.891  19.675 -10.197
  209    HG2  ARG  27           HG2      ARG  27 -10.815  16.914 -10.921
  210    HG3  ARG  27           HG3      ARG  27 -10.222  17.991  -9.656
  211    HD2  ARG  27           HD2      ARG  27 -12.319  17.730  -8.413
  212    HD3  ARG  27           HD3      ARG  27 -12.868  16.554  -9.627
  213    HE   ARG  27           HE       ARG  27 -10.291  15.798  -8.719
  214   HH11  ARG  27          HH11      ARG  27 -13.636  16.024  -7.448
  215   HH12  ARG  27          HH12      ARG  27 -13.405  14.762  -6.283
  216   HH21  ARG  27          HH21      ARG  27 -10.104  13.951  -7.375
  217   HH22  ARG  27          HH22      ARG  27 -11.325  13.606  -6.185
  218    H    PHE  28           H        PHE  28 -14.196  16.593 -11.616
  219    HA   PHE  28           HA       PHE  28 -16.825  17.291 -10.996
  220    HB2  PHE  28           HB2      PHE  28 -16.141  15.090 -11.695
  221    HB3  PHE  28           HB3      PHE  28 -15.009  14.940 -10.365
  222    HD1  PHE  28           HD1      PHE  28 -18.662  15.084 -11.152
  223    HD2  PHE  28           HD2      PHE  28 -15.589  13.944  -8.347
  224    HE1  PHE  28           HE1      PHE  28 -20.340  13.818  -9.842
  225    HE2  PHE  28           HE2      PHE  28 -17.270  12.623  -7.054
  226    HZ   PHE  28           HZ       PHE  28 -19.652  12.586  -7.785
  227    H    GLY  29           H        GLY  29 -17.757  18.163  -9.213
  228    HA2  GLY  29           HA2      GLY  29 -18.268  18.597  -7.031
  229    HA3  GLY  29           HA3      GLY  29 -16.949  17.540  -6.524
  230    H    GLN  30           H        GLN  30 -14.964  19.211  -8.134
  231    HA   GLN  30           HA       GLN  30 -14.379  21.187  -6.069
  232    HB2  GLN  30           HB2      GLN  30 -12.784  19.575  -7.336
  233    HB3  GLN  30           HB3      GLN  30 -12.940  20.714  -8.683
  234    HG2  GLN  30           HG2      GLN  30 -12.074  22.505  -7.077
  235    HG3  GLN  30           HG3      GLN  30 -11.724  21.199  -5.946
  236   HE21  GLN  30          HE22      GLN  30 -10.692  22.851  -8.833
  237   HE22  GLN  30          HE21      GLN  30  -9.366  21.809  -9.302
  238    H    HIS  31           H        HIS  31 -15.568  21.111  -9.421
  239    HA   HIS  31           HA       HIS  31 -16.296  22.611 -10.870
  240    HB2  HIS  31           HB2      HIS  31 -17.004  24.347  -8.494
  241    HB3  HIS  31           HB3      HIS  31 -17.644  24.482 -10.129
  242    HD1  HIS  31           HD1      HIS  31 -19.281  22.365 -10.939
  243    HD2  HIS  31           HD2      HIS  31 -18.121  22.553  -6.895
  244    HE1  HIS  31           HE1      HIS  31 -20.795  20.753  -9.686
  245    H    SER  32           H        SER  32 -13.489  22.618 -10.256
  246    HA   SER  32           HA       SER  32 -12.806  24.903 -11.889
  247    HB2  SER  32           HB2      SER  32 -10.814  25.476 -10.396
  248    HB3  SER  32           HB3      SER  32 -12.406  26.019  -9.855
  249    HG   SER  32           HG       SER  32 -11.413  25.143  -8.093
  250    H    TRP  33           H        TRP  33 -10.281  24.485 -12.486
  251    HA   TRP  33           HA       TRP  33 -10.445  21.925 -13.742
  252    HB2  TRP  33           HB2      TRP  33  -8.104  23.840 -13.779
  253    HB3  TRP  33           HB3      TRP  33  -8.569  22.647 -14.994
  254    HD1  TRP  33           HD1      TRP  33  -9.156  26.202 -13.945
  255    HE1  TRP  33           HE1      TRP  33 -10.965  27.327 -15.343
  256    HE3  TRP  33           HE3      TRP  33 -10.759  22.135 -16.599
  257    HZ2  TRP  33           HZ2      TRP  33 -12.881  26.568 -17.393
  258    HZ3  TRP  33           HZ3      TRP  33 -12.598  22.367 -18.262
  259    HH2  TRP  33           HH2      TRP  33 -13.661  24.572 -18.653
  260    H    GLN  34           H        GLN  34  -8.607  20.349 -13.919
  261    HA   GLN  34           HA       GLN  34  -6.667  20.268 -11.766
  262    HB2  GLN  34           HB2      GLN  34  -8.697  19.089 -10.827
  263    HB3  GLN  34           HB3      GLN  34  -8.567  17.913 -12.137
  264    HG2  GLN  34           HG2      GLN  34  -6.100  17.601 -11.117
  265    HG3  GLN  34           HG3      GLN  34  -6.838  18.315  -9.695
  266   HE21  GLN  34          HE22      GLN  34  -6.714  15.519 -11.857
  267   HE22  GLN  34          HE21      GLN  34  -7.645  14.429 -10.825
  268    H    PHE  35           H        PHE  35  -4.922  19.031 -12.340
  269    HA   PHE  35           HA       PHE  35  -4.301  18.404 -15.052
  270    HB2  PHE  35           HB2      PHE  35  -2.352  17.187 -13.801
  271    HB3  PHE  35           HB3      PHE  35  -2.475  18.933 -13.676
  272    HD1  PHE  35           HD1      PHE  35  -3.234  15.742 -11.839
  273    HD2  PHE  35           HD2      PHE  35  -2.878  20.040 -11.561
  274    HE1  PHE  35           HE1      PHE  35  -3.693  15.647  -9.397
  275    HE2  PHE  35           HE2      PHE  35  -3.313  19.920  -9.127
  276    HZ   PHE  35           HZ       PHE  35  -3.767  17.729  -8.047
  277    HA   PRO  36           HA       PRO  36  -5.890  14.193 -15.147
  278    HB2  PRO  36           HB2      PRO  36  -3.494  13.442 -16.762
  279    HB3  PRO  36           HB3      PRO  36  -5.218  13.209 -17.153
  280    HG2  PRO  36           HG2      PRO  36  -3.786  15.166 -18.402
  281    HG3  PRO  36           HG3      PRO  36  -5.485  15.432 -17.900
  282    HD2  PRO  36           HD2      PRO  36  -2.957  16.307 -16.466
  283    HD3  PRO  36           HD3      PRO  36  -4.457  17.232 -16.807
  284    H    GLN  37           H        GLN  37  -5.332  12.100 -14.259
  285    HA   GLN  37           HA       GLN  37  -2.799  11.318 -13.243
  286    HB2  GLN  37           HB2      GLN  37  -3.130  11.486 -10.870
  287    HB3  GLN  37           HB3      GLN  37  -2.980  13.069 -11.596
  288    HG2  GLN  37           HG2      GLN  37  -5.426  13.416 -11.449
  289    HG3  GLN  37           HG3      GLN  37  -5.647  11.780 -10.840
  290   HE21  GLN  37          HE22      GLN  37  -6.834  13.384  -9.297
  291   HE22  GLN  37          HE21      GLN  37  -5.936  13.808  -7.845
  292    H    GLY  38           H        GLY  38  -3.060   9.297 -11.880
  293    HA2  GLY  38           HA2      GLY  38  -5.556   8.321 -11.013
  294    HA3  GLY  38           HA3      GLY  38  -5.163   7.544 -12.561
  295    H    GLY  39           H        GLY  39  -4.954   6.893  -9.382
  296    HA2  GLY  39           HA2      GLY  39  -2.197   6.178  -8.990
  297    HA3  GLY  39           HA3      GLY  39  -3.591   5.651  -8.027
  298    H    ILE  40           H        ILE  40  -1.204   4.333  -9.555
  299    HA   ILE  40           HA       ILE  40  -2.395   2.456 -11.399
  300    HB   ILE  40           HB       ILE  40   0.235   2.538  -9.896
  301   HG12  ILE  40          HG12      ILE  40  -0.553   2.994 -12.812
  302   HG13  ILE  40          HG13      ILE  40  -0.179   4.249 -11.645
  303   HG21  ILE  40          HG21      ILE  40  -0.494   0.500 -12.035
  304   HG22  ILE  40          HG22      ILE  40   1.083   0.699 -11.261
  305   HG23  ILE  40          HG23      ILE  40  -0.276   0.144 -10.308
  306   HD11  ILE  40          HD11      ILE  40   1.745   2.222 -12.846
  307   HD12  ILE  40          HD12      ILE  40   1.734   3.982 -13.036
  308   HD13  ILE  40          HD13      ILE  40   2.169   3.273 -11.472
  309    H    ASN  41           H        ASN  41  -3.362   0.559 -11.050
  310    HA   ASN  41           HA       ASN  41  -4.363  -0.128  -8.418
  311    HB2  ASN  41           HB2      ASN  41  -5.811  -0.370 -10.316
  312    HB3  ASN  41           HB3      ASN  41  -4.588  -1.263 -11.212
  313   HD21  ASN  41          HD22      ASN  41  -6.014  -2.956 -11.644
  314   HD22  ASN  41          HD21      ASN  41  -6.507  -4.113 -10.403
  315    HA   PRO  42           HA       PRO  42  -0.702  -2.345  -7.385
  316    HB2  PRO  42           HB2      PRO  42  -2.518  -3.797  -5.436
  317    HB3  PRO  42           HB3      PRO  42  -0.867  -3.144  -5.168
  318    HG2  PRO  42           HG2      PRO  42  -3.023  -1.740  -4.332
  319    HG3  PRO  42           HG3      PRO  42  -1.684  -0.891  -5.171
  320    HD2  PRO  42           HD2      PRO  42  -4.338  -1.806  -6.308
  321    HD3  PRO  42           HD3      PRO  42  -3.469  -0.256  -6.537
  322    H    GLY  43           H        GLY  43   0.063  -3.685  -8.734
  323    HA2  GLY  43           HA2      GLY  43   0.698  -5.882  -9.357
  324    HA3  GLY  43           HA3      GLY  43  -0.893  -6.496  -8.887
  325    H    GLU  44           H        GLU  44  -1.407  -3.662 -10.635
  326    HA   GLU  44           HA       GLU  44  -1.693  -5.072 -13.272
  327    HB2  GLU  44           HB2      GLU  44  -3.770  -4.293 -12.259
  328    HB3  GLU  44           HB3      GLU  44  -3.110  -2.655 -12.099
  329    HG2  GLU  44           HG2      GLU  44  -3.012  -2.337 -14.444
  330    HG3  GLU  44           HG3      GLU  44  -3.285  -4.067 -14.749
  331    H    SER  45           H        SER  45  -0.057  -4.585 -14.664
  332    HA   SER  45           HA       SER  45   1.901  -2.653 -13.966
  333    HB2  SER  45           HB2      SER  45   1.672  -4.013 -16.646
  334    HB3  SER  45           HB3      SER  45   3.112  -3.379 -15.854
  335    HG   SER  45           HG       SER  45   2.931  -5.672 -15.630
  336    H    ALA  46           H        ALA  46   2.735  -1.018 -15.366
  337    HA   ALA  46           HA       ALA  46   1.243   1.200 -15.200
  338    HB1  ALA  46           HB1      ALA  46   3.689   1.087 -15.594
  339    HB2  ALA  46           HB2      ALA  46   3.391   0.613 -17.279
  340    HB3  ALA  46           HB3      ALA  46   2.907   2.237 -16.710
  341    H    GLU  47           H        GLU  47   1.462  -0.790 -18.227
  342    HA   GLU  47           HA       GLU  47   0.012   1.208 -19.705
  343    HB2  GLU  47           HB2      GLU  47   0.644  -1.709 -20.380
  344    HB3  GLU  47           HB3      GLU  47  -0.102  -0.555 -21.474
  345    HG2  GLU  47           HG2      GLU  47   2.224  -0.714 -22.018
  346    HG3  GLU  47           HG3      GLU  47   1.876   0.886 -21.374
  347    H    GLN  48           H        GLN  48  -0.807  -1.911 -18.131
  348    HA   GLN  48           HA       GLN  48  -3.574  -1.991 -18.913
  349    HB2  GLN  48           HB2      GLN  48  -2.185  -3.242 -16.508
  350    HB3  GLN  48           HB3      GLN  48  -3.798  -3.609 -17.103
  351    HG2  GLN  48           HG2      GLN  48  -2.740  -5.304 -18.152
  352    HG3  GLN  48           HG3      GLN  48  -2.431  -4.097 -19.395
  353   HE21  GLN  48          HE22      GLN  48  -0.171  -3.424 -19.715
  354   HE22  GLN  48          HE21      GLN  48   1.133  -4.007 -18.726
  355    H    ALA  49           H        ALA  49  -1.863  -0.556 -16.113
  356    HA   ALA  49           HA       ALA  49  -4.192   0.536 -14.845
  357    HB1  ALA  49           HB1      ALA  49  -2.061   0.200 -13.682
  358    HB2  ALA  49           HB2      ALA  49  -1.275   1.409 -14.737
  359    HB3  ALA  49           HB3      ALA  49  -2.569   1.910 -13.629
  360    H    MET  50           H        MET  50  -2.017   1.795 -17.438
  361    HA   MET  50           HA       MET  50  -3.112   4.419 -17.484
  362    HB2  MET  50           HB2      MET  50  -1.005   3.847 -18.540
  363    HB3  MET  50           HB3      MET  50  -1.795   2.770 -19.676
  364    HG2  MET  50           HG2      MET  50  -2.349   5.723 -19.504
  365    HG3  MET  50           HG3      MET  50  -1.202   4.981 -20.594
  366    HE1  MET  50           HE1      MET  50  -2.251   2.582 -22.002
  367    HE2  MET  50           HE2      MET  50  -3.156   3.304 -23.354
  368    HE3  MET  50           HE3      MET  50  -1.607   4.014 -22.852
  369    H    TYR  51           H        TYR  51  -4.147   1.382 -19.166
  370    HA   TYR  51           HA       TYR  51  -6.454   2.659 -20.208
  371    HB2  TYR  51           HB2      TYR  51  -6.187  -0.259 -19.505
  372    HB3  TYR  51           HB3      TYR  51  -7.437   0.499 -20.481
  373    HD1  TYR  51           HD2      TYR  51  -6.903   1.406 -22.775
  374    HD2  TYR  51           HD1      TYR  51  -4.002  -0.606 -20.374
  375    HE1  TYR  51           HE2      TYR  51  -5.556   1.015 -24.783
  376    HE2  TYR  51           HE1      TYR  51  -2.503  -0.889 -22.316
  377    HH   TYR  51           HH       TYR  51  -3.585   0.029 -25.668
  378    H    ARG  52           H        ARG  52  -5.829   1.350 -16.952
  379    HA   ARG  52           HA       ARG  52  -8.581   1.308 -16.094
  380    HB2  ARG  52           HB2      ARG  52  -6.544   0.248 -14.911
  381    HB3  ARG  52           HB3      ARG  52  -6.152   1.871 -14.347
  382    HG2  ARG  52           HG2      ARG  52  -7.272   0.849 -12.561
  383    HG3  ARG  52           HG3      ARG  52  -8.393   2.017 -13.250
  384    HD2  ARG  52           HD2      ARG  52  -9.543  -0.044 -12.650
  385    HD3  ARG  52           HD3      ARG  52  -9.591   0.169 -14.410
  386    HE   ARG  52           HE       ARG  52  -7.315  -1.447 -13.636
  387   HH11  ARG  52          HH11      ARG  52 -10.874  -1.728 -13.658
  388   HH12  ARG  52          HH12      ARG  52 -10.857  -3.428 -13.961
  389   HH21  ARG  52          HH21      ARG  52  -7.300  -3.594 -14.243
  390   HH22  ARG  52          HH22      ARG  52  -8.760  -4.551 -14.220
  391    H    ALA  53           H        ALA  53  -6.017   3.869 -16.027
  392    HA   ALA  53           HA       ALA  53  -7.785   5.822 -14.849
  393    HB1  ALA  53           HB1      ALA  53  -5.978   7.410 -15.485
  394    HB2  ALA  53           HB2      ALA  53  -5.381   5.999 -14.587
  395    HB3  ALA  53           HB3      ALA  53  -5.148   6.089 -16.348
  396    H    LEU  54           H        LEU  54  -7.087   4.774 -18.149
  397    HA   LEU  54           HA       LEU  54  -8.187   6.974 -19.596
  398    HB2  LEU  54           HB2      LEU  54  -6.827   5.144 -20.552
  399    HB3  LEU  54           HB3      LEU  54  -8.095   4.007 -20.092
  400    HG   LEU  54           HG       LEU  54  -9.653   4.947 -21.717
  401   HD11  LEU  54          HD11      LEU  54  -8.837   7.235 -21.886
  402   HD12  LEU  54          HD12      LEU  54  -7.242   6.673 -22.408
  403   HD13  LEU  54          HD13      LEU  54  -8.655   6.468 -23.473
  404   HD21  LEU  54          HD21      LEU  54  -8.331   3.016 -22.114
  405   HD22  LEU  54          HD22      LEU  54  -8.596   3.920 -23.603
  406   HD23  LEU  54          HD23      LEU  54  -6.996   3.997 -22.779
  407    H    PHE  55           H        PHE  55  -9.527   3.957 -18.344
  408    HA   PHE  55           HA       PHE  55 -12.266   4.497 -18.885
  409    HB2  PHE  55           HB2      PHE  55 -11.822   2.284 -18.534
  410    HB3  PHE  55           HB3      PHE  55 -10.711   2.569 -17.219
  411    HD1  PHE  55           HD2      PHE  55 -14.369   2.622 -18.060
  412    HD2  PHE  55           HD1      PHE  55 -11.340   2.375 -15.018
  413    HE1  PHE  55           HE2      PHE  55 -16.121   2.071 -16.375
  414    HE2  PHE  55           HE1      PHE  55 -13.099   1.846 -13.308
  415    HZ   PHE  55           HZ       PHE  55 -15.485   1.693 -14.003
  416    H    GLU  56           H        GLU  56 -10.535   4.964 -15.673
  417    HA   GLU  56           HA       GLU  56 -12.866   6.149 -14.558
  418    HB2  GLU  56           HB2      GLU  56  -9.950   6.208 -13.657
  419    HB3  GLU  56           HB3      GLU  56 -11.287   6.848 -12.703
  420    HG2  GLU  56           HG2      GLU  56 -12.358   4.585 -12.727
  421    HG3  GLU  56           HG3      GLU  56 -10.910   3.951 -13.516
  422    H    GLU  57           H        GLU  57 -10.228   7.699 -16.342
  423    HA   GLU  57           HA       GLU  57 -11.150  10.337 -15.388
  424    HB2  GLU  57           HB2      GLU  57  -9.152  10.998 -15.049
  425    HB3  GLU  57           HB3      GLU  57  -8.743   9.302 -14.942
  426    HG2  GLU  57           HG2      GLU  57  -7.644   9.295 -17.059
  427    HG3  GLU  57           HG3      GLU  57  -8.317  10.859 -17.515
  428    H    VAL  58           H        VAL  58 -11.182   8.424 -18.194
  429    HA   VAL  58           HA       VAL  58 -11.963  10.825 -19.766
  430    HB   VAL  58           HB       VAL  58 -10.662   8.486 -21.125
  431   HG11  VAL  58          HG11      VAL  58 -11.780  10.334 -22.359
  432   HG12  VAL  58          HG12      VAL  58 -10.589  11.465 -21.716
  433   HG13  VAL  58          HG13      VAL  58 -10.092  10.123 -22.782
  434   HG21  VAL  58          HG21      VAL  58  -9.054  10.772 -19.894
  435   HG22  VAL  58          HG22      VAL  58  -8.951   9.067 -19.419
  436   HG23  VAL  58          HG23      VAL  58  -8.440   9.553 -21.029
  437    H    GLY  59           H        GLY  59 -12.831   7.623 -18.670
  438    HA2  GLY  59           HA2      GLY  59 -14.856   6.552 -18.929
  439    HA3  GLY  59           HA3      GLY  59 -15.356   7.806 -20.065
  440    H    LEU  60           H        LEU  60 -12.327   6.182 -20.752
  441    HA   LEU  60           HA       LEU  60 -13.655   4.965 -23.168
  442    HB2  LEU  60           HB2      LEU  60 -10.938   6.284 -22.896
  443    HB3  LEU  60           HB3      LEU  60 -11.551   5.478 -24.346
  444    HG   LEU  60           HG       LEU  60 -12.557   8.039 -23.036
  445   HD11  LEU  60          HD11      LEU  60 -11.431   7.545 -25.821
  446   HD12  LEU  60          HD12      LEU  60 -11.860   9.104 -25.115
  447   HD13  LEU  60          HD13      LEU  60 -10.501   8.200 -24.444
  448   HD21  LEU  60          HD21      LEU  60 -13.779   6.509 -25.357
  449   HD22  LEU  60          HD22      LEU  60 -14.572   7.007 -23.855
  450   HD23  LEU  60          HD23      LEU  60 -14.104   8.222 -25.047
  451    H    SER  61           H        SER  61 -12.703   3.046 -24.018
  452    HA   SER  61           HA       SER  61 -11.699   1.303 -21.839
  453    HB2  SER  61           HB2      SER  61 -12.866  -0.428 -23.371
  454    HB3  SER  61           HB3      SER  61 -13.852   0.729 -22.466
  455    HG   SER  61           HG       SER  61 -14.686   1.075 -24.388
  456    H    ARG  62           H        ARG  62 -10.615  -0.795 -22.998
  457    HA   ARG  62           HA       ARG  62  -8.085   0.179 -23.920
  458    HB2  ARG  62           HB2      ARG  62  -8.839  -2.768 -23.821
  459    HB3  ARG  62           HB3      ARG  62  -7.267  -1.999 -23.566
  460    HG2  ARG  62           HG2      ARG  62  -8.513  -0.931 -21.483
  461    HG3  ARG  62           HG3      ARG  62  -9.613  -2.287 -21.685
  462    HD2  ARG  62           HD2      ARG  62  -7.822  -3.892 -21.388
  463    HD3  ARG  62           HD3      ARG  62  -6.597  -2.597 -21.392
  464    HE   ARG  62           HE       ARG  62  -8.513  -2.056 -19.356
  465   HH11  ARG  62          HH11      ARG  62  -6.068  -4.554 -19.964
  466   HH12  ARG  62          HH12      ARG  62  -5.673  -4.765 -18.291
  467   HH21  ARG  62          HH21      ARG  62  -7.851  -2.198 -17.166
  468   HH22  ARG  62          HH22      ARG  62  -6.591  -3.274 -16.671
  469    H    LYS  63           H        LYS  63  -9.855   0.955 -25.804
  470    HA   LYS  63           HA       LYS  63  -9.005  -0.427 -28.254
  471    HB2  LYS  63           HB2      LYS  63 -11.271  -1.172 -28.865
  472    HB3  LYS  63           HB3      LYS  63 -10.715  -1.945 -27.377
  473    HG2  LYS  63           HG2      LYS  63 -12.118  -0.442 -26.010
  474    HG3  LYS  63           HG3      LYS  63 -12.659   0.426 -27.448
  475    HD2  LYS  63           HD2      LYS  63 -13.691  -1.620 -28.345
  476    HD3  LYS  63           HD3      LYS  63 -13.088  -2.555 -26.952
  477    HE2  LYS  63           HE2      LYS  63 -14.401  -1.138 -25.414
  478    HE3  LYS  63           HE3      LYS  63 -14.981  -0.162 -26.767
  479    HZ1  LYS  63           HZ1      LYS  63 -15.575  -3.049 -26.371
  480    HZ2  LYS  63           HZ2      LYS  63 -16.615  -1.822 -26.111
  481    HZ3  LYS  63           HZ3      LYS  63 -16.108  -2.146 -27.628
  482    H    ASP  64           H        ASP  64 -10.447   2.373 -26.673
  483    HA   ASP  64           HA       ASP  64 -11.481   3.326 -29.302
  484    HB2  ASP  64           HB2      ASP  64 -13.001   2.981 -27.278
  485    HB3  ASP  64           HB3      ASP  64 -12.215   4.396 -26.576
  486    H    VAL  65           H        VAL  65  -8.638   3.478 -28.297
  487    HA   VAL  65           HA       VAL  65  -8.079   6.258 -28.975
  488    HB   VAL  65           HB       VAL  65  -6.611   6.540 -26.975
  489   HG11  VAL  65          HG11      VAL  65  -8.973   7.521 -27.233
  490   HG12  VAL  65          HG12      VAL  65  -9.492   6.246 -26.116
  491   HG13  VAL  65          HG13      VAL  65  -8.283   7.446 -25.598
  492   HG21  VAL  65          HG21      VAL  65  -7.066   5.170 -24.947
  493   HG22  VAL  65          HG22      VAL  65  -8.134   4.127 -25.877
  494   HG23  VAL  65          HG23      VAL  65  -6.401   4.185 -26.253
  495    H    ARG  66           H        ARG  66  -5.508   6.478 -28.811
  496    HA   ARG  66           HA       ARG  66  -4.248   4.053 -30.036
  497    HB2  ARG  66           HB2      ARG  66  -5.288   5.330 -31.827
  498    HB3  ARG  66           HB3      ARG  66  -4.756   6.861 -31.140
  499    HG2  ARG  66           HG2      ARG  66  -3.481   6.408 -33.082
  500    HG3  ARG  66           HG3      ARG  66  -2.435   6.332 -31.675
  501    HD2  ARG  66           HD2      ARG  66  -3.656   3.762 -32.711
  502    HD3  ARG  66           HD3      ARG  66  -2.387   4.518 -33.681
  503    HE   ARG  66           HE       ARG  66  -1.187   4.502 -31.258
  504   HH11  ARG  66          HH11      ARG  66  -2.707   1.887 -33.154
  505   HH12  ARG  66          HH12      ARG  66  -1.581   0.690 -32.631
  506   HH21  ARG  66          HH21      ARG  66   0.286   2.970 -30.621
  507   HH22  ARG  66          HH22      ARG  66   0.170   1.312 -31.133
  508    H    ILE  67           H        ILE  67  -2.419   3.818 -28.617
  509    HA   ILE  67           HA       ILE  67  -1.223   6.143 -27.352
  510    HB   ILE  67           HB       ILE  67  -0.178   3.317 -27.761
  511   HG12  ILE  67          HG12      ILE  67  -1.356   4.398 -25.177
  512   HG13  ILE  67          HG13      ILE  67  -2.416   3.685 -26.387
  513   HG21  ILE  67          HG21      ILE  67   0.737   5.533 -25.868
  514   HG22  ILE  67          HG22      ILE  67   1.322   3.855 -25.818
  515   HG23  ILE  67          HG23      ILE  67   1.651   4.842 -27.232
  516   HD11  ILE  67          HD11      ILE  67  -1.117   1.592 -26.347
  517   HD12  ILE  67          HD12      ILE  67  -0.057   2.256 -25.079
  518   HD13  ILE  67          HD13      ILE  67  -1.776   1.997 -24.751
  519    H    LEU  68           H        LEU  68   0.287   7.489 -28.133
  520    HA   LEU  68           HA       LEU  68   1.694   6.696 -30.684
  521    HB2  LEU  68           HB2      LEU  68   0.786   9.328 -29.585
  522    HB3  LEU  68           HB3      LEU  68   2.346   9.322 -30.329
  523    HG   LEU  68           HG       LEU  68   0.482   9.980 -31.858
  524   HD11  LEU  68          HD11      LEU  68   2.108   7.549 -32.746
  525   HD12  LEU  68          HD12      LEU  68   1.345   8.755 -33.799
  526   HD13  LEU  68          HD13      LEU  68   2.671   9.234 -32.735
  527   HD21  LEU  68          HD21      LEU  68  -0.186   7.006 -31.940
  528   HD22  LEU  68          HD22      LEU  68  -1.143   8.225 -31.072
  529   HD23  LEU  68          HD23      LEU  68  -0.959   8.314 -32.842
  530    H    ALA  69           H        ALA  69   2.155   8.309 -27.529
  531    HA   ALA  69           HA       ALA  69   4.933   7.249 -27.367
  532    HB1  ALA  69           HB1      ALA  69   5.830   9.517 -27.002
  533    HB2  ALA  69           HB2      ALA  69   5.072   9.412 -28.591
  534    HB3  ALA  69           HB3      ALA  69   4.212  10.219 -27.260
  535    H    SER  70           H        SER  70   5.946   8.017 -25.202
  536    HA   SER  70           HA       SER  70   4.049   8.702 -23.094
  537    HB2  SER  70           HB2      SER  70   4.780   6.820 -21.650
  538    HB3  SER  70           HB3      SER  70   3.975   6.245 -23.117
  539    HG   SER  70           HG       SER  70   5.813   5.029 -23.020
  540    H    THR  71           H        THR  71   5.515   9.020 -20.934
  541    HA   THR  71           HA       THR  71   7.619  10.837 -21.572
  542    HB   THR  71           HB       THR  71   7.965  10.546 -18.943
  543    HG1  THR  71           HG1      THR  71   6.822   8.809 -18.421
  544   HG21  THR  71          HG21      THR  71   5.920  11.942 -18.585
  545   HG22  THR  71          HG22      THR  71   6.995  12.505 -19.883
  546   HG23  THR  71          HG23      THR  71   5.494  11.656 -20.298
  547    H    ARG  72           H        ARG  72   7.987   7.701 -22.186
  548    HA   ARG  72           HA       ARG  72   9.576   6.189 -22.350
  549    HB2  ARG  72           HB2      ARG  72  11.381   8.608 -22.137
  550    HB3  ARG  72           HB3      ARG  72  11.851   7.021 -22.760
  551    HG2  ARG  72           HG2      ARG  72  10.108   7.255 -24.544
  552    HG3  ARG  72           HG3      ARG  72   9.774   8.896 -23.987
  553    HD2  ARG  72           HD2      ARG  72  12.504   7.943 -24.923
  554    HD3  ARG  72           HD3      ARG  72  11.306   8.713 -25.975
  555    HE   ARG  72           HE       ARG  72  11.613  10.499 -23.838
  556   HH11  ARG  72          HH11      ARG  72  13.800   9.159 -26.331
  557   HH12  ARG  72          HH12      ARG  72  14.805  10.563 -26.358
  558   HH21  ARG  72          HH21      ARG  72  12.847  12.284 -23.893
  559   HH22  ARG  72          HH22      ARG  72  14.271  12.401 -24.910
  560    H    ASN  73           H        ASN  73   9.547   7.895 -19.356
  561    HA   ASN  73           HA       ASN  73  10.419   5.621 -17.873
  562    HB2  ASN  73           HB2      ASN  73  12.332   6.477 -16.822
  563    HB3  ASN  73           HB3      ASN  73  12.640   6.788 -18.519
  564   HD21  ASN  73          HD22      ASN  73  11.404   9.252 -19.095
  565   HD22  ASN  73          HD21      ASN  73  12.069  10.458 -18.031
  566    H    TRP  74           H        TRP  74  10.460   6.402 -15.421
  567    HA   TRP  74           HA       TRP  74   7.919   7.740 -14.973
  568    HB2  TRP  74           HB2      TRP  74   9.984   6.618 -13.030
  569    HB3  TRP  74           HB3      TRP  74   8.364   7.183 -12.621
  570    HD1  TRP  74           HD1      TRP  74  10.208   4.276 -14.258
  571    HE1  TRP  74           HE1      TRP  74   8.593   2.414 -14.882
  572    HE3  TRP  74           HE3      TRP  74   5.820   6.547 -12.951
  573    HZ2  TRP  74           HZ2      TRP  74   5.754   2.005 -14.978
  574    HZ3  TRP  74           HZ3      TRP  74   3.652   5.394 -13.325
  575    HH2  TRP  74           HH2      TRP  74   3.582   3.185 -14.432
  576    H    LEU  75           H        LEU  75   7.692   9.868 -14.632
  577    HA   LEU  75           HA       LEU  75  10.037  11.537 -13.874
  578    HB2  LEU  75           HB2      LEU  75   7.223  12.281 -14.779
  579    HB3  LEU  75           HB3      LEU  75   8.448  13.440 -14.260
  580    HG   LEU  75           HG       LEU  75   8.624  11.610 -16.694
  581   HD11  LEU  75          HD11      LEU  75   7.073  13.504 -16.880
  582   HD12  LEU  75          HD12      LEU  75   8.359  14.644 -16.443
  583   HD13  LEU  75          HD13      LEU  75   8.464  13.709 -17.960
  584   HD21  LEU  75          HD21      LEU  75  10.634  13.653 -15.636
  585   HD22  LEU  75          HD22      LEU  75  10.896  11.907 -15.859
  586   HD23  LEU  75          HD23      LEU  75  10.673  12.941 -17.269
  587    H    ARG  76           H        ARG  76   9.665  13.077 -12.097
  588    HA   ARG  76           HA       ARG  76   7.803  12.109  -9.976
  589    HB2  ARG  76           HB2      ARG  76  10.835  12.259  -9.871
  590    HB3  ARG  76           HB3      ARG  76   9.882  12.458  -8.401
  591    HG2  ARG  76           HG2      ARG  76   8.969  10.245  -8.549
  592    HG3  ARG  76           HG3      ARG  76   9.561  10.029 -10.198
  593    HD2  ARG  76           HD2      ARG  76  10.931   8.780  -8.637
  594    HD3  ARG  76           HD3      ARG  76  11.862  10.006  -9.481
  595    HE   ARG  76           HE       ARG  76  11.031   9.983  -6.605
  596   HH11  ARG  76          HH11      ARG  76  12.969  11.608  -9.132
  597   HH12  ARG  76          HH12      ARG  76  13.954  12.460  -8.004
  598   HH21  ARG  76          HH21      ARG  76  12.520  10.954  -5.126
  599   HH22  ARG  76          HH22      ARG  76  13.625  12.156  -5.695
  600    H    TYR  77           H        TYR  77   7.090  13.753  -8.673
  601    HA   TYR  77           HA       TYR  77   8.548  16.256  -8.465
  602    HB2  TYR  77           HB2      TYR  77   6.580  17.684  -8.851
  603    HB3  TYR  77           HB3      TYR  77   7.077  16.858 -10.311
  604    HD1  TYR  77           HD2      TYR  77   4.605  16.575  -7.484
  605    HD2  TYR  77           HD1      TYR  77   5.448  15.791 -11.642
  606    HE1  TYR  77           HE2      TYR  77   2.352  15.701  -7.759
  607    HE2  TYR  77           HE1      TYR  77   3.148  14.993 -11.967
  608    HH   TYR  77           HH       TYR  77   1.077  14.492 -10.931
  609    H    LYS  78           H        LYS  78   7.743  17.373  -6.491
  610    HA   LYS  78           HA       LYS  78   6.695  15.350  -4.558
  611    HB2  LYS  78           HB2      LYS  78   8.372  17.857  -4.152
  612    HB3  LYS  78           HB3      LYS  78   7.412  17.140  -2.856
  613    HG2  LYS  78           HG2      LYS  78   8.562  14.907  -3.405
  614    HG3  LYS  78           HG3      LYS  78   9.738  15.873  -4.323
  615    HD2  LYS  78           HD2      LYS  78   8.998  16.242  -1.385
  616    HD3  LYS  78           HD3      LYS  78  10.411  15.341  -1.968
  617    HE2  LYS  78           HE2      LYS  78  11.264  17.414  -3.078
  618    HE3  LYS  78           HE3      LYS  78   9.893  18.321  -2.418
  619    HZ1  LYS  78           HZ1      LYS  78  10.725  17.815  -0.183
  620    HZ2  LYS  78           HZ2      LYS  78  11.991  16.972  -0.798
  621    HZ3  LYS  78           HZ3      LYS  78  11.874  18.579  -1.055
  622    H    LEU  79           H        LEU  79   5.221  16.074  -3.042
  623    HA   LEU  79           HA       LEU  79   3.241  18.049  -4.074
  624    HB2  LEU  79           HB2      LEU  79   3.124  15.980  -1.846
  625    HB3  LEU  79           HB3      LEU  79   1.824  17.125  -2.175
  626    HG   LEU  79           HG       LEU  79   2.840  15.081  -4.200
  627   HD11  LEU  79          HD11      LEU  79   0.466  14.841  -2.306
  628   HD12  LEU  79          HD12      LEU  79   0.877  13.712  -3.618
  629   HD13  LEU  79          HD13      LEU  79   1.977  13.891  -2.250
  630   HD21  LEU  79          HD21      LEU  79   1.618  16.993  -5.198
  631   HD22  LEU  79          HD22      LEU  79   0.712  15.479  -5.344
  632   HD23  LEU  79          HD23      LEU  79   0.242  16.664  -4.110
  633    HA   PRO  80           HA       PRO  80   5.058  20.821  -0.945
  634    HB2  PRO  80           HB2      PRO  80   3.035  22.639  -0.633
  635    HB3  PRO  80           HB3      PRO  80   4.007  22.564  -2.137
  636    HG2  PRO  80           HG2      PRO  80   1.368  21.160  -1.571
  637    HG3  PRO  80           HG3      PRO  80   1.739  22.287  -2.953
  638    HD2  PRO  80           HD2      PRO  80   1.919  19.644  -3.309
  639    HD3  PRO  80           HD3      PRO  80   3.224  20.693  -3.933
  640    H    LYS  81           H        LYS  81   4.746  21.108   1.412
  641    HA   LYS  81           HA       LYS  81   3.724  18.781   2.459
  642    HB2  LYS  81           HB2      LYS  81   4.406  19.557   4.643
  643    HB3  LYS  81           HB3      LYS  81   5.547  20.062   3.423
  644    HG2  LYS  81           HG2      LYS  81   5.442  21.979   4.662
  645    HG3  LYS  81           HG3      LYS  81   4.241  22.345   3.447
  646    HD2  LYS  81           HD2      LYS  81   3.429  23.053   5.614
  647    HD3  LYS  81           HD3      LYS  81   2.430  21.726   5.060
  648    HE2  LYS  81           HE2      LYS  81   2.811  21.411   7.392
  649    HE3  LYS  81           HE3      LYS  81   3.703  20.150   6.554
  650    HZ1  LYS  81           HZ1      LYS  81   4.992  21.179   8.335
  651    HZ2  LYS  81           HZ2      LYS  81   5.746  21.458   6.917
  652    HZ3  LYS  81           HZ3      LYS  81   4.888  22.653   7.649
  653    H    ARG  82           H        ARG  82   1.905  21.669   2.054
  654    HA   ARG  82           HA       ARG  82  -0.253  20.934   3.819
  655    HB2  ARG  82           HB2      ARG  82  -1.390  22.860   2.934
  656    HB3  ARG  82           HB3      ARG  82   0.290  23.256   3.225
  657    HG2  ARG  82           HG2      ARG  82   0.496  22.605   0.578
  658    HG3  ARG  82           HG3      ARG  82  -1.220  22.983   0.627
  659    HD2  ARG  82           HD2      ARG  82  -0.044  24.977   0.006
  660    HD3  ARG  82           HD3      ARG  82  -0.615  25.207   1.671
  661    HE   ARG  82           HE       ARG  82   2.055  24.119   1.668
  662   HH11  ARG  82          HH11      ARG  82   0.339  27.160   0.989
  663   HH12  ARG  82          HH12      ARG  82   1.679  28.175   1.389
  664   HH21  ARG  82          HH21      ARG  82   3.852  25.482   2.210
  665   HH22  ARG  82          HH22      ARG  82   3.711  27.196   2.085
  666    H    LEU  83           H        LEU  83   0.576  20.068   0.520
  667    HA   LEU  83           HA       LEU  83  -2.154  19.033   0.019
  668    HB2  LEU  83           HB2      LEU  83  -0.962  20.490  -1.678
  669    HB3  LEU  83           HB3      LEU  83   0.205  19.173  -1.875
  670    HG   LEU  83           HG       LEU  83  -1.611  17.684  -2.691
  671   HD11  LEU  83          HD11      LEU  83  -3.371  20.170  -2.403
  672   HD12  LEU  83          HD12      LEU  83  -3.818  18.710  -3.313
  673   HD13  LEU  83          HD13      LEU  83  -3.592  18.617  -1.569
  674   HD21  LEU  83          HD21      LEU  83  -1.450  20.372  -4.120
  675   HD22  LEU  83          HD22      LEU  83  -0.279  19.047  -4.253
  676   HD23  LEU  83          HD23      LEU  83  -1.934  18.823  -4.851
  677    H    VAL  84           H        VAL  84   1.134  17.989   0.745
  678    HA   VAL  84           HA       VAL  84   1.009  15.251   0.202
  679    HB   VAL  84           HB       VAL  84   2.173  16.701   2.618
  680   HG11  VAL  84          HG11      VAL  84   2.627  13.791   1.796
  681   HG12  VAL  84          HG12      VAL  84   3.555  14.679   3.027
  682   HG13  VAL  84          HG13      VAL  84   1.852  14.354   3.297
  683   HG21  VAL  84          HG21      VAL  84   4.308  16.444   1.527
  684   HG22  VAL  84          HG22      VAL  84   3.617  15.418   0.264
  685   HG23  VAL  84          HG23      VAL  84   3.208  17.141   0.337
  686    H    ARG  85           H        ARG  85  -0.001  13.554   1.100
  687    HA   ARG  85           HA       ARG  85  -2.622  14.192   2.124
  688    HB2  ARG  85           HB2      ARG  85  -1.546  11.357   1.941
  689    HB3  ARG  85           HB3      ARG  85  -3.200  11.909   1.787
  690    HG2  ARG  85           HG2      ARG  85  -0.946  12.125  -0.249
  691    HG3  ARG  85           HG3      ARG  85  -2.440  11.221  -0.373
  692    HD2  ARG  85           HD2      ARG  85  -2.152  14.245  -0.421
  693    HD3  ARG  85           HD3      ARG  85  -2.511  13.202  -1.792
  694    HE   ARG  85           HE       ARG  85  -4.575  12.508  -0.520
  695   HH11  ARG  85          HH22      ARG  85  -3.233  15.822  -0.218
  696   HH12  ARG  85          HH21      ARG  85  -4.764  16.519   0.203
  697   HH21  ARG  85          HH11      ARG  85  -6.576  13.475   0.038
  698   HH22  ARG  85          HH12      ARG  85  -6.697  15.170   0.322
  699    H    TRP  86           H        TRP  86   0.133  12.567   3.558
  700    HA   TRP  86           HA       TRP  86   0.694  11.704   5.537
  701    HB2  TRP  86           HB2      TRP  86  -1.199  13.671   6.812
  702    HB3  TRP  86           HB3      TRP  86   0.202  12.899   7.542
  703    HD1  TRP  86           HD1      TRP  86  -0.774  15.638   5.123
  704    HE1  TRP  86           HE1      TRP  86   1.159  17.271   4.737
  705    HE3  TRP  86           HE3      TRP  86   2.879  13.072   7.608
  706    HZ2  TRP  86           HZ2      TRP  86   3.999  17.369   5.346
  707    HZ3  TRP  86           HZ3      TRP  86   5.200  13.952   7.671
  708    HH2  TRP  86           HH2      TRP  86   5.771  16.082   6.538
  709    H    ASP  87           H        ASP  87  -2.223  11.109   4.287
  710    HA   ASP  87           HA       ASP  87  -3.210   9.322   6.457
  711    HB2  ASP  87           HB2      ASP  87  -4.826  10.797   5.333
  712    HB3  ASP  87           HB3      ASP  87  -4.396  10.094   3.769
  713    H    THR  88           H        THR  88  -1.190   9.287   3.695
  714    HA   THR  88           HA       THR  88  -1.545   6.471   2.990
  715    HB   THR  88           HB       THR  88   0.460   7.172   1.486
  716    HG1  THR  88           HG1      THR  88  -0.292   9.738   1.297
  717   HG21  THR  88          HG21      THR  88  -1.831   6.840   0.614
  718   HG22  THR  88          HG22      THR  88  -2.255   8.506   1.068
  719   HG23  THR  88          HG23      THR  88  -1.034   8.190  -0.195
  720    H    LYS  89           H        LYS  89   0.040   4.946   3.583
  721    HA   LYS  89           HA       LYS  89   2.296   5.844   5.283
  722    HB2  LYS  89           HB2      LYS  89   0.231   3.793   6.119
  723    HB3  LYS  89           HB3      LYS  89   1.839   3.962   6.851
  724    HG2  LYS  89           HG2      LYS  89   1.337   6.349   7.399
  725    HG3  LYS  89           HG3      LYS  89  -0.306   6.143   6.744
  726    HD2  LYS  89           HD2      LYS  89  -0.788   4.420   8.384
  727    HD3  LYS  89           HD3      LYS  89   0.867   4.565   9.045
  728    HE2  LYS  89           HE2      LYS  89   0.412   6.941   9.624
  729    HE3  LYS  89           HE3      LYS  89  -1.228   6.786   8.977
  730    HZ1  LYS  89           HZ1      LYS  89  -0.170   5.270  11.304
  731    HZ2  LYS  89           HZ2      LYS  89  -1.201   6.533  11.380
  732    HZ3  LYS  89           HZ3      LYS  89  -1.688   5.135  10.698
  733    HA   PRO  90           HA       PRO  90   4.568   5.561   4.945
  734    HB2  PRO  90           HB2      PRO  90   5.630   5.503   2.123
  735    HB3  PRO  90           HB3      PRO  90   6.527   5.654   3.665
  736    HG2  PRO  90           HG2      PRO  90   6.434   3.279   2.359
  737    HG3  PRO  90           HG3      PRO  90   6.223   3.323   4.142
  738    HD2  PRO  90           HD2      PRO  90   4.083   3.140   2.007
  739    HD3  PRO  90           HD3      PRO  90   4.240   2.210   3.526
  740    H    VAL  91           H        VAL  91   4.632   7.857   4.620
  741    HA   VAL  91           HA       VAL  91   2.350   9.090   3.460
  742    HB   VAL  91           HB       VAL  91   4.949  10.224   4.604
  743   HG11  VAL  91          HG11      VAL  91   2.331  11.604   3.882
  744   HG12  VAL  91          HG12      VAL  91   3.658  12.350   4.804
  745   HG13  VAL  91          HG13      VAL  91   3.915  11.865   3.128
  746   HG21  VAL  91          HG21      VAL  91   3.569  10.749   6.602
  747   HG22  VAL  91          HG22      VAL  91   2.194   9.880   5.876
  748   HG23  VAL  91          HG23      VAL  91   3.673   9.007   6.324
  749    H    CYS  92           H        CYS  92   2.136   9.535   1.484
  750    HA   CYS  92           HA       CYS  92   4.214   8.966  -0.473
  751    HB2  CYS  92           HB2      CYS  92   1.295   9.579  -0.323
  752    HB3  CYS  92           HB3      CYS  92   2.117   9.635  -1.918
  753    HG   CYS  92           HG       CYS  92   2.270   7.199   0.345
  754    H    ILE  93           H        ILE  93   5.724  10.571  -0.781
  755    HA   ILE  93           HA       ILE  93   4.964  13.356  -0.155
  756    HB   ILE  93           HB       ILE  93   7.302  13.833  -0.110
  757   HG12  ILE  93          HG12      ILE  93   7.655  11.114  -1.403
  758   HG13  ILE  93          HG13      ILE  93   8.286  12.676  -1.894
  759   HG21  ILE  93          HG21      ILE  93   6.122  12.746   1.835
  760   HG22  ILE  93          HG22      ILE  93   6.857  11.201   1.336
  761   HG23  ILE  93          HG23      ILE  93   7.875  12.566   1.830
  762   HD11  ILE  93          HD11      ILE  93  10.088  11.338  -1.029
  763   HD12  ILE  93          HD12      ILE  93   9.777  12.632   0.146
  764   HD13  ILE  93          HD13      ILE  93   9.189  10.969   0.456
  765    H    GLY  94           H        GLY  94   4.841  11.551  -2.984
  766    HA2  GLY  94           HA2      GLY  94   4.582  13.845  -4.701
  767    HA3  GLY  94           HA3      GLY  94   6.118  13.001  -4.933
  768    H    GLN  95           H        GLN  95   4.243  13.065  -6.994
  769    HA   GLN  95           HA       GLN  95   3.003  10.339  -6.973
  770    HB2  GLN  95           HB2      GLN  95   2.718  12.485  -9.100
  771    HB3  GLN  95           HB3      GLN  95   1.859  10.969  -9.014
  772    HG2  GLN  95           HG2      GLN  95   1.440  13.461  -7.354
  773    HG3  GLN  95           HG3      GLN  95   0.350  12.724  -8.544
  774   HE21  GLN  95          HE22      GLN  95  -0.916  13.368  -6.266
  775   HE22  GLN  95          HE21      GLN  95  -1.154  11.970  -5.250
  776    H    LYS  96           H        LYS  96   4.223   8.757  -7.950
  777    HA   LYS  96           HA       LYS  96   6.575   9.483  -9.678
  778    HB2  LYS  96           HB2      LYS  96   7.161   7.702  -8.215
  779    HB3  LYS  96           HB3      LYS  96   5.558   6.967  -8.285
  780    HG2  LYS  96           HG2      LYS  96   6.029   6.221 -10.632
  781    HG3  LYS  96           HG3      LYS  96   7.661   6.911 -10.491
  782    HD2  LYS  96           HD2      LYS  96   8.157   5.350  -8.667
  783    HD3  LYS  96           HD3      LYS  96   6.494   4.725  -8.704
  784    HE2  LYS  96           HE2      LYS  96   6.862   3.952 -11.082
  785    HE3  LYS  96           HE3      LYS  96   8.529   4.537 -10.974
  786    HZ1  LYS  96           HZ1      LYS  96   7.336   2.277  -9.483
  787    HZ2  LYS  96           HZ2      LYS  96   8.636   2.259 -10.467
  788    HZ3  LYS  96           HZ3      LYS  96   8.729   2.962  -8.976
  789    H    GLN  97           H        GLN  97   5.833   9.952 -11.807
  790    HA   GLN  97           HA       GLN  97   3.428   8.432 -12.687
  791    HB2  GLN  97           HB2      GLN  97   3.083  10.838 -13.996
  792    HB3  GLN  97           HB3      GLN  97   2.149  10.164 -12.698
  793    HG2  GLN  97           HG2      GLN  97   2.591  12.405 -12.129
  794    HG3  GLN  97           HG3      GLN  97   3.511  11.402 -11.035
  795   HE21  GLN  97          HE22      GLN  97   5.427  12.439 -10.565
  796   HE22  GLN  97          HE21      GLN  97   6.385  13.325 -11.754
  797    H    LYS  98           H        LYS  98   3.217   7.723 -14.653
  798    HA   LYS  98           HA       LYS  98   5.321   8.379 -16.685
  799    HB2  LYS  98           HB2      LYS  98   5.486   6.019 -15.977
  800    HB3  LYS  98           HB3      LYS  98   3.752   5.781 -16.264
  801    HG2  LYS  98           HG2      LYS  98   4.127   6.222 -18.699
  802    HG3  LYS  98           HG3      LYS  98   5.857   6.448 -18.373
  803    HD2  LYS  98           HD2      LYS  98   5.939   4.111 -17.439
  804    HD3  LYS  98           HD3      LYS  98   4.233   3.906 -17.881
  805    HE2  LYS  98           HE2      LYS  98   4.806   4.279 -20.276
  806    HE3  LYS  98           HE3      LYS  98   6.494   4.575 -19.828
  807    HZ1  LYS  98           HZ1      LYS  98   6.566   2.231 -19.004
  808    HZ2  LYS  98           HZ2      LYS  98   5.066   1.948 -19.635
  809    HZ3  LYS  98           HZ3      LYS  98   6.299   2.346 -20.607
  810    H    TRP  99           H        TRP  99   4.384   9.457 -18.397
  811    HA   TRP  99           HA       TRP  99   1.393   9.657 -18.369
  812    HB2  TRP  99           HB2      TRP  99   3.499  11.562 -19.397
  813    HB3  TRP  99           HB3      TRP  99   1.775  11.752 -19.621
  814    HD1  TRP  99           HD1      TRP  99   4.348  11.643 -16.739
  815    HE1  TRP  99           HE1      TRP  99   3.611  13.226 -14.908
  816    HE3  TRP  99           HE3      TRP  99  -0.247  12.886 -18.590
  817    HZ2  TRP  99           HZ2      TRP  99   1.273  14.889 -14.306
  818    HZ3  TRP  99           HZ3      TRP  99  -1.676  14.512 -17.411
  819    HH2  TRP  99           HH2      TRP  99  -0.977  15.455 -15.223
  820    H    PHE 100           H        PHE 100   0.343   9.288 -20.301
  821    HA   PHE 100           HA       PHE 100   1.994   8.193 -22.543
  822    HB2  PHE 100           HB2      PHE 100  -0.696   7.250 -21.496
  823    HB3  PHE 100           HB3      PHE 100  -0.020   6.799 -23.052
  824    HD1  PHE 100           HD1      PHE 100   0.705   6.653 -19.341
  825    HD2  PHE 100           HD2      PHE 100   1.456   4.952 -23.242
  826    HE1  PHE 100           HE1      PHE 100   1.742   4.670 -18.283
  827    HE2  PHE 100           HE2      PHE 100   2.506   2.984 -22.171
  828    HZ   PHE 100           HZ       PHE 100   2.596   2.814 -19.686
  829    H    LEU 101           H        LEU 101   1.608   9.081 -24.452
  830    HA   LEU 101           HA       LEU 101  -0.334  11.295 -24.653
  831    HB2  LEU 101           HB2      LEU 101   1.957  11.773 -25.401
  832    HB3  LEU 101           HB3      LEU 101   1.910  10.376 -26.484
  833    HG   LEU 101           HG       LEU 101  -0.053  11.439 -27.676
  834   HD11  LEU 101          HD11      LEU 101  -0.333  13.925 -27.328
  835   HD12  LEU 101          HD12      LEU 101  -0.940  12.941 -26.000
  836   HD13  LEU 101          HD13      LEU 101   0.630  13.778 -25.845
  837   HD21  LEU 101          HD21      LEU 101   2.338  11.641 -28.446
  838   HD22  LEU 101          HD22      LEU 101   1.284  12.953 -28.977
  839   HD23  LEU 101          HD23      LEU 101   2.403  13.224 -27.626
  840    H    LEU 102           H        LEU 102  -2.242  10.616 -25.141
  841    HA   LEU 102           HA       LEU 102  -2.594   8.302 -26.968
  842    HB2  LEU 102           HB2      LEU 102  -4.347   9.629 -24.862
  843    HB3  LEU 102           HB3      LEU 102  -5.046   8.623 -26.145
  844    HG   LEU 102           HG       LEU 102  -3.106   7.736 -23.982
  845   HD11  LEU 102          HD11      LEU 102  -5.955   6.988 -24.715
  846   HD12  LEU 102          HD12      LEU 102  -5.003   6.272 -23.378
  847   HD13  LEU 102          HD13      LEU 102  -5.478   7.985 -23.352
  848   HD21  LEU 102          HD21      LEU 102  -3.694   5.422 -25.152
  849   HD22  LEU 102          HD22      LEU 102  -3.916   6.466 -26.600
  850   HD23  LEU 102          HD23      LEU 102  -2.373   6.461 -25.710
  851    H    GLN 103           H        GLN 103  -3.523   8.556 -28.860
  852    HA   GLN 103           HA       GLN 103  -4.404  11.312 -29.623
  853    HB2  GLN 103           HB2      GLN 103  -3.451   8.870 -31.106
  854    HB3  GLN 103           HB3      GLN 103  -4.614   9.911 -31.910
  855    HG2  GLN 103           HG2      GLN 103  -2.089  10.364 -32.305
  856    HG3  GLN 103           HG3      GLN 103  -3.183  11.720 -32.045
  857   HE21  GLN 103          HE22      GLN 103  -1.951  13.313 -31.021
  858   HE22  GLN 103          HE21      GLN 103  -0.902  12.965 -29.657
  859    H    LEU 104           H        LEU 104  -6.525  11.773 -29.562
  860    HA   LEU 104           HA       LEU 104  -8.365   9.792 -28.577
  861    HB2  LEU 104           HB2      LEU 104  -8.412  12.258 -28.080
  862    HB3  LEU 104           HB3      LEU 104  -8.896  12.557 -29.745
  863    HG   LEU 104           HG       LEU 104 -11.006  11.367 -29.405
  864   HD11  LEU 104          HD11      LEU 104 -10.421   9.661 -27.718
  865   HD12  LEU 104          HD12      LEU 104 -10.093  10.944 -26.522
  866   HD13  LEU 104          HD13      LEU 104 -11.738  10.667 -27.146
  867   HD21  LEU 104          HD21      LEU 104 -10.941  13.730 -28.946
  868   HD22  LEU 104          HD22      LEU 104 -11.950  12.985 -27.683
  869   HD23  LEU 104          HD23      LEU 104 -10.291  13.473 -27.308
  870    H    VAL 105           H        VAL 105  -9.184   8.192 -29.856
  871    HA   VAL 105           HA       VAL 105  -9.233   8.487 -32.783
  872    HB   VAL 105           HB       VAL 105  -9.888   6.191 -30.906
  873   HG11  VAL 105          HG11      VAL 105  -9.924   4.701 -32.841
  874   HG12  VAL 105          HG12      VAL 105 -11.241   5.873 -32.909
  875   HG13  VAL 105          HG13      VAL 105  -9.806   6.101 -33.939
  876   HG21  VAL 105          HG21      VAL 105  -7.448   6.790 -31.080
  877   HG22  VAL 105          HG22      VAL 105  -7.817   5.197 -31.747
  878   HG23  VAL 105          HG23      VAL 105  -7.561   6.576 -32.836
  879    H    SER 106           H        SER 106 -11.540   8.285 -30.000
  880    HA   SER 106           HA       SER 106 -13.797   8.762 -31.825
  881    HB2  SER 106           HB2      SER 106 -15.131   8.471 -29.776
  882    HB3  SER 106           HB3      SER 106 -14.117   7.094 -30.200
  883    HG   SER 106           HG       SER 106 -13.679   7.267 -28.189
  884    H    GLY 107           H        GLY 107 -14.244  10.278 -28.807
  885    HA2  GLY 107           HA2      GLY 107 -13.506  12.953 -29.255
  886    HA3  GLY 107           HA3      GLY 107 -15.003  12.679 -30.148
  887    H    ASP 108           H        ASP 108 -15.199  14.491 -28.216
  888    HA   ASP 108           HA       ASP 108 -15.750  13.789 -25.577
  889    HB2  ASP 108           HB2      ASP 108 -15.628  16.079 -26.335
  890    HB3  ASP 108           HB3      ASP 108 -17.046  15.859 -27.364
  891    H    ALA 109           H        ALA 109 -17.801  13.355 -28.455
  892    HA   ALA 109           HA       ALA 109 -20.260  12.906 -27.105
  893    HB1  ALA 109           HB1      ALA 109 -19.322  11.909 -29.830
  894    HB2  ALA 109           HB2      ALA 109 -21.003  11.998 -29.268
  895    HB3  ALA 109           HB3      ALA 109 -20.079  13.491 -29.499
  896    H    GLU 110           H        GLU 110 -17.497  10.751 -27.496
  897    HA   GLU 110           HA       GLU 110 -19.151   8.432 -26.689
  898    HB2  GLU 110           HB2      GLU 110 -16.514   8.518 -28.169
  899    HB3  GLU 110           HB3      GLU 110 -17.303   7.042 -27.586
  900    HG2  GLU 110           HG2      GLU 110 -19.345   7.662 -28.948
  901    HG3  GLU 110           HG3      GLU 110 -18.423   8.993 -29.646
  902    H    ILE 111           H        ILE 111 -16.590  10.579 -25.785
  903    HA   ILE 111           HA       ILE 111 -15.436   9.151 -23.594
  904    HB   ILE 111           HB       ILE 111 -15.645  11.903 -24.665
  905   HG12  ILE 111          HG12      ILE 111 -13.412  10.162 -23.727
  906   HG13  ILE 111          HG13      ILE 111 -13.887  10.533 -25.382
  907   HG21  ILE 111          HG21      ILE 111 -14.719  13.084 -22.781
  908   HG22  ILE 111          HG22      ILE 111 -16.239  12.374 -22.296
  909   HG23  ILE 111          HG23      ILE 111 -14.709  11.606 -21.795
  910   HD11  ILE 111          HD11      ILE 111 -13.230  12.925 -24.992
  911   HD12  ILE 111          HD12      ILE 111 -12.582  12.446 -23.397
  912   HD13  ILE 111          HD13      ILE 111 -11.883  11.775 -24.871
  913    H    ASN 112           H        ASN 112 -16.044   9.065 -21.440
  914    HA   ASN 112           HA       ASN 112 -18.583  10.270 -20.573
  915    HB2  ASN 112           HB2      ASN 112 -19.415   8.174 -21.525
  916    HB3  ASN 112           HB3      ASN 112 -18.192   7.263 -20.619
  917   HD21  ASN 112          HD22      ASN 112 -19.898   6.041 -19.461
  918   HD22  ASN 112          HD21      ASN 112 -20.778   6.821 -18.167
  919    H    MET 113           H        MET 113 -16.942  11.375 -19.351
  920    HA   MET 113           HA       MET 113 -15.134  10.010 -17.626
  921    HB2  MET 113           HB2      MET 113 -16.075  12.890 -17.331
  922    HB3  MET 113           HB3      MET 113 -14.567  12.179 -16.740
  923    HG2  MET 113           HG2      MET 113 -13.883  11.756 -19.105
  924    HG3  MET 113           HG3      MET 113 -15.343  12.603 -19.638
  925    HE1  MET 113           HE1      MET 113 -12.853  15.443 -20.556
  926    HE2  MET 113           HE2      MET 113 -12.848  13.703 -20.944
  927    HE3  MET 113           HE3      MET 113 -14.367  14.636 -21.008
  928    H    GLN 114           H        GLN 114 -18.161   9.359 -17.152
  929    HA   GLN 114           HA       GLN 114 -18.103   9.763 -14.213
  930    HB2  GLN 114           HB2      GLN 114 -20.589   9.799 -15.975
  931    HB3  GLN 114           HB3      GLN 114 -20.568   9.864 -14.210
  932    HG2  GLN 114           HG2      GLN 114 -19.281  12.015 -14.318
  933    HG3  GLN 114           HG3      GLN 114 -19.394  11.977 -16.078
  934   HE21  GLN 114          HE22      GLN 114 -21.390  12.067 -13.071
  935   HE22  GLN 114          HE21      GLN 114 -22.766  12.856 -13.810
  936    H    THR 115           H        THR 115 -17.049   7.671 -15.963
  937    HA   THR 115           HA       THR 115 -18.506   5.256 -15.771
  938    HB   THR 115           HB       THR 115 -15.871   4.551 -15.855
  939    HG1  THR 115           HG1      THR 115 -14.633   6.214 -16.661
  940   HG21  THR 115          HG21      THR 115 -17.355   5.912 -18.146
  941   HG22  THR 115          HG22      THR 115 -16.003   4.758 -18.301
  942   HG23  THR 115          HG23      THR 115 -17.554   4.212 -17.658
  943    H    SER 116           H        SER 116 -16.146   6.840 -13.585
  944    HA   SER 116           HA       SER 116 -15.837   4.606 -11.909
  945    HB2  SER 116           HB2      SER 116 -15.101   7.238 -10.809
  946    HB3  SER 116           HB3      SER 116 -14.087   5.814 -11.132
  947    HG   SER 116           HG       SER 116 -13.583   7.676 -12.476
  948    H    SER 117           H        SER 117 -18.530   6.528 -11.986
  949    HA   SER 117           HA       SER 117 -20.259   7.043 -10.711
  950    HB2  SER 117           HB2      SER 117 -19.201   5.189  -8.559
  951    HB3  SER 117           HB3      SER 117 -20.851   5.800  -8.748
  952    HG   SER 117           HG       SER 117 -20.605   3.667  -9.609
  953    H    THR 118           H        THR 118 -17.213   7.186  -8.842
  954    HA   THR 118           HA       THR 118 -17.878   9.998  -8.127
  955    HB   THR 118           HB       THR 118 -16.375   9.564  -6.106
  956    HG1  THR 118           HG1      THR 118 -15.561   7.523  -6.584
  957   HG21  THR 118          HG21      THR 118 -19.064   8.130  -6.206
  958   HG22  THR 118          HG22      THR 118 -18.230   8.711  -4.750
  959   HG23  THR 118          HG23      THR 118 -18.827   9.870  -5.947
  960    HA   PRO 119           HA       PRO 119 -14.243   9.410 -10.977
  961    HB2  PRO 119           HB2      PRO 119 -14.938  11.055 -12.987
  962    HB3  PRO 119           HB3      PRO 119 -15.837   9.536 -12.728
  963    HG2  PRO 119           HG2      PRO 119 -16.576  12.304 -11.671
  964    HG3  PRO 119           HG3      PRO 119 -17.585  11.240 -12.693
  965    HD2  PRO 119           HD2      PRO 119 -17.812  11.187 -10.000
  966    HD3  PRO 119           HD3      PRO 119 -17.884   9.676 -10.949
  967    H    GLU 120           H        GLU 120 -12.993  11.487 -12.196
  968    HA   GLU 120           HA       GLU 120 -12.766  13.652 -10.132
  969    HB2  GLU 120           HB2      GLU 120 -10.711  12.668 -12.139
  970    HB3  GLU 120           HB3      GLU 120 -10.568  14.136 -11.168
  971    HG2  GLU 120           HG2      GLU 120 -11.157  12.452  -9.160
  972    HG3  GLU 120           HG3      GLU 120 -10.447  11.272 -10.260
  973    H    PHE 121           H        PHE 121 -14.085  13.102 -13.320
  974    HA   PHE 121           HA       PHE 121 -13.766  16.023 -13.814
  975    HB2  PHE 121           HB2      PHE 121 -13.097  13.775 -15.706
  976    HB3  PHE 121           HB3      PHE 121 -13.311  15.454 -16.190
  977    HD1  PHE 121           HD1      PHE 121 -11.936  17.253 -14.904
  978    HD2  PHE 121           HD2      PHE 121 -10.911  13.065 -14.981
  979    HE1  PHE 121           HE1      PHE 121  -9.609  17.821 -14.306
  980    HE2  PHE 121           HE2      PHE 121  -8.592  13.639 -14.304
  981    HZ   PHE 121           HZ       PHE 121  -7.933  16.009 -13.991
  982    H    ASP 122           H        ASP 122 -15.098  17.080 -14.969
  983    HA   ASP 122           HA       ASP 122 -17.654  15.904 -15.916
  984    HB2  ASP 122           HB2      ASP 122 -18.182  17.301 -14.030
  985    HB3  ASP 122           HB3      ASP 122 -17.015  18.530 -14.516
  986    H    GLY 123           H        GLY 123 -17.321  15.745 -18.044
  987    HA2  GLY 123           HA2      GLY 123 -15.085  16.631 -19.400
  988    HA3  GLY 123           HA3      GLY 123 -16.554  16.048 -20.184
  989    H    TRP 124           H        TRP 124 -14.677  18.092 -21.107
  990    HA   TRP 124           HA       TRP 124 -16.484  20.392 -21.394
  991    HB2  TRP 124           HB2      TRP 124 -15.043  20.786 -19.388
  992    HB3  TRP 124           HB3      TRP 124 -13.628  20.721 -20.423
  993    HD1  TRP 124           HD1      TRP 124 -17.013  22.635 -20.408
  994    HE1  TRP 124           HE1      TRP 124 -16.644  25.069 -21.056
  995    HE3  TRP 124           HE3      TRP 124 -11.923  22.528 -21.096
  996    HZ2  TRP 124           HZ2      TRP 124 -14.426  26.774 -21.814
  997    HZ3  TRP 124           HZ3      TRP 124 -10.723  24.580 -21.751
  998    HH2  TRP 124           HH2      TRP 124 -11.953  26.709 -22.122
  999    H    ARG 125           H        ARG 125 -13.353  21.203 -22.337
 1000    HA   ARG 125           HA       ARG 125 -13.727  20.378 -25.155
 1001    HB2  ARG 125           HB2      ARG 125 -15.026  22.285 -25.194
 1002    HB3  ARG 125           HB3      ARG 125 -14.136  23.111 -23.938
 1003    HG2  ARG 125           HG2      ARG 125 -12.837  22.726 -26.637
 1004    HG3  ARG 125           HG3      ARG 125 -14.064  23.964 -26.404
 1005    HD2  ARG 125           HD2      ARG 125 -12.810  25.043 -24.623
 1006    HD3  ARG 125           HD3      ARG 125 -11.614  23.761 -24.605
 1007    HE   ARG 125           HE       ARG 125 -10.688  24.437 -26.601
 1008   HH11  ARG 125          HH11      ARG 125 -13.372  26.629 -25.736
 1009   HH12  ARG 125          HH12      ARG 125 -12.920  27.853 -26.867
 1010   HH21  ARG 125          HH21      ARG 125 -10.099  26.079 -28.105
 1011   HH22  ARG 125          HH22      ARG 125 -11.017  27.536 -28.231
 1012    H    TRP 126           H        TRP 126 -11.759  20.591 -26.432
 1013    HA   TRP 126           HA       TRP 126  -9.449  20.133 -24.742
 1014    HB2  TRP 126           HB2      TRP 126  -9.507  20.132 -27.762
 1015    HB3  TRP 126           HB3      TRP 126  -8.460  19.211 -26.681
 1016    HD1  TRP 126           HD1      TRP 126 -11.395  18.779 -28.780
 1017    HE1  TRP 126           HE1      TRP 126 -12.989  16.932 -28.042
 1018    HE3  TRP 126           HE3      TRP 126  -9.467  17.880 -24.134
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.413  15.279 -25.698
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.588  16.267 -22.607
 1021    HH2  TRP 126           HH2      TRP 126 -12.563  14.989 -23.366
 1022    H    VAL 127           H        VAL 127  -7.457  21.248 -24.788
 1023    HA   VAL 127           HA       VAL 127  -7.727  24.125 -25.563
 1024    HB   VAL 127           HB       VAL 127  -6.373  24.566 -23.530
 1025   HG11  VAL 127          HG11      VAL 127  -8.840  24.721 -23.472
 1026   HG12  VAL 127          HG12      VAL 127  -8.933  23.024 -22.943
 1027   HG13  VAL 127          HG13      VAL 127  -8.157  24.238 -21.908
 1028   HG21  VAL 127          HG21      VAL 127  -6.831  21.623 -22.863
 1029   HG22  VAL 127          HG22      VAL 127  -5.283  22.331 -23.333
 1030   HG23  VAL 127          HG23      VAL 127  -6.068  22.832 -21.820
 1031    H    SER 128           H        SER 128  -5.594  25.289 -25.870
 1032    HA   SER 128           HA       SER 128  -4.009  24.139 -27.835
 1033    HB2  SER 128           HB2      SER 128  -3.069  26.246 -25.852
 1034    HB3  SER 128           HB3      SER 128  -2.505  25.995 -27.506
 1035    HG   SER 128           HG       SER 128  -4.064  27.709 -27.394
 1036    H    TYR 129           H        TYR 129  -1.758  23.456 -27.853
 1037    HA   TYR 129           HA       TYR 129  -1.087  21.626 -25.743
 1038    HB2  TYR 129           HB2      TYR 129  -0.429  21.676 -28.292
 1039    HB3  TYR 129           HB3      TYR 129   0.910  22.691 -27.734
 1040    HD1  TYR 129           HD1      TYR 129  -0.882  19.459 -27.133
 1041    HD2  TYR 129           HD2      TYR 129   2.867  21.560 -26.884
 1042    HE1  TYR 129           HE1      TYR 129   0.222  17.391 -26.296
 1043    HE2  TYR 129           HE2      TYR 129   3.969  19.497 -26.082
 1044    HH   TYR 129           HH       TYR 129   2.157  16.449 -25.512
 1045    H    TRP 130           H        TRP 130   0.739  21.897 -24.270
 1046    HA   TRP 130           HA       TRP 130   1.641  22.883 -22.492
 1047    HB2  TRP 130           HB2      TRP 130   1.785  25.585 -23.784
 1048    HB3  TRP 130           HB3      TRP 130   2.863  24.845 -22.617
 1049    HD1  TRP 130           HD1      TRP 130   2.304  25.336 -26.250
 1050    HE1  TRP 130           HE1      TRP 130   3.950  24.090 -27.683
 1051    HE3  TRP 130           HE3      TRP 130   4.445  22.483 -22.591
 1052    HZ2  TRP 130           HZ2      TRP 130   6.213  22.217 -27.239
 1053    HZ3  TRP 130           HZ3      TRP 130   6.331  20.947 -23.128
 1054    HH2  TRP 130           HH2      TRP 130   7.222  20.825 -25.426
 1055    H    TYR 131           H        TYR 131  -1.426  24.197 -23.597
 1056    HA   TYR 131           HA       TYR 131  -1.728  26.167 -21.624
 1057    HB2  TYR 131           HB2      TYR 131  -3.158  25.891 -23.601
 1058    HB3  TYR 131           HB3      TYR 131  -3.931  24.500 -22.873
 1059    HD1  TYR 131           HD1      TYR 131  -5.349  24.775 -20.791
 1060    HD2  TYR 131           HD2      TYR 131  -3.763  28.137 -22.994
 1061    HE1  TYR 131           HE1      TYR 131  -7.061  26.234 -19.783
 1062    HE2  TYR 131           HE2      TYR 131  -5.447  29.614 -21.955
 1063    HH   TYR 131           HH       TYR 131  -7.314  29.750 -20.529
 1064    HA   PRO 132           HA       PRO 132  -3.467  22.801 -18.576
 1065    HB2  PRO 132           HB2      PRO 132  -1.757  20.488 -19.495
 1066    HB3  PRO 132           HB3      PRO 132  -3.327  20.444 -18.691
 1067    HG2  PRO 132           HG2      PRO 132  -3.206  20.046 -21.351
 1068    HG3  PRO 132           HG3      PRO 132  -4.483  21.111 -20.673
 1069    HD2  PRO 132           HD2      PRO 132  -1.870  21.927 -21.982
 1070    HD3  PRO 132           HD3      PRO 132  -3.491  22.590 -22.198
 1071    H    VAL 133           H        VAL 133  -0.081  22.832 -19.848
 1072    HA   VAL 133           HA       VAL 133   1.178  22.527 -17.259
 1073    HB   VAL 133           HB       VAL 133   2.297  23.838 -19.781
 1074   HG11  VAL 133          HG11      VAL 133   4.495  23.172 -18.778
 1075   HG12  VAL 133          HG12      VAL 133   3.657  24.462 -17.925
 1076   HG13  VAL 133          HG13      VAL 133   3.640  22.804 -17.273
 1077   HG21  VAL 133          HG21      VAL 133   2.427  20.938 -18.884
 1078   HG22  VAL 133          HG22      VAL 133   1.661  21.606 -20.335
 1079   HG23  VAL 133          HG23      VAL 133   3.408  21.646 -20.192
 1080    H    ARG 134           H        ARG 134   0.338  25.380 -19.352
 1081    HA   ARG 134           HA       ARG 134   1.428  27.140 -17.351
 1082    HB2  ARG 134           HB2      ARG 134  -0.563  27.853 -19.557
 1083    HB3  ARG 134           HB3      ARG 134   0.471  28.967 -18.671
 1084    HG2  ARG 134           HG2      ARG 134   1.267  26.978 -20.803
 1085    HG3  ARG 134           HG3      ARG 134   1.458  28.715 -20.793
 1086    HD2  ARG 134           HD2      ARG 134   3.025  26.679 -19.154
 1087    HD3  ARG 134           HD3      ARG 134   3.631  27.636 -20.491
 1088    HE   ARG 134           HE       ARG 134   3.336  28.432 -17.713
 1089   HH11  ARG 134          HH11      ARG 134   3.630  29.705 -21.024
 1090   HH12  ARG 134          HH12      ARG 134   4.136  31.277 -20.523
 1091   HH21  ARG 134          HH21      ARG 134   3.970  30.568 -17.052
 1092   HH22  ARG 134          HH22      ARG 134   4.360  31.759 -18.235
 1093    H    GLN 135           H        GLN 135  -1.721  25.607 -17.628
 1094    HA   GLN 135           HA       GLN 135  -2.930  27.474 -15.719
 1095    HB2  GLN 135           HB2      GLN 135  -3.746  24.826 -16.946
 1096    HB3  GLN 135           HB3      GLN 135  -4.639  25.510 -15.595
 1097    HG2  GLN 135           HG2      GLN 135  -4.171  27.026 -18.190
 1098    HG3  GLN 135           HG3      GLN 135  -5.585  26.035 -17.842
 1099   HE21  GLN 135          HE22      GLN 135  -6.484  28.409 -18.397
 1100   HE22  GLN 135          HE21      GLN 135  -6.781  29.393 -16.990
 1101    H    VAL 136           H        VAL 136  -0.742  24.767 -15.331
 1102    HA   VAL 136           HA       VAL 136  -1.945  23.928 -12.856
 1103    HB   VAL 136           HB       VAL 136  -0.621  22.638 -14.754
 1104   HG11  VAL 136          HG11      VAL 136   1.551  23.749 -14.240
 1105   HG12  VAL 136          HG12      VAL 136   1.543  22.915 -12.669
 1106   HG13  VAL 136          HG13      VAL 136   1.596  21.969 -14.165
 1107   HG21  VAL 136          HG21      VAL 136  -0.422  20.718 -13.351
 1108   HG22  VAL 136          HG22      VAL 136  -0.514  21.708 -11.879
 1109   HG23  VAL 136          HG23      VAL 136  -1.916  21.587 -12.981
 1110    H    VAL 137           H        VAL 137  -0.801  23.659 -10.852
 1111    HA   VAL 137           HA       VAL 137   0.197  26.037  -9.706
 1112    HB   VAL 137           HB       VAL 137   0.829  24.355  -7.821
 1113   HG11  VAL 137          HG11      VAL 137  -2.065  24.603  -8.785
 1114   HG12  VAL 137          HG12      VAL 137  -1.544  24.197  -7.133
 1115   HG13  VAL 137          HG13      VAL 137  -1.183  25.792  -7.799
 1116   HG21  VAL 137          HG21      VAL 137  -0.886  22.447  -9.497
 1117   HG22  VAL 137          HG22      VAL 137   0.865  22.273  -9.182
 1118   HG23  VAL 137          HG23      VAL 137  -0.307  22.194  -7.859
 1119    H    SER 138           H        SER 138   2.229  26.665  -8.943
 1120    HA   SER 138           HA       SER 138   4.241  26.403 -10.816
 1121    HB2  SER 138           HB2      SER 138   4.459  27.374  -7.948
 1122    HB3  SER 138           HB3      SER 138   5.483  27.861  -9.312
 1123    HG   SER 138           HG       SER 138   3.603  29.278  -8.733
 1124    H    PHE 139           H        PHE 139   3.954  24.443  -7.794
 1125    HA   PHE 139           HA       PHE 139   6.670  23.510  -7.968
 1126    HB2  PHE 139           HB2      PHE 139   6.065  21.877  -6.334
 1127    HB3  PHE 139           HB3      PHE 139   5.348  23.412  -5.899
 1128    HD1  PHE 139           HD2      PHE 139   4.675  19.985  -7.166
 1129    HD2  PHE 139           HD1      PHE 139   2.912  23.664  -5.754
 1130    HE1  PHE 139           HE2      PHE 139   2.490  18.857  -6.950
 1131    HE2  PHE 139           HE1      PHE 139   0.723  22.528  -5.551
 1132    HZ   PHE 139           HZ       PHE 139   0.490  20.137  -6.179
 1133    H    LYS 140           H        LYS 140   3.672  22.510  -9.552
 1134    HA   LYS 140           HA       LYS 140   4.927  20.038 -10.601
 1135    HB2  LYS 140           HB2      LYS 140   2.606  20.216  -9.593
 1136    HB3  LYS 140           HB3      LYS 140   2.093  21.059 -11.060
 1137    HG2  LYS 140           HG2      LYS 140   2.782  19.086 -12.422
 1138    HG3  LYS 140           HG3      LYS 140   3.353  18.273 -10.965
 1139    HD2  LYS 140           HD2      LYS 140   0.464  18.996 -11.646
 1140    HD3  LYS 140           HD3      LYS 140   1.198  17.389 -11.630
 1141    HE2  LYS 140           HE2      LYS 140   1.726  17.882  -9.102
 1142    HE3  LYS 140           HE3      LYS 140   0.573  19.213  -9.253
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.024  16.317  -9.675
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.563  17.255  -8.443
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.109  17.529  -9.960
 1146    H    ARG 141           H        ARG 141   3.849  23.207 -11.759
 1147    HA   ARG 141           HA       ARG 141   3.636  22.898 -14.467
 1148    HB2  ARG 141           HB2      ARG 141   3.322  24.954 -13.063
 1149    HB3  ARG 141           HB3      ARG 141   5.063  25.228 -13.086
 1150    HG2  ARG 141           HG2      ARG 141   5.050  25.732 -15.416
 1151    HG3  ARG 141           HG3      ARG 141   3.516  24.899 -15.666
 1152    HD2  ARG 141           HD2      ARG 141   3.139  27.279 -15.802
 1153    HD3  ARG 141           HD3      ARG 141   2.304  26.630 -14.404
 1154    HE   ARG 141           HE       ARG 141   4.909  28.126 -14.379
 1155   HH11  ARG 141          HH21      ARG 141   1.848  27.325 -12.641
 1156   HH12  ARG 141          HH22      ARG 141   2.283  28.324 -11.286
 1157   HH21  ARG 141          HH11      ARG 141   5.338  29.470 -12.584
 1158   HH22  ARG 141          HH12      ARG 141   4.251  29.494 -11.233
 1159    H    ASP 142           H        ASP 142   6.833  23.244 -12.845
 1160    HA   ASP 142           HA       ASP 142   8.334  23.363 -15.258
 1161    HB2  ASP 142           HB2      ASP 142   9.313  23.946 -13.108
 1162    HB3  ASP 142           HB3      ASP 142   9.113  22.294 -12.514
 1163    H    VAL 143           H        VAL 143   7.336  20.519 -13.273
 1164    HA   VAL 143           HA       VAL 143   8.699  18.681 -15.064
 1165    HB   VAL 143           HB       VAL 143   6.770  18.254 -12.745
 1166   HG11  VAL 143          HG11      VAL 143   6.478  16.324 -14.202
 1167   HG12  VAL 143          HG12      VAL 143   8.236  16.182 -14.440
 1168   HG13  VAL 143          HG13      VAL 143   7.515  15.841 -12.852
 1169   HG21  VAL 143          HG21      VAL 143   8.981  19.118 -12.090
 1170   HG22  VAL 143          HG22      VAL 143   8.845  17.423 -11.617
 1171   HG23  VAL 143          HG23      VAL 143   9.786  17.864 -13.051
 1172    H    TYR 144           H        TYR 144   5.353  19.967 -14.797
 1173    HA   TYR 144           HA       TYR 144   4.357  18.104 -16.693
 1174    HB2  TYR 144           HB2      TYR 144   3.089  19.582 -15.031
 1175    HB3  TYR 144           HB3      TYR 144   3.227  20.875 -16.199
 1176    HD1  TYR 144           HD2      TYR 144   2.701  17.550 -17.760
 1177    HD2  TYR 144           HD1      TYR 144   0.690  20.845 -15.818
 1178    HE1  TYR 144           HE2      TYR 144   0.582  16.693 -18.528
 1179    HE2  TYR 144           HE1      TYR 144  -1.450  20.042 -16.686
 1180    HH   TYR 144           HH       TYR 144  -1.749  17.116 -18.773
 1181    H    ARG 145           H        ARG 145   6.101  21.197 -17.108
 1182    HA   ARG 145           HA       ARG 145   5.861  21.410 -19.933
 1183    HB2  ARG 145           HB2      ARG 145   7.238  22.730 -17.849
 1184    HB3  ARG 145           HB3      ARG 145   8.550  22.039 -18.776
 1185    HG2  ARG 145           HG2      ARG 145   6.349  23.871 -19.786
 1186    HG3  ARG 145           HG3      ARG 145   7.992  24.356 -19.411
 1187    HD2  ARG 145           HD2      ARG 145   7.240  22.391 -21.620
 1188    HD3  ARG 145           HD3      ARG 145   7.497  24.129 -21.853
 1189    HE   ARG 145           HE       ARG 145   9.786  23.064 -20.560
 1190   HH11  ARG 145          HH11      ARG 145   8.199  23.040 -23.760
 1191   HH12  ARG 145          HH12      ARG 145   9.670  22.807 -24.630
 1192   HH21  ARG 145          HH21      ARG 145  11.738  22.722 -21.744
 1193   HH22  ARG 145          HH22      ARG 145  11.711  22.617 -23.463
 1194    H    ARG 146           H        ARG 146   8.049  19.424 -17.904
 1195    HA   ARG 146           HA       ARG 146   9.608  18.380 -20.087
 1196    HB2  ARG 146           HB2      ARG 146   9.160  17.127 -17.333
 1197    HB3  ARG 146           HB3      ARG 146  10.382  16.649 -18.506
 1198    HG2  ARG 146           HG2      ARG 146  11.507  18.810 -18.343
 1199    HG3  ARG 146           HG3      ARG 146  10.219  19.451 -17.325
 1200    HD2  ARG 146           HD2      ARG 146  10.783  17.575 -15.652
 1201    HD3  ARG 146           HD3      ARG 146  12.262  17.336 -16.585
 1202    HE   ARG 146           HE       ARG 146  11.409  19.774 -15.058
 1203   HH11  ARG 146          HH11      ARG 146  14.129  18.136 -16.722
 1204   HH12  ARG 146          HH12      ARG 146  15.290  19.269 -16.131
 1205   HH21  ARG 146          HH22      ARG 146  12.831  21.166 -14.350
 1206   HH22  ARG 146          HH21      ARG 146  14.547  21.080 -14.711
 1207    H    VAL 147           H        VAL 147   6.712  17.074 -18.358
 1208    HA   VAL 147           HA       VAL 147   6.366  14.678 -19.763
 1209    HB   VAL 147           HB       VAL 147   4.321  16.720 -18.827
 1210   HG11  VAL 147          HG11      VAL 147   3.148  15.314 -20.412
 1211   HG12  VAL 147          HG12      VAL 147   3.833  13.853 -19.671
 1212   HG13  VAL 147          HG13      VAL 147   2.663  14.859 -18.781
 1213   HG21  VAL 147          HG21      VAL 147   5.795  15.653 -17.040
 1214   HG22  VAL 147          HG22      VAL 147   4.060  15.384 -16.849
 1215   HG23  VAL 147          HG23      VAL 147   5.082  14.105 -17.516
 1216    H    MET 148           H        MET 148   5.086  17.946 -20.720
 1217    HA   MET 148           HA       MET 148   4.071  16.864 -23.165
 1218    HB2  MET 148           HB2      MET 148   4.470  19.707 -22.195
 1219    HB3  MET 148           HB3      MET 148   3.869  19.317 -23.810
 1220    HG2  MET 148           HG2      MET 148   2.130  17.807 -22.660
 1221    HG3  MET 148           HG3      MET 148   2.617  18.595 -21.151
 1222    HE1  MET 148           HE1      MET 148  -0.419  20.691 -21.164
 1223    HE2  MET 148           HE2      MET 148  -0.569  18.984 -21.677
 1224    HE3  MET 148           HE3      MET 148   0.581  19.464 -20.398
 1225    H    LYS 149           H        LYS 149   7.153  18.593 -22.434
 1226    HA   LYS 149           HA       LYS 149   8.166  18.810 -25.044
 1227    HB2  LYS 149           HB2      LYS 149   9.318  19.848 -23.280
 1228    HB3  LYS 149           HB3      LYS 149   9.437  18.385 -22.326
 1229    HG2  LYS 149           HG2      LYS 149  10.893  18.497 -24.975
 1230    HG3  LYS 149           HG3      LYS 149  11.524  19.387 -23.584
 1231    HD2  LYS 149           HD2      LYS 149  11.547  17.298 -22.218
 1232    HD3  LYS 149           HD3      LYS 149  11.044  16.360 -23.631
 1233    HE2  LYS 149           HE2      LYS 149  13.039  17.040 -24.864
 1234    HE3  LYS 149           HE3      LYS 149  13.570  18.061 -23.521
 1235    HZ1  LYS 149           HZ1      LYS 149  14.621  15.814 -23.592
 1236    HZ2  LYS 149           HZ2      LYS 149  13.873  16.118 -22.169
 1237    HZ3  LYS 149           HZ3      LYS 149  13.158  15.119 -23.253
 1238    H    GLU 150           H        GLU 150   8.050  15.916 -22.959
 1239    HA   GLU 150           HA       GLU 150   9.865  14.399 -24.519
 1240    HB2  GLU 150           HB2      GLU 150   7.711  13.648 -22.527
 1241    HB3  GLU 150           HB3      GLU 150   8.612  12.409 -23.380
 1242    HG2  GLU 150           HG2      GLU 150   9.959  14.610 -21.757
 1243    HG3  GLU 150           HG3      GLU 150   9.565  13.010 -21.125
 1244    H    PHE 151           H        PHE 151   6.544  15.226 -25.278
 1245    HA   PHE 151           HA       PHE 151   6.941  13.744 -27.778
 1246    HB2  PHE 151           HB2      PHE 151   4.602  12.714 -27.551
 1247    HB3  PHE 151           HB3      PHE 151   5.963  12.000 -26.735
 1248    HD1  PHE 151           HD2      PHE 151   3.630  14.805 -25.752
 1249    HD2  PHE 151           HD1      PHE 151   5.335  10.984 -24.757
 1250    HE1  PHE 151           HE2      PHE 151   2.431  14.837 -23.573
 1251    HE2  PHE 151           HE1      PHE 151   4.121  11.016 -22.581
 1252    HZ   PHE 151           HZ       PHE 151   2.694  12.928 -21.987
 1253    H    ALA 152           H        ALA 152   6.644  16.622 -26.835
 1254    HA   ALA 152           HA       ALA 152   4.291  17.740 -27.761
 1255    HB1  ALA 152           HB1      ALA 152   7.124  18.907 -28.014
 1256    HB2  ALA 152           HB2      ALA 152   5.603  19.823 -28.042
 1257    HB3  ALA 152           HB3      ALA 152   6.109  18.975 -26.563
 1258    H    SER 153           H        SER 153   7.292  17.130 -29.670
 1259    HA   SER 153           HA       SER 153   6.303  18.093 -32.128
 1260    HB2  SER 153           HB2      SER 153   8.146  16.486 -33.009
 1261    HB3  SER 153           HB3      SER 153   8.596  17.855 -31.979
 1262    HG   SER 153           HG       SER 153   9.606  15.880 -31.300
 1263    H    VAL 154           H        VAL 154   5.384  15.207 -30.394
 1264    HA   VAL 154           HA       VAL 154   4.794  13.648 -32.811
 1265    HB   VAL 154           HB       VAL 154   4.034  13.043 -29.926
 1266   HG11  VAL 154          HG11      VAL 154   4.057  10.698 -30.735
 1267   HG12  VAL 154          HG12      VAL 154   2.814  11.676 -31.534
 1268   HG13  VAL 154          HG13      VAL 154   4.322  11.276 -32.392
 1269   HG21  VAL 154          HG21      VAL 154   6.058  11.599 -29.866
 1270   HG22  VAL 154          HG22      VAL 154   6.539  12.204 -31.466
 1271   HG23  VAL 154          HG23      VAL 154   6.510  13.291 -30.067
 1272    H    VAL 155           H        VAL 155   3.139  15.809 -30.496
 1273    HA   VAL 155           HA       VAL 155   0.509  15.443 -31.734
 1274    HB   VAL 155           HB       VAL 155   1.660  17.568 -29.858
 1275   HG11  VAL 155          HG11      VAL 155  -0.142  18.614 -31.105
 1276   HG12  VAL 155          HG12      VAL 155  -1.167  17.175 -30.915
 1277   HG13  VAL 155          HG13      VAL 155  -0.759  18.192 -29.507
 1278   HG21  VAL 155          HG21      VAL 155  -0.115  15.122 -29.468
 1279   HG22  VAL 155          HG22      VAL 155   1.473  15.456 -28.720
 1280   HG23  VAL 155          HG23      VAL 155   0.051  16.392 -28.256
 1281    H    MET 156           H        MET 156   3.164  17.887 -31.884
 1282    HA   MET 156           HA       MET 156   1.746  19.507 -33.731
 1283    HB2  MET 156           HB2      MET 156   4.765  19.241 -33.399
 1284    HB3  MET 156           HB3      MET 156   3.936  20.548 -34.247
 1285    HG2  MET 156           HG2      MET 156   3.688  19.911 -31.284
 1286    HG3  MET 156           HG3      MET 156   4.591  21.246 -31.994
 1287    HE1  MET 156           HE1      MET 156   3.403  22.805 -30.228
 1288    HE2  MET 156           HE2      MET 156   1.640  22.967 -30.064
 1289    HE3  MET 156           HE3      MET 156   2.439  21.438 -29.614
 1290    H    SER 157           H        SER 157   3.804  16.681 -34.384
 1291    HA   SER 157           HA       SER 157   4.215  16.823 -37.117
 1292    HB2  SER 157           HB2      SER 157   3.206  14.490 -35.428
 1293    HB3  SER 157           HB3      SER 157   3.780  14.313 -37.087
 1294    HG   SER 157           HG       SER 157   5.337  15.300 -34.891
 1295    H    LEU 158           H        LEU 158   1.133  16.284 -35.449
 1296    HA   LEU 158           HA       LEU 158  -0.210  15.237 -37.802
 1297    HB2  LEU 158           HB2      LEU 158  -1.380  16.344 -35.228
 1298    HB3  LEU 158           HB3      LEU 158  -2.204  15.321 -36.404
 1299    HG   LEU 158           HG       LEU 158   0.171  14.469 -34.684
 1300   HD11  LEU 158          HD11      LEU 158  -1.884  14.817 -33.368
 1301   HD12  LEU 158          HD12      LEU 158  -2.771  13.725 -34.459
 1302   HD13  LEU 158          HD13      LEU 158  -1.432  13.099 -33.463
 1303   HD21  LEU 158          HD21      LEU 158  -1.573  12.825 -36.570
 1304   HD22  LEU 158          HD22      LEU 158   0.153  13.205 -36.788
 1305   HD23  LEU 158          HD23      LEU 158  -0.358  12.175 -35.453
 1306    H    GLN 159           H        GLN 159   0.285  18.447 -36.392
 1307    HA   GLN 159           HA       GLN 159  -1.718  19.609 -38.275
 1308    HB2  GLN 159           HB2      GLN 159  -0.810  20.637 -35.562
 1309    HB3  GLN 159           HB3      GLN 159  -2.064  21.349 -36.590
 1310    HG2  GLN 159           HG2      GLN 159  -2.122  18.703 -35.122
 1311    HG3  GLN 159           HG3      GLN 159  -3.162  20.098 -34.908
 1312   HE21  GLN 159          HE22      GLN 159  -3.589  17.053 -35.853
 1313   HE22  GLN 159          HE21      GLN 159  -4.483  17.211 -37.337
 1314    H    GLU 160           H        GLU 160   1.594  19.471 -37.725
 1315    HA   GLU 160           HA       GLU 160   2.076  21.803 -39.543
 1316    HB2  GLU 160           HB2      GLU 160   3.956  20.248 -37.751
 1317    HB3  GLU 160           HB3      GLU 160   4.407  21.608 -38.798
 1318    HG2  GLU 160           HG2      GLU 160   2.708  23.010 -37.471
 1319    HG3  GLU 160           HG3      GLU 160   2.717  21.710 -36.274
 1320    H    ASN 161           H        ASN 161   0.970  19.226 -40.174
 1321    HA   ASN 161           HA       ASN 161   2.964  17.336 -41.069
 1322    HB2  ASN 161           HB2      ASN 161   0.432  16.958 -40.418
 1323    HB3  ASN 161           HB3      ASN 161   0.107  17.333 -42.113
 1324   HD21  ASN 161          HD22      ASN 161   2.033  15.312 -39.925
 1325   HD22  ASN 161          HD21      ASN 161   2.194  13.914 -40.991
 1326    H    THR 162           H        THR 162   1.193  19.887 -42.507
 1327    HA   THR 162           HA       THR 162   2.851  20.183 -44.814
 1328    HB   THR 162           HB       THR 162   0.686  20.773 -46.126
 1329    HG1  THR 162           HG1      THR 162  -1.206  19.793 -45.450
 1330   HG21  THR 162          HG21      THR 162   0.323  18.510 -46.950
 1331   HG22  THR 162          HG22      THR 162   2.047  18.754 -46.646
 1332   HG23  THR 162          HG23      THR 162   1.071  17.812 -45.498
 1333    HA   PRO 163           HA       PRO 163   2.213  24.177 -42.911
 1334    HB2  PRO 163           HB2      PRO 163   2.554  26.035 -44.840
 1335    HB3  PRO 163           HB3      PRO 163   3.841  24.883 -44.368
 1336    HG2  PRO 163           HG2      PRO 163   1.915  24.612 -46.706
 1337    HG3  PRO 163           HG3      PRO 163   3.705  24.497 -46.733
 1338    HD2  PRO 163           HD2      PRO 163   2.102  22.296 -46.542
 1339    HD3  PRO 163           HD3      PRO 163   3.683  22.384 -45.705
 1340    H    LYS 164           H        LYS 164  -0.125  23.030 -42.752
 1341    HA   LYS 164           HA       LYS 164  -2.254  24.396 -44.205
 1342    HB2  LYS 164           HB2      LYS 164  -3.771  23.252 -42.685
 1343    HB3  LYS 164           HB3      LYS 164  -2.652  22.134 -43.466
 1344    HG2  LYS 164           HG2      LYS 164  -1.295  21.986 -41.430
 1345    HG3  LYS 164           HG3      LYS 164  -2.312  23.181 -40.615
 1346    HD2  LYS 164           HD2      LYS 164  -3.297  20.475 -41.622
 1347    HD3  LYS 164           HD3      LYS 164  -2.761  20.808 -39.971
 1348    HE2  LYS 164           HE2      LYS 164  -4.515  22.602 -39.787
 1349    HE3  LYS 164           HE3      LYS 164  -5.123  22.133 -41.380
 1350    HZ1  LYS 164           HZ1      LYS 164  -5.603  19.923 -40.475
 1351    HZ2  LYS 164           HZ2      LYS 164  -5.038  20.360 -38.987
 1352    HZ3  LYS 164           HZ3      LYS 164  -6.374  21.073 -39.608
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1  -1.558   1.876  -1.650
    2    H2   MET   1           H2       MET   1  -1.993   2.282  -3.173
    3    H3   MET   1           H3       MET   1  -2.120   0.724  -2.670
    4    HA   MET   1           HA       MET   1   0.282   0.548  -2.433
    5    HB2  MET   1           HB2      MET   1  -0.832  -0.104  -4.599
    6    HB3  MET   1           HB3      MET   1  -0.511   1.514  -5.229
    7    HG2  MET   1           HG2      MET   1   1.944   1.102  -4.943
    8    HG3  MET   1           HG3      MET   1   1.577  -0.527  -4.353
    9    HE1  MET   1           HE1      MET   1   3.173  -1.666  -6.125
   10    HE2  MET   1           HE2      MET   1   3.160  -1.254  -7.856
   11    HE3  MET   1           HE3      MET   1   3.640  -0.029  -6.654
   12    H    ILE   2           H        ILE   2   2.040   1.743  -1.721
   13    HA   ILE   2           HA       ILE   2   2.575   4.357  -2.975
   14    HB   ILE   2           HB       ILE   2   3.229   3.809  -0.091
   15   HG12  ILE   2          HG12      ILE   2   0.766   3.862  -0.121
   16   HG13  ILE   2          HG13      ILE   2   1.483   5.186   0.766
   17   HG21  ILE   2          HG21      ILE   2   3.529   6.285   0.017
   18   HG22  ILE   2          HG22      ILE   2   4.582   5.539  -1.191
   19   HG23  ILE   2          HG23      ILE   2   3.132   6.398  -1.710
   20   HD11  ILE   2          HD11      ILE   2   0.957   6.775  -0.992
   21   HD12  ILE   2          HD12      ILE   2   0.421   5.480  -2.073
   22   HD13  ILE   2          HD13      ILE   2  -0.499   5.845  -0.603
   23    H    ASP   3           H        ASP   3   4.825   4.574  -3.296
   24    HA   ASP   3           HA       ASP   3   6.415   2.155  -3.534
   25    HB2  ASP   3           HB2      ASP   3   7.213   3.402  -5.180
   26    HB3  ASP   3           HB3      ASP   3   6.407   4.839  -4.635
   27    H    ASP   4           H        ASP   4   8.627   2.129  -2.548
   28    HA   ASP   4           HA       ASP   4   8.222   1.966   0.264
   29    HB2  ASP   4           HB2      ASP   4   9.595   0.387  -1.030
   30    HB3  ASP   4           HB3      ASP   4  10.747   1.675  -1.406
   31    H    ASP   5           H        ASP   5   9.517   4.610  -1.661
   32    HA   ASP   5           HA       ASP   5  11.033   5.716   0.595
   33    HB2  ASP   5           HB2      ASP   5  12.038   5.853  -1.642
   34    HB3  ASP   5           HB3      ASP   5  10.659   6.803  -2.202
   35    H    GLY   6           H        GLY   6   8.092   6.184  -1.287
   36    HA2  GLY   6           HA2      GLY   6   6.213   6.809   0.318
   37    HA3  GLY   6           HA3      GLY   6   7.128   8.296   0.596
   38    H    TYR   7           H        TYR   7   7.215   6.973  -2.687
   39    HA   TYR   7           HA       TYR   7   5.604   9.264  -3.615
   40    HB2  TYR   7           HB2      TYR   7   7.340   7.176  -4.963
   41    HB3  TYR   7           HB3      TYR   7   6.195   8.159  -5.865
   42    HD1  TYR   7           HD2      TYR   7   9.234   8.343  -3.710
   43    HD2  TYR   7           HD1      TYR   7   6.543  10.473  -6.312
   44    HE1  TYR   7           HE2      TYR   7  10.758  10.284  -3.681
   45    HE2  TYR   7           HE1      TYR   7   8.026  12.435  -6.258
   46    HH   TYR   7           HH       TYR   7  11.145  12.475  -4.445
   47    H    ARG   8           H        ARG   8   3.586   9.033  -4.661
   48    HA   ARG   8           HA       ARG   8   2.293   6.347  -4.320
   49    HB2  ARG   8           HB2      ARG   8   1.243   8.493  -3.637
   50    HB3  ARG   8           HB3      ARG   8   1.057   8.933  -5.318
   51    HG2  ARG   8           HG2      ARG   8  -0.067   6.329  -4.194
   52    HG3  ARG   8           HG3      ARG   8  -0.862   7.873  -3.872
   53    HD2  ARG   8           HD2      ARG   8  -1.083   8.245  -6.319
   54    HD3  ARG   8           HD3      ARG   8  -0.484   6.599  -6.610
   55    HE   ARG   8           HE       ARG   8  -2.418   5.931  -5.012
   56   HH11  ARG   8          HH12      ARG   8  -2.696   8.382  -7.596
   57   HH12  ARG   8          HH11      ARG   8  -4.385   8.612  -7.389
   58   HH21  ARG   8          HH22      ARG   8  -4.706   6.133  -4.832
   59   HH22  ARG   8          HH21      ARG   8  -5.572   7.181  -5.885
   60    HA   PRO   9           HA       PRO   9   3.612   5.927  -8.647
   61    HB2  PRO   9           HB2      PRO   9   2.356   3.209  -8.534
   62    HB3  PRO   9           HB3      PRO   9   4.025   3.660  -8.985
   63    HG2  PRO   9           HG2      PRO   9   3.498   2.476  -6.599
   64    HG3  PRO   9           HG3      PRO   9   4.673   3.828  -6.693
   65    HD2  PRO   9           HD2      PRO   9   1.722   3.974  -5.940
   66    HD3  PRO   9           HD3      PRO   9   3.146   4.610  -5.062
   67    H    ASN  10           H        ASN  10   2.532   6.640 -10.486
   68    HA   ASN  10           HA       ASN  10  -0.386   6.146 -10.758
   69    HB2  ASN  10           HB2      ASN  10   0.995   8.868 -10.823
   70    HB3  ASN  10           HB3      ASN  10  -0.666   8.574 -11.318
   71   HD21  ASN  10          HD22      ASN  10   1.531   8.505  -8.479
   72   HD22  ASN  10          HD21      ASN  10   0.221   9.055  -7.435
   73    H    VAL  11           H        VAL  11  -1.199   6.777 -12.833
   74    HA   VAL  11           HA       VAL  11   0.726   7.104 -15.075
   75    HB   VAL  11           HB       VAL  11  -1.135   5.961 -16.430
   76   HG11  VAL  11          HG11      VAL  11   1.052   4.907 -15.999
   77   HG12  VAL  11          HG12      VAL  11   0.449   4.244 -14.469
   78   HG13  VAL  11          HG13      VAL  11  -0.259   3.712 -16.011
   79   HG21  VAL  11          HG21      VAL  11  -2.900   5.932 -14.650
   80   HG22  VAL  11          HG22      VAL  11  -2.570   4.328 -15.285
   81   HG23  VAL  11          HG23      VAL  11  -1.932   4.773 -13.714
   82    H    GLY  12           H        GLY  12   0.122   8.856 -16.447
   83    HA2  GLY  12           HA2      GLY  12  -2.517  10.200 -15.945
   84    HA3  GLY  12           HA3      GLY  12  -1.036  11.082 -16.309
   85    H    ILE  13           H        ILE  13  -3.830  10.189 -17.753
   86    HA   ILE  13           HA       ILE  13  -2.728   9.344 -20.359
   87    HB   ILE  13           HB       ILE  13  -5.520   9.852 -19.272
   88   HG12  ILE  13          HG12      ILE  13  -5.947   7.668 -20.491
   89   HG13  ILE  13          HG13      ILE  13  -4.225   7.582 -20.856
   90   HG21  ILE  13          HG21      ILE  13  -4.867   9.732 -22.237
   91   HG22  ILE  13          HG22      ILE  13  -6.492   9.610 -21.516
   92   HG23  ILE  13          HG23      ILE  13  -5.583  11.097 -21.335
   93   HD11  ILE  13          HD11      ILE  13  -4.922   6.207 -18.930
   94   HD12  ILE  13          HD12      ILE  13  -3.729   7.409 -18.441
   95   HD13  ILE  13          HD13      ILE  13  -5.463   7.660 -18.070
   96    H    VAL  14           H        VAL  14  -2.246  10.777 -22.007
   97    HA   VAL  14           HA       VAL  14  -3.131  13.609 -21.692
   98    HB   VAL  14           HB       VAL  14  -0.651  12.637 -23.180
   99   HG11  VAL  14          HG11      VAL  14  -1.591  15.451 -22.468
  100   HG12  VAL  14          HG12      VAL  14  -0.135  15.017 -23.391
  101   HG13  VAL  14          HG13      VAL  14  -1.729  14.691 -24.072
  102   HG21  VAL  14          HG21      VAL  14   0.631  13.836 -21.418
  103   HG22  VAL  14          HG22      VAL  14  -0.858  13.965 -20.469
  104   HG23  VAL  14          HG23      VAL  14  -0.163  12.356 -20.862
  105    H    ILE  15           H        ILE  15  -5.171  13.123 -22.764
  106    HA   ILE  15           HA       ILE  15  -5.100  11.843 -25.393
  107    HB   ILE  15           HB       ILE  15  -7.200  13.771 -24.281
  108   HG12  ILE  15          HG12      ILE  15  -7.115  11.663 -22.997
  109   HG13  ILE  15          HG13      ILE  15  -8.622  11.928 -23.843
  110   HG21  ILE  15          HG21      ILE  15  -8.679  12.866 -26.072
  111   HG22  ILE  15          HG22      ILE  15  -7.379  13.879 -26.659
  112   HG23  ILE  15          HG23      ILE  15  -7.246  12.111 -26.828
  113   HD11  ILE  15          HD11      ILE  15  -7.713   9.545 -23.975
  114   HD12  ILE  15          HD12      ILE  15  -8.073  10.281 -25.546
  115   HD13  ILE  15          HD13      ILE  15  -6.398  10.179 -24.999
  116    H    CYS  16           H        CYS  16  -4.716  12.800 -27.314
  117    HA   CYS  16           HA       CYS  16  -4.500  15.776 -27.360
  118    HB2  CYS  16           HB2      CYS  16  -2.506  13.808 -28.519
  119    HB3  CYS  16           HB3      CYS  16  -2.714  15.474 -29.150
  120    HG   CYS  16           HG       CYS  16  -2.232  14.558 -26.000
  121    H    ASN  17           H        ASN  17  -5.837  16.565 -28.761
  122    HA   ASN  17           HA       ASN  17  -7.464  14.706 -30.373
  123    HB2  ASN  17           HB2      ASN  17  -8.585  16.504 -29.038
  124    HB3  ASN  17           HB3      ASN  17  -7.714  17.733 -29.962
  125   HD21  ASN  17          HD22      ASN  17 -10.442  15.519 -30.001
  126   HD22  ASN  17          HD21      ASN  17 -10.941  15.841 -31.643
  127    H    ARG  18           H        ARG  18  -7.412  14.768 -32.615
  128    HA   ARG  18           HA       ARG  18  -4.899  15.219 -33.801
  129    HB2  ARG  18           HB2      ARG  18  -7.594  14.792 -35.171
  130    HB3  ARG  18           HB3      ARG  18  -5.987  14.497 -35.864
  131    HG2  ARG  18           HG2      ARG  18  -5.558  12.863 -33.978
  132    HG3  ARG  18           HG3      ARG  18  -7.268  13.056 -33.498
  133    HD2  ARG  18           HD2      ARG  18  -7.966  12.440 -35.793
  134    HD3  ARG  18           HD3      ARG  18  -6.249  12.204 -36.223
  135    HE   ARG  18           HE       ARG  18  -7.289  10.646 -33.915
  136   HH11  ARG  18          HH11      ARG  18  -6.713  10.535 -37.430
  137   HH12  ARG  18          HH12      ARG  18  -6.602   8.810 -37.489
  138   HH21  ARG  18          HH21      ARG  18  -7.138   8.436 -33.980
  139   HH22  ARG  18          HH22      ARG  18  -6.866   7.563 -35.473
  140    H    GLN  19           H        GLN  19  -7.298  17.615 -33.268
  141    HA   GLN  19           HA       GLN  19  -6.515  19.316 -35.506
  142    HB2  GLN  19           HB2      GLN  19  -7.856  19.873 -32.833
  143    HB3  GLN  19           HB3      GLN  19  -7.605  21.098 -34.087
  144    HG2  GLN  19           HG2      GLN  19  -9.091  20.092 -35.601
  145    HG3  GLN  19           HG3      GLN  19  -9.078  18.538 -34.770
  146   HE21  GLN  19          HE22      GLN  19 -10.217  18.268 -32.783
  147   HE22  GLN  19          HE21      GLN  19 -11.490  19.384 -32.279
  148    H    GLY  20           H        GLY  20  -4.853  18.274 -32.670
  149    HA2  GLY  20           HA2      GLY  20  -2.543  18.623 -32.402
  150    HA3  GLY  20           HA3      GLY  20  -2.668  20.226 -33.149
  151    H    GLN  21           H        GLN  21  -4.555  18.781 -30.455
  152    HA   GLN  21           HA       GLN  21  -3.776  21.023 -28.690
  153    HB2  GLN  21           HB2      GLN  21  -6.544  20.567 -29.891
  154    HB3  GLN  21           HB3      GLN  21  -6.362  21.298 -28.322
  155    HG2  GLN  21           HG2      GLN  21  -6.369  23.215 -29.545
  156    HG3  GLN  21           HG3      GLN  21  -4.641  22.928 -29.573
  157   HE21  GLN  21          HE22      GLN  21  -3.652  22.733 -31.693
  158   HE22  GLN  21          HE21      GLN  21  -4.574  22.531 -33.162
  159    H    VAL  22           H        VAL  22  -4.577  20.647 -26.452
  160    HA   VAL  22           HA       VAL  22  -4.174  17.756 -25.926
  161    HB   VAL  22           HB       VAL  22  -3.426  18.575 -23.675
  162   HG11  VAL  22          HG11      VAL  22  -1.247  19.425 -24.531
  163   HG12  VAL  22          HG12      VAL  22  -1.817  17.960 -25.340
  164   HG13  VAL  22          HG13      VAL  22  -1.969  19.521 -26.153
  165   HG21  VAL  22          HG21      VAL  22  -2.801  20.917 -23.408
  166   HG22  VAL  22          HG22      VAL  22  -3.530  21.349 -24.955
  167   HG23  VAL  22          HG23      VAL  22  -4.557  20.780 -23.631
  168    H    MET  23           H        MET  23  -5.073  16.762 -24.111
  169    HA   MET  23           HA       MET  23  -7.817  16.928 -23.627
  170    HB2  MET  23           HB2      MET  23  -6.112  15.083 -23.041
  171    HB3  MET  23           HB3      MET  23  -5.759  15.987 -21.589
  172    HG2  MET  23           HG2      MET  23  -8.182  15.933 -20.989
  173    HG3  MET  23           HG3      MET  23  -8.499  14.985 -22.448
  174    HE1  MET  23           HE1      MET  23  -9.794  13.173 -21.057
  175    HE2  MET  23           HE2      MET  23  -9.173  12.561 -19.493
  176    HE3  MET  23           HE3      MET  23  -9.531  14.283 -19.686
  177    H    TRP  24           H        TRP  24  -9.016  18.383 -22.294
  178    HA   TRP  24           HA       TRP  24  -7.888  19.147 -19.796
  179    HB2  TRP  24           HB2      TRP  24  -7.220  20.989 -21.573
  180    HB3  TRP  24           HB3      TRP  24  -8.892  21.492 -21.410
  181    HD1  TRP  24           HD1      TRP  24  -8.697  23.629 -20.073
  182    HE1  TRP  24           HE1      TRP  24  -7.743  24.358 -17.824
  183    HE3  TRP  24           HE3      TRP  24  -6.029  19.394 -18.906
  184    HZ2  TRP  24           HZ2      TRP  24  -6.059  23.218 -15.729
  185    HZ3  TRP  24           HZ3      TRP  24  -4.878  19.217 -16.749
  186    HH2  TRP  24           HH2      TRP  24  -4.906  21.107 -15.133
  187    H    ALA  25           H        ALA  25  -9.539  19.339 -18.261
  188    HA   ALA  25           HA       ALA  25 -12.300  19.464 -19.172
  189    HB1  ALA  25           HB1      ALA  25 -11.902  17.082 -19.471
  190    HB2  ALA  25           HB2      ALA  25 -11.148  16.957 -17.873
  191    HB3  ALA  25           HB3      ALA  25 -12.884  17.308 -18.009
  192    H    ARG  26           H        ARG  26 -13.702  20.099 -17.610
  193    HA   ARG  26           HA       ARG  26 -12.548  21.527 -15.356
  194    HB2  ARG  26           HB2      ARG  26 -14.462  22.383 -16.691
  195    HB3  ARG  26           HB3      ARG  26 -15.461  21.039 -16.120
  196    HG2  ARG  26           HG2      ARG  26 -15.299  21.865 -13.798
  197    HG3  ARG  26           HG3      ARG  26 -14.127  23.095 -14.298
  198    HD2  ARG  26           HD2      ARG  26 -16.281  24.146 -14.014
  199    HD3  ARG  26           HD3      ARG  26 -15.837  24.156 -15.733
  200    HE   ARG  26           HE       ARG  26 -17.456  21.848 -15.047
  201   HH11  ARG  26          HH21      ARG  26 -17.755  25.341 -15.680
  202   HH12  ARG  26          HH22      ARG  26 -19.387  25.235 -16.236
  203   HH21  ARG  26          HH11      ARG  26 -19.551  21.690 -15.753
  204   HH22  ARG  26          HH12      ARG  26 -20.460  23.089 -16.281
  205    H    ARG  27           H        ARG  27 -12.773  20.944 -13.125
  206    HA   ARG  27           HA       ARG  27 -12.725  18.084 -12.828
  207    HB2  ARG  27           HB2      ARG  27 -11.237  19.895 -11.712
  208    HB3  ARG  27           HB3      ARG  27 -12.514  20.049 -10.532
  209    HG2  ARG  27           HG2      ARG  27 -10.998  17.471 -11.191
  210    HG3  ARG  27           HG3      ARG  27 -10.544  18.597  -9.916
  211    HD2  ARG  27           HD2      ARG  27 -12.606  18.117  -8.700
  212    HD3  ARG  27           HD3      ARG  27 -13.084  16.965  -9.964
  213    HE   ARG  27           HE       ARG  27 -10.543  16.191  -9.106
  214   HH11  ARG  27          HH21      ARG  27 -13.830  16.501  -7.729
  215   HH12  ARG  27          HH22      ARG  27 -13.609  15.224  -6.581
  216   HH21  ARG  27          HH11      ARG  27 -10.372  14.292  -7.771
  217   HH22  ARG  27          HH12      ARG  27 -11.593  13.966  -6.584
  218    H    PHE  28           H        PHE  28 -14.130  16.797 -11.672
  219    HA   PHE  28           HA       PHE  28 -16.920  17.443 -11.393
  220    HB2  PHE  28           HB2      PHE  28 -16.196  15.195 -11.799
  221    HB3  PHE  28           HB3      PHE  28 -15.062  15.234 -10.461
  222    HD1  PHE  28           HD2      PHE  28 -18.743  15.364 -11.191
  223    HD2  PHE  28           HD1      PHE  28 -15.615  14.328  -8.415
  224    HE1  PHE  28           HE2      PHE  28 -20.405  14.199  -9.760
  225    HE2  PHE  28           HE1      PHE  28 -17.275  13.089  -7.013
  226    HZ   PHE  28           HZ       PHE  28 -19.675  13.056  -7.675
  227    H    GLY  29           H        GLY  29 -17.869  18.609  -9.759
  228    HA2  GLY  29           HA2      GLY  29 -18.417  19.264  -7.663
  229    HA3  GLY  29           HA3      GLY  29 -17.325  18.027  -7.036
  230    H    GLN  30           H        GLN  30 -15.784  20.402  -9.097
  231    HA   GLN  30           HA       GLN  30 -14.921  22.133  -6.873
  232    HB2  GLN  30           HB2      GLN  30 -13.416  20.213  -6.744
  233    HB3  GLN  30           HB3      GLN  30 -13.233  20.198  -8.494
  234    HG2  GLN  30           HG2      GLN  30 -12.146  22.476  -8.309
  235    HG3  GLN  30           HG3      GLN  30 -12.101  22.238  -6.560
  236   HE21  GLN  30          HE22      GLN  30 -10.142  22.122  -9.152
  237   HE22  GLN  30          HE21      GLN  30  -9.101  20.765  -8.747
  238    H    HIS  31           H        HIS  31 -14.673  24.207  -7.739
  239    HA   HIS  31           HA       HIS  31 -15.493  24.496 -10.525
  240    HB2  HIS  31           HB2      HIS  31 -15.115  26.607  -8.392
  241    HB3  HIS  31           HB3      HIS  31 -15.961  26.789  -9.932
  242    HD1  HIS  31           HD1      HIS  31 -17.114  26.834  -6.698
  243    HD2  HIS  31           HD2      HIS  31 -17.794  24.126  -9.856
  244    HE1  HIS  31           HE1      HIS  31 -19.297  25.638  -6.163
  245    H    SER  32           H        SER  32 -13.072  23.430 -10.734
  246    HA   SER  32           HA       SER  32 -11.593  25.456 -12.165
  247    HB2  SER  32           HB2      SER  32  -9.410  24.941 -10.967
  248    HB3  SER  32           HB3      SER  32 -10.567  25.928 -10.083
  249    HG   SER  32           HG       SER  32  -9.802  24.412  -8.680
  250    H    TRP  33           H        TRP  33  -9.395  24.100 -12.951
  251    HA   TRP  33           HA       TRP  33 -10.492  21.592 -14.140
  252    HB2  TRP  33           HB2      TRP  33  -8.516  23.586 -15.271
  253    HB3  TRP  33           HB3      TRP  33  -9.069  22.102 -16.050
  254    HD1  TRP  33           HD1      TRP  33 -10.785  25.328 -14.661
  255    HE1  TRP  33           HE1      TRP  33 -12.646  26.041 -16.228
  256    HE3  TRP  33           HE3      TRP  33 -10.180  21.775 -18.266
  257    HZ2  TRP  33           HZ2      TRP  33 -13.824  25.125 -18.717
  258    HZ3  TRP  33           HZ3      TRP  33 -11.656  21.745 -20.271
  259    HH2  TRP  33           HH2      TRP  33 -13.502  23.399 -20.486
  260    H    GLN  34           H        GLN  34  -8.788  19.849 -14.511
  261    HA   GLN  34           HA       GLN  34  -6.692  19.979 -12.386
  262    HB2  GLN  34           HB2      GLN  34  -8.932  18.952 -11.651
  263    HB3  GLN  34           HB3      GLN  34  -8.574  17.636 -12.769
  264    HG2  GLN  34           HG2      GLN  34  -6.283  17.542 -11.386
  265    HG3  GLN  34           HG3      GLN  34  -7.230  18.382 -10.171
  266   HE21  GLN  34          HE22      GLN  34  -6.640  15.363 -11.849
  267   HE22  GLN  34          HE21      GLN  34  -7.758  14.373 -10.907
  268    H    PHE  35           H        PHE  35  -4.856  18.830 -12.725
  269    HA   PHE  35           HA       PHE  35  -4.092  17.830 -15.248
  270    HB2  PHE  35           HB2      PHE  35  -2.115  17.119 -14.202
  271    HB3  PHE  35           HB3      PHE  35  -2.573  18.602 -13.400
  272    HD1  PHE  35           HD1      PHE  35  -3.955  18.288 -11.097
  273    HD2  PHE  35           HD2      PHE  35  -1.509  15.235 -12.929
  274    HE1  PHE  35           HE1      PHE  35  -3.988  16.995  -8.993
  275    HE2  PHE  35           HE2      PHE  35  -1.432  14.020 -10.778
  276    HZ   PHE  35           HZ       PHE  35  -2.715  14.860  -8.814
  277    HA   PRO  36           HA       PRO  36  -6.068  13.761 -14.989
  278    HB2  PRO  36           HB2      PRO  36  -3.929  12.955 -16.943
  279    HB3  PRO  36           HB3      PRO  36  -5.688  12.661 -17.036
  280    HG2  PRO  36           HG2      PRO  36  -4.560  14.627 -18.540
  281    HG3  PRO  36           HG3      PRO  36  -6.127  14.904 -17.712
  282    HD2  PRO  36           HD2      PRO  36  -3.352  15.785 -16.848
  283    HD3  PRO  36           HD3      PRO  36  -4.891  16.694 -16.852
  284    H    GLN  37           H        GLN  37  -5.619  11.734 -13.995
  285    HA   GLN  37           HA       GLN  37  -3.058  10.653 -13.516
  286    HB2  GLN  37           HB2      GLN  37  -2.730  10.874 -11.177
  287    HB3  GLN  37           HB3      GLN  37  -2.716  12.434 -11.939
  288    HG2  GLN  37           HG2      GLN  37  -3.946  12.866 -10.004
  289    HG3  GLN  37           HG3      GLN  37  -5.219  12.657 -11.184
  290   HE21  GLN  37          HE22      GLN  37  -6.907  11.833  -9.870
  291   HE22  GLN  37          HE21      GLN  37  -6.732  10.437  -8.829
  292    H    GLY  38           H        GLY  38  -3.172   8.582 -12.460
  293    HA2  GLY  38           HA2      GLY  38  -5.452   7.787 -10.866
  294    HA3  GLY  38           HA3      GLY  38  -5.315   6.913 -12.408
  295    H    GLY  39           H        GLY  39  -4.706   6.195  -9.383
  296    HA2  GLY  39           HA2      GLY  39  -1.921   5.695  -9.163
  297    HA3  GLY  39           HA3      GLY  39  -3.212   4.983  -8.197
  298    H    ILE  40           H        ILE  40  -0.965   3.605  -9.043
  299    HA   ILE  40           HA       ILE  40  -1.812   1.713 -11.173
  300    HB   ILE  40           HB       ILE  40   0.769   2.173  -9.652
  301   HG12  ILE  40          HG12      ILE  40   0.043   2.533 -12.595
  302   HG13  ILE  40          HG13      ILE  40   0.202   3.826 -11.421
  303   HG21  ILE  40          HG21      ILE  40   0.263   0.034 -11.756
  304   HG22  ILE  40          HG22      ILE  40   1.849   0.467 -11.083
  305   HG23  ILE  40          HG23      ILE  40   0.642  -0.215 -10.032
  306   HD11  ILE  40          HD11      ILE  40   2.178   3.806 -12.736
  307   HD12  ILE  40          HD12      ILE  40   2.629   3.220 -11.128
  308   HD13  ILE  40          HD13      ILE  40   2.442   2.083 -12.492
  309    H    ASN  41           H        ASN  41  -2.138  -0.541 -10.704
  310    HA   ASN  41           HA       ASN  41  -2.876  -1.123  -7.894
  311    HB2  ASN  41           HB2      ASN  41  -3.378  -2.699 -10.451
  312    HB3  ASN  41           HB3      ASN  41  -3.828  -3.239  -8.848
  313   HD21  ASN  41          HD22      ASN  41  -4.771  -1.263 -11.539
  314   HD22  ASN  41          HD21      ASN  41  -6.209  -0.569 -10.790
  315    HA   PRO  42           HA       PRO  42   0.752  -3.223  -6.994
  316    HB2  PRO  42           HB2      PRO  42  -0.879  -5.518  -5.875
  317    HB3  PRO  42           HB3      PRO  42   0.512  -4.666  -5.136
  318    HG2  PRO  42           HG2      PRO  42  -2.007  -4.059  -4.365
  319    HG3  PRO  42           HG3      PRO  42  -0.838  -2.731  -4.687
  320    HD2  PRO  42           HD2      PRO  42  -2.997  -3.819  -6.518
  321    HD3  PRO  42           HD3      PRO  42  -2.594  -2.122  -6.124
  322    H    GLY  43           H        GLY  43   1.976  -3.926  -8.490
  323    HA2  GLY  43           HA2      GLY  43   3.136  -5.471  -9.781
  324    HA3  GLY  43           HA3      GLY  43   1.898  -6.692  -9.443
  325    H    GLU  44           H        GLU  44   0.458  -3.789 -10.544
  326    HA   GLU  44           HA       GLU  44  -0.088  -4.928 -13.231
  327    HB2  GLU  44           HB2      GLU  44  -1.853  -3.961 -11.767
  328    HB3  GLU  44           HB3      GLU  44  -1.090  -2.369 -11.934
  329    HG2  GLU  44           HG2      GLU  44  -1.512  -2.333 -14.290
  330    HG3  GLU  44           HG3      GLU  44  -1.946  -4.047 -14.314
  331    H    SER  45           H        SER  45   1.129  -4.443 -14.955
  332    HA   SER  45           HA       SER  45   3.318  -2.622 -14.823
  333    HB2  SER  45           HB2      SER  45   3.199  -3.330 -17.425
  334    HB3  SER  45           HB3      SER  45   3.911  -4.307 -16.138
  335    HG   SER  45           HG       SER  45   2.552  -5.729 -17.029
  336    H    ALA  46           H        ALA  46   3.727  -0.882 -16.329
  337    HA   ALA  46           HA       ALA  46   2.061   1.207 -15.691
  338    HB1  ALA  46           HB1      ALA  46   4.448   1.374 -16.342
  339    HB2  ALA  46           HB2      ALA  46   4.005   1.019 -18.032
  340    HB3  ALA  46           HB3      ALA  46   3.440   2.518 -17.245
  341    H    GLU  47           H        GLU  47   1.992  -0.672 -18.807
  342    HA   GLU  47           HA       GLU  47   0.179   1.241 -20.019
  343    HB2  GLU  47           HB2      GLU  47   0.473  -1.626 -20.959
  344    HB3  GLU  47           HB3      GLU  47   0.012  -0.195 -21.852
  345    HG2  GLU  47           HG2      GLU  47   2.135  -0.587 -22.628
  346    HG3  GLU  47           HG3      GLU  47   2.412   0.667 -21.422
  347    H    GLN  48           H        GLN  48  -0.132  -1.971 -18.479
  348    HA   GLN  48           HA       GLN  48  -2.894  -2.352 -18.777
  349    HB2  GLN  48           HB2      GLN  48  -0.917  -3.372 -16.658
  350    HB3  GLN  48           HB3      GLN  48  -2.589  -3.877 -16.736
  351    HG2  GLN  48           HG2      GLN  48  -1.011  -5.462 -17.845
  352    HG3  GLN  48           HG3      GLN  48  -2.333  -4.912 -18.874
  353   HE21  GLN  48          HE22      GLN  48   1.128  -4.100 -18.107
  354   HE22  GLN  48          HE21      GLN  48   1.498  -3.374 -19.652
  355    H    ALA  49           H        ALA  49  -1.119  -0.635 -16.124
  356    HA   ALA  49           HA       ALA  49  -3.491   0.132 -14.693
  357    HB1  ALA  49           HB1      ALA  49  -0.744   1.440 -14.779
  358    HB2  ALA  49           HB2      ALA  49  -2.035   1.790 -13.610
  359    HB3  ALA  49           HB3      ALA  49  -1.272   0.179 -13.636
  360    H    MET  50           H        MET  50  -1.711   1.642 -17.444
  361    HA   MET  50           HA       MET  50  -3.037   4.148 -17.315
  362    HB2  MET  50           HB2      MET  50  -0.925   3.812 -18.451
  363    HB3  MET  50           HB3      MET  50  -1.684   2.769 -19.654
  364    HG2  MET  50           HG2      MET  50  -2.523   5.644 -19.180
  365    HG3  MET  50           HG3      MET  50  -1.281   5.184 -20.323
  366    HE1  MET  50           HE1      MET  50  -1.559   4.344 -22.640
  367    HE2  MET  50           HE2      MET  50  -2.083   2.769 -21.985
  368    HE3  MET  50           HE3      MET  50  -3.019   3.556 -23.274
  369    H    TYR  51           H        TYR  51  -3.982   1.164 -19.166
  370    HA   TYR  51           HA       TYR  51  -6.339   2.406 -20.074
  371    HB2  TYR  51           HB2      TYR  51  -5.871  -0.541 -19.578
  372    HB3  TYR  51           HB3      TYR  51  -7.213   0.149 -20.490
  373    HD1  TYR  51           HD2      TYR  51  -6.796   1.306 -22.724
  374    HD2  TYR  51           HD1      TYR  51  -3.693  -0.687 -20.515
  375    HE1  TYR  51           HE2      TYR  51  -5.406   1.245 -24.754
  376    HE2  TYR  51           HE1      TYR  51  -2.235  -0.700 -22.512
  377    HH   TYR  51           HH       TYR  51  -3.395   0.516 -25.727
  378    H    ARG  52           H        ARG  52  -5.708   1.138 -16.804
  379    HA   ARG  52           HA       ARG  52  -8.510   1.013 -16.009
  380    HB2  ARG  52           HB2      ARG  52  -6.170   1.785 -14.202
  381    HB3  ARG  52           HB3      ARG  52  -7.759   1.250 -13.712
  382    HG2  ARG  52           HG2      ARG  52  -5.695  -0.453 -15.135
  383    HG3  ARG  52           HG3      ARG  52  -6.002  -0.416 -13.400
  384    HD2  ARG  52           HD2      ARG  52  -8.333  -1.213 -13.808
  385    HD3  ARG  52           HD3      ARG  52  -7.942  -1.360 -15.546
  386    HE   ARG  52           HE       ARG  52  -5.918  -2.688 -14.107
  387   HH11  ARG  52          HH21      ARG  52  -9.425  -3.214 -14.604
  388   HH12  ARG  52          HH22      ARG  52  -9.301  -4.923 -14.374
  389   HH21  ARG  52          HH11      ARG  52  -5.755  -4.759 -13.841
  390   HH22  ARG  52          HH12      ARG  52  -7.110  -5.881 -13.899
  391    H    ALA  53           H        ALA  53  -5.955   3.543 -15.765
  392    HA   ALA  53           HA       ALA  53  -7.666   5.550 -14.700
  393    HB1  ALA  53           HB1      ALA  53  -5.245   5.697 -14.555
  394    HB2  ALA  53           HB2      ALA  53  -5.105   5.814 -16.329
  395    HB3  ALA  53           HB3      ALA  53  -5.883   7.118 -15.403
  396    H    LEU  54           H        LEU  54  -6.997   4.626 -18.083
  397    HA   LEU  54           HA       LEU  54  -8.157   6.819 -19.451
  398    HB2  LEU  54           HB2      LEU  54  -6.784   5.004 -20.427
  399    HB3  LEU  54           HB3      LEU  54  -8.045   3.846 -19.990
  400    HG   LEU  54           HG       LEU  54  -9.590   4.888 -21.627
  401   HD11  LEU  54          HD11      LEU  54  -8.613   7.147 -21.739
  402   HD12  LEU  54          HD12      LEU  54  -7.096   6.473 -22.393
  403   HD13  LEU  54          HD13      LEU  54  -8.601   6.386 -23.342
  404   HD21  LEU  54          HD21      LEU  54  -8.448   3.844 -23.507
  405   HD22  LEU  54          HD22      LEU  54  -6.915   3.843 -22.584
  406   HD23  LEU  54          HD23      LEU  54  -8.316   2.905 -22.003
  407    H    PHE  55           H        PHE  55  -9.540   3.820 -18.168
  408    HA   PHE  55           HA       PHE  55 -12.280   4.446 -18.852
  409    HB2  PHE  55           HB2      PHE  55 -12.052   2.193 -18.725
  410    HB3  PHE  55           HB3      PHE  55 -10.800   2.249 -17.504
  411    HD1  PHE  55           HD2      PHE  55 -14.496   2.503 -17.993
  412    HD2  PHE  55           HD1      PHE  55 -11.241   1.994 -15.224
  413    HE1  PHE  55           HE2      PHE  55 -16.127   1.998 -16.183
  414    HE2  PHE  55           HE1      PHE  55 -12.878   1.475 -13.400
  415    HZ   PHE  55           HZ       PHE  55 -15.319   1.483 -13.881
  416    H    GLU  56           H        GLU  56 -10.431   4.688 -15.741
  417    HA   GLU  56           HA       GLU  56 -12.694   5.483 -14.220
  418    HB2  GLU  56           HB2      GLU  56  -9.695   5.837 -13.792
  419    HB3  GLU  56           HB3      GLU  56 -10.892   6.355 -12.609
  420    HG2  GLU  56           HG2      GLU  56 -11.755   4.071 -12.392
  421    HG3  GLU  56           HG3      GLU  56 -10.598   3.492 -13.590
  422    H    GLU  57           H        GLU  57 -10.263   7.454 -15.991
  423    HA   GLU  57           HA       GLU  57 -11.367   9.949 -14.947
  424    HB2  GLU  57           HB2      GLU  57  -9.182   9.457 -17.026
  425    HB3  GLU  57           HB3      GLU  57  -9.582  10.977 -16.246
  426    HG2  GLU  57           HG2      GLU  57  -8.983   9.886 -14.025
  427    HG3  GLU  57           HG3      GLU  57  -8.387   8.502 -14.935
  428    H    VAL  58           H        VAL  58 -11.057   8.323 -18.144
  429    HA   VAL  58           HA       VAL  58 -12.594  10.516 -19.351
  430    HB   VAL  58           HB       VAL  58 -11.305   8.393 -21.023
  431   HG11  VAL  58          HG11      VAL  58 -10.922  10.239 -22.516
  432   HG12  VAL  58          HG12      VAL  58 -12.580  10.381 -21.906
  433   HG13  VAL  58          HG13      VAL  58 -11.315  11.427 -21.254
  434   HG21  VAL  58          HG21      VAL  58  -9.445   8.749 -19.487
  435   HG22  VAL  58          HG22      VAL  58  -9.112   9.659 -20.956
  436   HG23  VAL  58          HG23      VAL  58  -9.695  10.498 -19.503
  437    H    GLY  59           H        GLY  59 -12.939   7.115 -18.548
  438    HA2  GLY  59           HA2      GLY  59 -14.724   5.681 -18.818
  439    HA3  GLY  59           HA3      GLY  59 -15.689   6.985 -19.516
  440    H    LEU  60           H        LEU  60 -12.473   6.023 -20.686
  441    HA   LEU  60           HA       LEU  60 -13.652   4.894 -23.192
  442    HB2  LEU  60           HB2      LEU  60 -11.006   6.307 -22.721
  443    HB3  LEU  60           HB3      LEU  60 -11.428   5.448 -24.186
  444    HG   LEU  60           HG       LEU  60 -12.688   7.975 -23.075
  445   HD11  LEU  60          HD11      LEU  60 -11.823   9.006 -25.140
  446   HD12  LEU  60          HD12      LEU  60 -10.509   8.221 -24.252
  447   HD13  LEU  60          HD13      LEU  60 -11.219   7.448 -25.696
  448   HD21  LEU  60          HD21      LEU  60 -13.575   6.424 -25.542
  449   HD22  LEU  60          HD22      LEU  60 -14.530   6.732 -24.077
  450   HD23  LEU  60          HD23      LEU  60 -14.086   8.074 -25.129
  451    H    SER  61           H        SER  61 -12.483   3.037 -24.051
  452    HA   SER  61           HA       SER  61 -11.335   1.348 -21.865
  453    HB2  SER  61           HB2      SER  61 -13.122   0.596 -24.207
  454    HB3  SER  61           HB3      SER  61 -12.544  -0.495 -22.926
  455    HG   SER  61           HG       SER  61 -14.687   0.278 -22.512
  456    H    ARG  62           H        ARG  62 -10.420  -0.775 -23.254
  457    HA   ARG  62           HA       ARG  62  -7.889   0.155 -24.149
  458    HB2  ARG  62           HB2      ARG  62  -9.089  -2.653 -24.241
  459    HB3  ARG  62           HB3      ARG  62  -7.377  -2.265 -24.394
  460    HG2  ARG  62           HG2      ARG  62  -7.315  -1.425 -22.110
  461    HG3  ARG  62           HG3      ARG  62  -9.032  -1.822 -21.879
  462    HD2  ARG  62           HD2      ARG  62  -8.508  -4.205 -22.354
  463    HD3  ARG  62           HD3      ARG  62  -6.800  -3.775 -22.571
  464    HE   ARG  62           HE       ARG  62  -7.726  -2.879 -20.011
  465   HH11  ARG  62          HH11      ARG  62  -6.872  -5.892 -21.712
  466   HH12  ARG  62          HH12      ARG  62  -6.428  -6.742 -20.279
  467   HH21  ARG  62          HH21      ARG  62  -7.136  -4.027 -18.092
  468   HH22  ARG  62          HH22      ARG  62  -6.596  -5.665 -18.180
  469    H    LYS  63           H        LYS  63  -9.737   1.217 -25.980
  470    HA   LYS  63           HA       LYS  63  -8.812   0.087 -28.538
  471    HB2  LYS  63           HB2      LYS  63 -11.005  -0.647 -29.271
  472    HB3  LYS  63           HB3      LYS  63 -10.558  -1.459 -27.759
  473    HG2  LYS  63           HG2      LYS  63 -12.014   0.095 -26.479
  474    HG3  LYS  63           HG3      LYS  63 -12.509   0.877 -27.990
  475    HD2  LYS  63           HD2      LYS  63 -13.518  -1.183 -28.796
  476    HD3  LYS  63           HD3      LYS  63 -12.914  -2.084 -27.383
  477    HE2  LYS  63           HE2      LYS  63 -14.241  -0.673 -25.869
  478    HE3  LYS  63           HE3      LYS  63 -14.803   0.311 -27.227
  479    HZ1  LYS  63           HZ1      LYS  63 -16.457  -1.336 -26.591
  480    HZ2  LYS  63           HZ2      LYS  63 -15.943  -1.664 -28.104
  481    HZ3  LYS  63           HZ3      LYS  63 -15.425  -2.573 -26.840
  482    H    ASP  64           H        ASP  64 -10.367   2.659 -26.710
  483    HA   ASP  64           HA       ASP  64 -11.444   3.965 -29.104
  484    HB2  ASP  64           HB2      ASP  64 -11.256   4.864 -26.222
  485    HB3  ASP  64           HB3      ASP  64 -12.176   5.684 -27.476
  486    H    VAL  65           H        VAL  65  -8.346   3.691 -27.995
  487    HA   VAL  65           HA       VAL  65  -7.478   6.314 -28.959
  488    HB   VAL  65           HB       VAL  65  -6.182   6.718 -26.905
  489   HG11  VAL  65          HG11      VAL  65  -7.951   7.647 -25.580
  490   HG12  VAL  65          HG12      VAL  65  -8.421   7.791 -27.292
  491   HG13  VAL  65          HG13      VAL  65  -9.147   6.539 -26.279
  492   HG21  VAL  65          HG21      VAL  65  -6.704   5.562 -24.801
  493   HG22  VAL  65          HG22      VAL  65  -7.862   4.507 -25.632
  494   HG23  VAL  65          HG23      VAL  65  -6.126   4.383 -25.980
  495    H    ARG  66           H        ARG  66  -5.004   6.355 -28.897
  496    HA   ARG  66           HA       ARG  66  -3.777   3.737 -29.659
  497    HB2  ARG  66           HB2      ARG  66  -4.650   4.625 -31.720
  498    HB3  ARG  66           HB3      ARG  66  -4.323   6.283 -31.245
  499    HG2  ARG  66           HG2      ARG  66  -2.852   5.775 -32.972
  500    HG3  ARG  66           HG3      ARG  66  -1.895   5.897 -31.510
  501    HD2  ARG  66           HD2      ARG  66  -2.897   3.157 -32.322
  502    HD3  ARG  66           HD3      ARG  66  -1.677   3.893 -33.366
  503    HE   ARG  66           HE       ARG  66  -0.463   4.224 -31.003
  504   HH11  ARG  66          HH11      ARG  66  -1.894   1.301 -32.467
  505   HH12  ARG  66          HH12      ARG  66  -0.722   0.236 -31.779
  506   HH21  ARG  66          HH21      ARG  66   1.061   2.853 -30.130
  507   HH22  ARG  66          HH22      ARG  66   1.003   1.140 -30.397
  508    H    ILE  67           H        ILE  67  -1.798   3.726 -28.418
  509    HA   ILE  67           HA       ILE  67  -0.865   6.219 -27.236
  510    HB   ILE  67           HB       ILE  67   0.411   3.464 -27.408
  511   HG12  ILE  67          HG12      ILE  67  -1.008   4.643 -24.981
  512   HG13  ILE  67          HG13      ILE  67  -1.912   3.728 -26.178
  513   HG21  ILE  67          HG21      ILE  67   1.047   5.850 -25.602
  514   HG22  ILE  67          HG22      ILE  67   1.782   4.232 -25.474
  515   HG23  ILE  67          HG23      ILE  67   2.078   5.198 -26.904
  516   HD11  ILE  67          HD11      ILE  67   0.451   2.670 -24.567
  517   HD12  ILE  67          HD12      ILE  67  -1.247   2.235 -24.377
  518   HD13  ILE  67          HD13      ILE  67  -0.392   1.784 -25.862
  519    H    LEU  68           H        LEU  68   0.573   7.628 -28.051
  520    HA   LEU  68           HA       LEU  68   2.052   6.829 -30.551
  521    HB2  LEU  68           HB2      LEU  68   0.671   9.332 -29.791
  522    HB3  LEU  68           HB3      LEU  68   2.327   9.620 -30.304
  523    HG   LEU  68           HG       LEU  68   0.668   9.818 -32.110
  524   HD11  LEU  68          HD11      LEU  68   1.934   8.614 -33.821
  525   HD12  LEU  68          HD12      LEU  68   3.030   9.344 -32.641
  526   HD13  LEU  68          HD13      LEU  68   2.706   7.597 -32.588
  527   HD21  LEU  68          HD21      LEU  68  -0.452   7.946 -33.090
  528   HD22  LEU  68          HD22      LEU  68   0.382   6.786 -32.035
  529   HD23  LEU  68          HD23      LEU  68  -0.810   7.908 -31.349
  530    H    ALA  69           H        ALA  69   2.412   8.080 -27.248
  531    HA   ALA  69           HA       ALA  69   5.275   7.537 -27.301
  532    HB1  ALA  69           HB1      ALA  69   5.916   9.873 -26.739
  533    HB2  ALA  69           HB2      ALA  69   5.152   9.821 -28.336
  534    HB3  ALA  69           HB3      ALA  69   4.234  10.408 -26.948
  535    H    SER  70           H        SER  70   6.174   7.997 -25.039
  536    HA   SER  70           HA       SER  70   4.245   8.550 -22.942
  537    HB2  SER  70           HB2      SER  70   5.064   6.562 -21.604
  538    HB3  SER  70           HB3      SER  70   3.988   6.194 -22.959
  539    HG   SER  70           HG       SER  70   5.689   4.752 -23.096
  540    H    THR  71           H        THR  71   5.517   9.081 -20.827
  541    HA   THR  71           HA       THR  71   7.828  10.641 -21.552
  542    HB   THR  71           HB       THR  71   8.013  10.836 -18.975
  543    HG1  THR  71           HG1      THR  71   6.862   9.141 -18.253
  544   HG21  THR  71          HG21      THR  71   5.960  12.254 -18.838
  545   HG22  THR  71          HG22      THR  71   6.980  12.611 -20.246
  546   HG23  THR  71          HG23      THR  71   5.491  11.673 -20.449
  547    H    ARG  72           H        ARG  72   9.969  10.103 -21.473
  548    HA   ARG  72           HA       ARG  72  10.505   7.341 -21.802
  549    HB2  ARG  72           HB2      ARG  72  12.214   9.845 -21.691
  550    HB3  ARG  72           HB3      ARG  72  12.940   8.243 -21.929
  551    HG2  ARG  72           HG2      ARG  72  11.570   7.830 -23.896
  552    HG3  ARG  72           HG3      ARG  72  10.701   9.349 -23.696
  553    HD2  ARG  72           HD2      ARG  72  13.714   9.264 -24.089
  554    HD3  ARG  72           HD3      ARG  72  12.575   9.222 -25.445
  555    HE   ARG  72           HE       ARG  72  11.874  11.423 -23.766
  556   HH11  ARG  72          HH11      ARG  72  14.440  10.431 -26.049
  557   HH12  ARG  72          HH12      ARG  72  14.728  12.028 -26.636
  558   HH21  ARG  72          HH21      ARG  72  12.264  13.522 -24.520
  559   HH22  ARG  72          HH22      ARG  72  13.441  13.830 -25.771
  560    H    ASN  73           H        ASN  73  10.458   9.128 -18.859
  561    HA   ASN  73           HA       ASN  73  11.020   6.713 -17.435
  562    HB2  ASN  73           HB2      ASN  73  12.710   7.439 -15.955
  563    HB3  ASN  73           HB3      ASN  73  13.336   7.749 -17.564
  564   HD21  ASN  73          HD22      ASN  73  12.962  10.148 -18.382
  565   HD22  ASN  73          HD21      ASN  73  13.161  11.387 -17.171
  566    H    TRP  74           H        TRP  74  10.422   7.110 -15.035
  567    HA   TRP  74           HA       TRP  74   7.907   8.484 -14.912
  568    HB2  TRP  74           HB2      TRP  74   9.665   7.441 -12.643
  569    HB3  TRP  74           HB3      TRP  74   7.951   7.843 -12.556
  570    HD1  TRP  74           HD1      TRP  74  10.351   5.179 -13.929
  571    HE1  TRP  74           HE1      TRP  74   9.061   3.111 -14.643
  572    HE3  TRP  74           HE3      TRP  74   5.590   6.742 -12.879
  573    HZ2  TRP  74           HZ2      TRP  74   6.330   2.340 -15.070
  574    HZ3  TRP  74           HZ3      TRP  74   3.660   5.326 -13.519
  575    HH2  TRP  74           HH2      TRP  74   3.971   3.193 -14.704
  576    H    LEU  75           H        LEU  75   7.678  10.687 -14.680
  577    HA   LEU  75           HA       LEU  75  10.017  12.360 -14.541
  578    HB2  LEU  75           HB2      LEU  75   7.062  13.035 -14.204
  579    HB3  LEU  75           HB3      LEU  75   8.345  14.228 -14.334
  580    HG   LEU  75           HG       LEU  75   7.553  12.239 -16.505
  581   HD11  LEU  75          HD11      LEU  75   7.020  15.222 -16.101
  582   HD12  LEU  75          HD12      LEU  75   6.657  14.309 -17.590
  583   HD13  LEU  75          HD13      LEU  75   5.837  13.909 -16.056
  584   HD21  LEU  75          HD21      LEU  75   9.577  14.532 -16.506
  585   HD22  LEU  75          HD22      LEU  75   9.910  12.800 -16.768
  586   HD23  LEU  75          HD23      LEU  75   8.980  13.708 -17.966
  587    H    ARG  76           H        ARG  76   7.289  12.092 -12.393
  588    HA   ARG  76           HA       ARG  76   6.854  12.080 -10.265
  589    HB2  ARG  76           HB2      ARG  76   8.174  11.309  -8.543
  590    HB3  ARG  76           HB3      ARG  76   8.506  10.322  -9.941
  591    HG2  ARG  76           HG2      ARG  76  10.435  12.574  -9.519
  592    HG3  ARG  76           HG3      ARG  76  10.373  11.387  -8.217
  593    HD2  ARG  76           HD2      ARG  76  10.873   9.555  -9.699
  594    HD3  ARG  76           HD3      ARG  76  10.686  10.586 -11.113
  595    HE   ARG  76           HE       ARG  76  12.804  11.128  -9.086
  596   HH11  ARG  76          HH11      ARG  76  11.978  10.368 -12.491
  597   HH12  ARG  76          HH12      ARG  76  13.596  10.514 -13.052
  598   HH21  ARG  76          HH21      ARG  76  14.956  11.358  -9.867
  599   HH22  ARG  76          HH22      ARG  76  15.321  11.114 -11.534
  600    H    TYR  77           H        TYR  77   6.625  13.441  -8.444
  601    HA   TYR  77           HA       TYR  77   8.351  15.764  -8.303
  602    HB2  TYR  77           HB2      TYR  77   6.578  17.442  -8.323
  603    HB3  TYR  77           HB3      TYR  77   6.743  16.636  -9.859
  604    HD1  TYR  77           HD2      TYR  77   4.677  16.461  -6.690
  605    HD2  TYR  77           HD1      TYR  77   4.761  15.989 -10.979
  606    HE1  TYR  77           HE2      TYR  77   2.255  16.088  -6.703
  607    HE2  TYR  77           HE1      TYR  77   2.349  15.623 -11.007
  608    HH   TYR  77           HH       TYR  77   0.370  15.486  -9.715
  609    H    LYS  78           H        LYS  78   7.941  16.958  -6.295
  610    HA   LYS  78           HA       LYS  78   7.175  15.030  -4.153
  611    HB2  LYS  78           HB2      LYS  78   9.630  15.628  -4.629
  612    HB3  LYS  78           HB3      LYS  78   9.284  17.236  -4.013
  613    HG2  LYS  78           HG2      LYS  78   8.931  14.631  -2.449
  614    HG3  LYS  78           HG3      LYS  78  10.386  15.629  -2.443
  615    HD2  LYS  78           HD2      LYS  78   8.897  17.573  -1.618
  616    HD3  LYS  78           HD3      LYS  78   7.651  16.347  -1.365
  617    HE2  LYS  78           HE2      LYS  78   8.677  16.649   0.736
  618    HE3  LYS  78           HE3      LYS  78   9.228  15.083   0.134
  619    HZ1  LYS  78           HZ1      LYS  78  11.348  16.149  -0.481
  620    HZ2  LYS  78           HZ2      LYS  78  10.812  17.609   0.040
  621    HZ3  LYS  78           HZ3      LYS  78  11.037  16.396   1.099
  622    H    LEU  79           H        LEU  79   5.704  15.788  -2.676
  623    HA   LEU  79           HA       LEU  79   4.099  18.066  -3.483
  624    HB2  LEU  79           HB2      LEU  79   3.967  16.188  -1.085
  625    HB3  LEU  79           HB3      LEU  79   2.747  17.410  -1.427
  626    HG   LEU  79           HG       LEU  79   3.412  15.096  -3.294
  627   HD11  LEU  79          HD11      LEU  79   2.438  14.269  -1.179
  628   HD12  LEU  79          HD12      LEU  79   1.063  15.394  -1.376
  629   HD13  LEU  79          HD13      LEU  79   1.320  14.069  -2.536
  630   HD21  LEU  79          HD21      LEU  79   1.247  15.691  -4.364
  631   HD22  LEU  79          HD22      LEU  79   1.112  17.100  -3.289
  632   HD23  LEU  79          HD23      LEU  79   2.425  17.003  -4.492
  633    HA   PRO  80           HA       PRO  80   6.038  21.013  -0.619
  634    HB2  PRO  80           HB2      PRO  80   4.061  22.884  -0.385
  635    HB3  PRO  80           HB3      PRO  80   4.974  22.669  -1.912
  636    HG2  PRO  80           HG2      PRO  80   2.318  21.383  -1.165
  637    HG3  PRO  80           HG3      PRO  80   2.678  22.385  -2.638
  638    HD2  PRO  80           HD2      PRO  80   2.783  19.699  -2.742
  639    HD3  PRO  80           HD3      PRO  80   4.067  20.668  -3.534
  640    H    LYS  81           H        LYS  81   5.807  21.513   1.687
  641    HA   LYS  81           HA       LYS  81   4.871  19.306   3.095
  642    HB2  LYS  81           HB2      LYS  81   5.516  22.121   4.084
  643    HB3  LYS  81           HB3      LYS  81   5.264  20.767   5.177
  644    HG2  LYS  81           HG2      LYS  81   7.398  20.806   2.998
  645    HG3  LYS  81           HG3      LYS  81   7.682  21.338   4.643
  646    HD2  LYS  81           HD2      LYS  81   6.787  18.525   3.864
  647    HD3  LYS  81           HD3      LYS  81   8.456  18.997   4.137
  648    HE2  LYS  81           HE2      LYS  81   6.249  19.150   6.257
  649    HE3  LYS  81           HE3      LYS  81   7.388  17.817   6.069
  650    HZ1  LYS  81           HZ1      LYS  81   8.146  19.323   7.766
  651    HZ2  LYS  81           HZ2      LYS  81   9.206  19.365   6.531
  652    HZ3  LYS  81           HZ3      LYS  81   8.151  20.603   6.758
  653    H    ARG  82           H        ARG  82   3.104  22.263   2.488
  654    HA   ARG  82           HA       ARG  82   0.974  21.729   4.325
  655    HB2  ARG  82           HB2      ARG  82  -0.157  23.595   3.258
  656    HB3  ARG  82           HB3      ARG  82   1.536  23.963   3.523
  657    HG2  ARG  82           HG2      ARG  82   1.710  23.063   0.934
  658    HG3  ARG  82           HG3      ARG  82   0.019  23.542   0.954
  659    HD2  ARG  82           HD2      ARG  82   1.308  25.395   0.152
  660    HD3  ARG  82           HD3      ARG  82   0.724  25.812   1.775
  661    HE   ARG  82           HE       ARG  82   3.339  24.614   1.948
  662   HH11  ARG  82          HH21      ARG  82   1.794  27.638   0.887
  663   HH12  ARG  82          HH22      ARG  82   3.180  28.621   1.187
  664   HH21  ARG  82          HH11      ARG  82   5.196  25.936   2.362
  665   HH22  ARG  82          HH12      ARG  82   5.147  27.631   2.038
  666    H    LEU  83           H        LEU  83   1.638  20.455   1.129
  667    HA   LEU  83           HA       LEU  83  -1.169  19.529   0.890
  668    HB2  LEU  83           HB2      LEU  83  -0.081  20.937  -0.935
  669    HB3  LEU  83           HB3      LEU  83   0.948  19.536  -1.267
  670    HG   LEU  83           HG       LEU  83  -1.047  18.191  -1.858
  671   HD11  LEU  83          HD11      LEU  83  -2.811  19.175  -0.467
  672   HD12  LEU  83          HD12      LEU  83  -2.603  20.755  -1.257
  673   HD13  LEU  83          HD13      LEU  83  -3.253  19.367  -2.158
  674   HD21  LEU  83          HD21      LEU  83  -0.965  20.897  -3.254
  675   HD22  LEU  83          HD22      LEU  83   0.132  19.534  -3.558
  676   HD23  LEU  83          HD23      LEU  83  -1.595  19.378  -3.933
  677    H    VAL  84           H        VAL  84   2.078  18.367   1.521
  678    HA   VAL  84           HA       VAL  84   1.912  15.656   0.967
  679    HB   VAL  84           HB       VAL  84   2.932  17.004   3.501
  680   HG11  VAL  84          HG11      VAL  84   2.486  14.602   4.026
  681   HG12  VAL  84          HG12      VAL  84   3.422  14.117   2.604
  682   HG13  VAL  84          HG13      VAL  84   4.212  14.939   3.964
  683   HG21  VAL  84          HG21      VAL  84   4.463  15.800   1.149
  684   HG22  VAL  84          HG22      VAL  84   4.144  17.527   1.340
  685   HG23  VAL  84          HG23      VAL  84   5.142  16.686   2.529
  686    H    ARG  85           H        ARG  85   0.812  13.963   1.723
  687    HA   ARG  85           HA       ARG  85  -1.855  14.640   2.549
  688    HB2  ARG  85           HB2      ARG  85  -0.775  11.812   2.323
  689    HB3  ARG  85           HB3      ARG  85  -2.434  12.353   2.109
  690    HG2  ARG  85           HG2      ARG  85  -0.069  12.731   0.224
  691    HG3  ARG  85           HG3      ARG  85  -1.525  11.779  -0.044
  692    HD2  ARG  85           HD2      ARG  85  -1.301  14.803   0.057
  693    HD3  ARG  85           HD3      ARG  85  -1.573  13.814  -1.369
  694    HE   ARG  85           HE       ARG  85  -3.707  13.053  -0.306
  695   HH11  ARG  85          HH11      ARG  85  -2.386  16.316   0.419
  696   HH12  ARG  85          HH12      ARG  85  -3.931  16.964   0.861
  697   HH21  ARG  85          HH21      ARG  85  -5.742  13.970   0.273
  698   HH22  ARG  85          HH22      ARG  85  -5.866  15.625   0.736
  699    H    TRP  86           H        TRP  86   0.630  12.783   4.203
  700    HA   TRP  86           HA       TRP  86   0.908  11.865   6.200
  701    HB2  TRP  86           HB2      TRP  86  -0.918  13.963   7.326
  702    HB3  TRP  86           HB3      TRP  86   0.308  13.041   8.187
  703    HD1  TRP  86           HD1      TRP  86  -0.122  15.901   5.768
  704    HE1  TRP  86           HE1      TRP  86   2.019  17.269   5.562
  705    HE3  TRP  86           HE3      TRP  86   2.997  12.844   8.418
  706    HZ2  TRP  86           HZ2      TRP  86   4.787  17.043   6.418
  707    HZ3  TRP  86           HZ3      TRP  86   5.402  13.408   8.654
  708    HH2  TRP  86           HH2      TRP  86   6.307  15.504   7.666
  709    H    ASP  87           H        ASP  87  -1.906  11.504   4.673
  710    HA   ASP  87           HA       ASP  87  -3.323   9.965   6.785
  711    HB2  ASP  87           HB2      ASP  87  -4.607  11.512   5.383
  712    HB3  ASP  87           HB3      ASP  87  -4.094  10.652   3.931
  713    H    THR  88           H        THR  88  -1.203   9.429   4.049
  714    HA   THR  88           HA       THR  88  -2.038   6.700   3.563
  715    HB   THR  88           HB       THR  88   0.008   7.149   1.871
  716    HG1  THR  88           HG1      THR  88  -0.899   9.735   1.758
  717   HG21  THR  88          HG21      THR  88  -1.641   8.143   0.299
  718   HG22  THR  88          HG22      THR  88  -2.358   6.806   1.221
  719   HG23  THR  88          HG23      THR  88  -2.728   8.488   1.668
  720    H    LYS  89           H        LYS  89  -0.434   4.967   3.559
  721    HA   LYS  89           HA       LYS  89   1.793   5.296   5.514
  722    HB2  LYS  89           HB2      LYS  89  -0.213   2.999   5.465
  723    HB3  LYS  89           HB3      LYS  89   1.259   3.095   6.429
  724    HG2  LYS  89           HG2      LYS  89  -0.160   3.870   8.013
  725    HG3  LYS  89           HG3      LYS  89   0.186   5.416   7.223
  726    HD2  LYS  89           HD2      LYS  89  -1.917   5.186   5.904
  727    HD3  LYS  89           HD3      LYS  89  -2.247   3.647   6.716
  728    HE2  LYS  89           HE2      LYS  89  -2.374   4.765   8.892
  729    HE3  LYS  89           HE3      LYS  89  -1.839   6.294   8.177
  730    HZ1  LYS  89           HZ1      LYS  89  -4.253   6.210   8.508
  731    HZ2  LYS  89           HZ2      LYS  89  -3.876   6.398   6.922
  732    HZ3  LYS  89           HZ3      LYS  89  -4.392   4.940   7.492
  733    HA   PRO  90           HA       PRO  90   3.976   5.301   5.269
  734    HB2  PRO  90           HB2      PRO  90   5.853   6.134   3.424
  735    HB3  PRO  90           HB3      PRO  90   5.990   4.629   4.379
  736    HG2  PRO  90           HG2      PRO  90   4.913   4.943   1.557
  737    HG3  PRO  90           HG3      PRO  90   6.141   3.775   2.147
  738    HD2  PRO  90           HD2      PRO  90   3.565   3.019   1.914
  739    HD3  PRO  90           HD3      PRO  90   4.501   2.524   3.348
  740    H    VAL  91           H        VAL  91   4.121   7.678   5.191
  741    HA   VAL  91           HA       VAL  91   1.891   8.904   4.021
  742    HB   VAL  91           HB       VAL  91   2.838  11.017   4.809
  743   HG11  VAL  91          HG11      VAL  91   1.528   9.574   6.321
  744   HG12  VAL  91          HG12      VAL  91   3.021   8.811   6.901
  745   HG13  VAL  91          HG13      VAL  91   2.732  10.534   7.199
  746   HG21  VAL  91          HG21      VAL  91   5.256  10.678   4.514
  747   HG22  VAL  91          HG22      VAL  91   4.862  11.147   6.164
  748   HG23  VAL  91          HG23      VAL  91   5.259   9.455   5.805
  749    H    CYS  92           H        CYS  92   1.557   9.799   2.187
  750    HA   CYS  92           HA       CYS  92   3.459   9.385   0.077
  751    HB2  CYS  92           HB2      CYS  92   1.161   8.926  -0.227
  752    HB3  CYS  92           HB3      CYS  92   0.692  10.565   0.251
  753    HG   CYS  92           HG       CYS  92   0.335  10.399  -2.331
  754    H    ILE  93           H        ILE  93   5.050  10.715  -0.347
  755    HA   ILE  93           HA       ILE  93   4.830  13.618   0.271
  756    HB   ILE  93           HB       ILE  93   7.297  13.592   0.430
  757   HG12  ILE  93          HG12      ILE  93   7.052  10.553   0.266
  758   HG13  ILE  93          HG13      ILE  93   7.730  11.587  -0.992
  759   HG21  ILE  93          HG21      ILE  93   5.976  11.626   2.342
  760   HG22  ILE  93          HG22      ILE  93   7.379  12.667   2.668
  761   HG23  ILE  93          HG23      ILE  93   5.798  13.396   2.419
  762   HD11  ILE  93          HD11      ILE  93   9.533  10.606   0.244
  763   HD12  ILE  93          HD12      ILE  93   9.488  12.331   0.654
  764   HD13  ILE  93          HD13      ILE  93   8.854  11.120   1.797
  765    H    GLY  94           H        GLY  94   4.625  11.569  -2.426
  766    HA2  GLY  94           HA2      GLY  94   5.023  13.824  -4.178
  767    HA3  GLY  94           HA3      GLY  94   6.332  12.647  -4.302
  768    H    GLN  95           H        GLN  95   4.636  13.216  -6.449
  769    HA   GLN  95           HA       GLN  95   2.804  10.842  -6.623
  770    HB2  GLN  95           HB2      GLN  95   2.157  13.453  -7.019
  771    HB3  GLN  95           HB3      GLN  95   2.782  13.110  -8.614
  772    HG2  GLN  95           HG2      GLN  95   0.447  12.812  -8.773
  773    HG3  GLN  95           HG3      GLN  95   1.073  11.189  -8.738
  774   HE21  GLN  95          HE22      GLN  95  -0.255  13.787  -6.540
  775   HE22  GLN  95          HE21      GLN  95  -1.017  12.673  -5.423
  776    H    LYS  96           H        LYS  96   4.088   9.177  -7.490
  777    HA   LYS  96           HA       LYS  96   6.267   9.809  -9.425
  778    HB2  LYS  96           HB2      LYS  96   6.871   8.024  -7.999
  779    HB3  LYS  96           HB3      LYS  96   5.281   7.279  -8.051
  780    HG2  LYS  96           HG2      LYS  96   5.677   6.593 -10.431
  781    HG3  LYS  96           HG3      LYS  96   7.251   7.404 -10.395
  782    HD2  LYS  96           HD2      LYS  96   8.035   5.854  -8.672
  783    HD3  LYS  96           HD3      LYS  96   6.434   5.077  -8.603
  784    HE2  LYS  96           HE2      LYS  96   6.653   4.385 -10.992
  785    HE3  LYS  96           HE3      LYS  96   8.212   5.204 -11.091
  786    HZ1  LYS  96           HZ1      LYS  96   9.092   3.636  -9.447
  787    HZ2  LYS  96           HZ2      LYS  96   7.650   2.857  -9.352
  788    HZ3  LYS  96           HZ3      LYS  96   8.500   2.835 -10.742
  789    H    GLN  97           H        GLN  97   5.746   9.881 -11.655
  790    HA   GLN  97           HA       GLN  97   3.372   8.460 -12.504
  791    HB2  GLN  97           HB2      GLN  97   2.775  10.811 -13.810
  792    HB3  GLN  97           HB3      GLN  97   1.911  10.079 -12.492
  793    HG2  GLN  97           HG2      GLN  97   2.135  12.381 -12.006
  794    HG3  GLN  97           HG3      GLN  97   3.113  11.500 -10.854
  795   HE21  GLN  97          HE22      GLN  97   4.659  13.134 -10.364
  796   HE22  GLN  97          HE21      GLN  97   5.600  13.943 -11.614
  797    H    LYS  98           H        LYS  98   3.274   7.919 -14.579
  798    HA   LYS  98           HA       LYS  98   5.375   8.905 -16.443
  799    HB2  LYS  98           HB2      LYS  98   5.916   6.590 -15.847
  800    HB3  LYS  98           HB3      LYS  98   4.257   6.067 -16.188
  801    HG2  LYS  98           HG2      LYS  98   4.609   6.597 -18.598
  802    HG3  LYS  98           HG3      LYS  98   6.257   7.143 -18.219
  803    HD2  LYS  98           HD2      LYS  98   6.758   4.873 -17.284
  804    HD3  LYS  98           HD3      LYS  98   5.143   4.344 -17.816
  805    HE2  LYS  98           HE2      LYS  98   5.719   4.817 -20.160
  806    HE3  LYS  98           HE3      LYS  98   7.260   5.534 -19.673
  807    HZ1  LYS  98           HZ1      LYS  98   7.977   3.334 -18.899
  808    HZ2  LYS  98           HZ2      LYS  98   6.558   2.656 -19.365
  809    HZ3  LYS  98           HZ3      LYS  98   7.574   3.283 -20.480
  810    H    TRP  99           H        TRP  99   4.438   9.587 -18.377
  811    HA   TRP  99           HA       TRP  99   1.461   9.642 -18.351
  812    HB2  TRP  99           HB2      TRP  99   3.483  11.644 -19.380
  813    HB3  TRP  99           HB3      TRP  99   1.748  11.738 -19.634
  814    HD1  TRP  99           HD1      TRP  99   4.249  11.786 -16.656
  815    HE1  TRP  99           HE1      TRP  99   3.321  13.295 -14.853
  816    HE3  TRP  99           HE3      TRP  99  -0.367  12.664 -18.660
  817    HZ2  TRP  99           HZ2      TRP  99   0.871  14.879 -14.405
  818    HZ3  TRP  99           HZ3      TRP  99  -1.988  14.120 -17.531
  819    HH2  TRP  99           HH2      TRP  99  -1.405  15.203 -15.372
  820    H    PHE 100           H        PHE 100   0.392   9.289 -20.310
  821    HA   PHE 100           HA       PHE 100   2.058   8.093 -22.491
  822    HB2  PHE 100           HB2      PHE 100  -0.598   7.146 -21.364
  823    HB3  PHE 100           HB3      PHE 100   0.027   6.659 -22.930
  824    HD1  PHE 100           HD1      PHE 100   0.873   6.554 -19.257
  825    HD2  PHE 100           HD2      PHE 100   1.561   4.895 -23.182
  826    HE1  PHE 100           HE1      PHE 100   2.146   4.683 -18.251
  827    HE2  PHE 100           HE2      PHE 100   2.828   3.031 -22.173
  828    HZ   PHE 100           HZ       PHE 100   3.120   2.908 -19.705
  829    H    LEU 101           H        LEU 101   1.816   9.097 -24.371
  830    HA   LEU 101           HA       LEU 101  -0.186  11.228 -24.735
  831    HB2  LEU 101           HB2      LEU 101   2.059  11.668 -25.551
  832    HB3  LEU 101           HB3      LEU 101   2.093  10.118 -26.400
  833    HG   LEU 101           HG       LEU 101   0.325  10.879 -27.938
  834   HD11  LEU 101          HD11      LEU 101  -0.910  12.455 -26.565
  835   HD12  LEU 101          HD12      LEU 101   0.525  13.504 -26.404
  836   HD13  LEU 101          HD13      LEU 101  -0.270  13.295 -27.979
  837   HD21  LEU 101          HD21      LEU 101   2.670  11.203 -28.557
  838   HD22  LEU 101          HD22      LEU 101   1.663  12.505 -29.200
  839   HD23  LEU 101          HD23      LEU 101   2.682  12.797 -27.770
  840    H    LEU 102           H        LEU 102  -2.163  10.466 -25.163
  841    HA   LEU 102           HA       LEU 102  -2.472   8.112 -26.942
  842    HB2  LEU 102           HB2      LEU 102  -4.207   9.458 -24.834
  843    HB3  LEU 102           HB3      LEU 102  -4.964   8.558 -26.130
  844    HG   LEU 102           HG       LEU 102  -4.833   7.115 -24.274
  845   HD11  LEU 102          HD11      LEU 102  -3.844   5.223 -25.277
  846   HD12  LEU 102          HD12      LEU 102  -4.038   6.318 -26.684
  847   HD13  LEU 102          HD13      LEU 102  -2.479   6.164 -25.903
  848   HD21  LEU 102          HD21      LEU 102  -2.763   6.505 -23.128
  849   HD22  LEU 102          HD22      LEU 102  -1.826   7.591 -24.161
  850   HD23  LEU 102          HD23      LEU 102  -3.013   8.255 -23.020
  851    H    GLN 103           H        GLN 103  -3.182   8.331 -28.922
  852    HA   GLN 103           HA       GLN 103  -4.205  10.997 -29.802
  853    HB2  GLN 103           HB2      GLN 103  -3.301   8.503 -31.312
  854    HB3  GLN 103           HB3      GLN 103  -4.263   9.760 -32.090
  855    HG2  GLN 103           HG2      GLN 103  -1.574  10.207 -30.732
  856    HG3  GLN 103           HG3      GLN 103  -1.830  10.075 -32.477
  857   HE21  GLN 103          HE22      GLN 103  -0.882  12.374 -30.562
  858   HE22  GLN 103          HE21      GLN 103  -1.913  13.713 -31.096
  859    H    LEU 104           H        LEU 104  -6.350  11.234 -30.343
  860    HA   LEU 104           HA       LEU 104  -8.194   9.384 -29.142
  861    HB2  LEU 104           HB2      LEU 104  -8.306  11.954 -29.426
  862    HB3  LEU 104           HB3      LEU 104  -8.780  11.655 -31.096
  863    HG   LEU 104           HG       LEU 104 -10.832  10.486 -30.285
  864   HD11  LEU 104          HD11      LEU 104  -9.665  11.156 -27.534
  865   HD12  LEU 104          HD12      LEU 104 -11.377  10.791 -27.776
  866   HD13  LEU 104          HD13      LEU 104 -10.180   9.560 -28.140
  867   HD21  LEU 104          HD21      LEU 104 -10.800  12.945 -30.726
  868   HD22  LEU 104          HD22      LEU 104 -11.932  12.547 -29.425
  869   HD23  LEU 104          HD23      LEU 104 -10.349  13.240 -29.030
  870    H    VAL 105           H        VAL 105  -9.408   7.727 -30.147
  871    HA   VAL 105           HA       VAL 105  -9.170   7.420 -33.118
  872    HB   VAL 105           HB       VAL 105  -9.249   5.223 -31.013
  873   HG11  VAL 105          HG11      VAL 105  -9.162   4.987 -34.030
  874   HG12  VAL 105          HG12      VAL 105  -8.954   3.653 -32.864
  875   HG13  VAL 105          HG13      VAL 105 -10.491   4.502 -32.945
  876   HG21  VAL 105          HG21      VAL 105  -6.993   6.278 -31.177
  877   HG22  VAL 105          HG22      VAL 105  -7.023   4.615 -31.760
  878   HG23  VAL 105          HG23      VAL 105  -7.003   5.957 -32.924
  879    H    SER 106           H        SER 106 -11.129   6.941 -30.134
  880    HA   SER 106           HA       SER 106 -13.539   7.678 -31.702
  881    HB2  SER 106           HB2      SER 106 -13.460   5.490 -29.587
  882    HB3  SER 106           HB3      SER 106 -14.860   5.991 -30.553
  883    HG   SER 106           HG       SER 106 -13.857   5.122 -32.397
  884    H    GLY 107           H        GLY 107 -14.727   9.263 -30.555
  885    HA2  GLY 107           HA2      GLY 107 -14.325   9.729 -27.724
  886    HA3  GLY 107           HA3      GLY 107 -13.311  10.772 -28.734
  887    H    ASP 108           H        ASP 108 -14.832  12.071 -27.228
  888    HA   ASP 108           HA       ASP 108 -16.305  13.596 -26.803
  889    HB2  ASP 108           HB2      ASP 108 -15.621  14.586 -28.907
  890    HB3  ASP 108           HB3      ASP 108 -16.890  13.698 -29.761
  891    H    ALA 109           H        ALA 109 -17.757  11.290 -29.079
  892    HA   ALA 109           HA       ALA 109 -20.328  11.346 -27.641
  893    HB1  ALA 109           HB1      ALA 109 -19.395   9.651 -29.998
  894    HB2  ALA 109           HB2      ALA 109 -21.042   9.721 -29.350
  895    HB3  ALA 109           HB3      ALA 109 -20.333  11.165 -30.101
  896    H    GLU 110           H        GLU 110 -17.437   9.276 -27.938
  897    HA   GLU 110           HA       GLU 110 -18.656   7.160 -26.334
  898    HB2  GLU 110           HB2      GLU 110 -15.869   7.401 -27.531
  899    HB3  GLU 110           HB3      GLU 110 -16.521   5.977 -26.721
  900    HG2  GLU 110           HG2      GLU 110 -17.474   7.199 -29.339
  901    HG3  GLU 110           HG3      GLU 110 -16.649   5.661 -29.118
  902    H    ILE 111           H        ILE 111 -16.675   9.958 -25.814
  903    HA   ILE 111           HA       ILE 111 -15.508   9.143 -23.266
  904    HB   ILE 111           HB       ILE 111 -15.764  11.706 -24.830
  905   HG12  ILE 111          HG12      ILE 111 -13.459  10.058 -23.847
  906   HG13  ILE 111          HG13      ILE 111 -13.984  10.314 -25.503
  907   HG21  ILE 111          HG21      ILE 111 -16.230  12.366 -22.489
  908   HG22  ILE 111          HG22      ILE 111 -14.713  11.576 -21.979
  909   HG23  ILE 111          HG23      ILE 111 -14.712  13.003 -23.052
  910   HD11  ILE 111          HD11      ILE 111 -13.365  12.757 -25.243
  911   HD12  ILE 111          HD12      ILE 111 -12.592  12.324 -23.693
  912   HD13  ILE 111          HD13      ILE 111 -12.008  11.608 -25.195
  913    H    ASN 112           H        ASN 112 -16.427   9.466 -21.259
  914    HA   ASN 112           HA       ASN 112 -19.231  10.516 -21.143
  915    HB2  ASN 112           HB2      ASN 112 -19.305   8.033 -21.392
  916    HB3  ASN 112           HB3      ASN 112 -18.306   7.868 -19.943
  917   HD21  ASN 112          HD22      ASN 112 -19.926   6.769 -18.674
  918   HD22  ASN 112          HD21      ASN 112 -21.401   7.558 -18.185
  919    H    MET 113           H        MET 113 -16.237   9.648 -19.367
  920    HA   MET 113           HA       MET 113 -15.367  10.311 -17.429
  921    HB2  MET 113           HB2      MET 113 -16.807  12.936 -17.963
  922    HB3  MET 113           HB3      MET 113 -15.426  12.674 -16.890
  923    HG2  MET 113           HG2      MET 113 -14.177  11.778 -18.891
  924    HG3  MET 113           HG3      MET 113 -15.479  12.413 -19.902
  925    HE1  MET 113           HE1      MET 113 -12.204  14.741 -20.291
  926    HE2  MET 113           HE2      MET 113 -12.188  13.035 -19.801
  927    HE3  MET 113           HE3      MET 113 -13.249  13.567 -21.134
  928    H    GLN 114           H        GLN 114 -18.291   9.171 -17.234
  929    HA   GLN 114           HA       GLN 114 -18.436   9.699 -14.324
  930    HB2  GLN 114           HB2      GLN 114 -20.825   9.627 -16.227
  931    HB3  GLN 114           HB3      GLN 114 -20.921   9.710 -14.463
  932    HG2  GLN 114           HG2      GLN 114 -19.667  11.894 -14.535
  933    HG3  GLN 114           HG3      GLN 114 -19.748  11.844 -16.297
  934   HE21  GLN 114          HE22      GLN 114 -21.817  11.804 -13.352
  935   HE22  GLN 114          HE21      GLN 114 -23.196  12.579 -14.100
  936    H    THR 115           H        THR 115 -17.198   7.560 -15.889
  937    HA   THR 115           HA       THR 115 -18.756   5.166 -15.614
  938    HB   THR 115           HB       THR 115 -16.143   4.391 -15.905
  939    HG1  THR 115           HG1      THR 115 -14.911   5.998 -16.605
  940   HG21  THR 115          HG21      THR 115 -16.525   4.388 -18.308
  941   HG22  THR 115          HG22      THR 115 -18.058   4.018 -17.516
  942   HG23  THR 115          HG23      THR 115 -17.767   5.655 -18.157
  943    H    SER 116           H        SER 116 -16.528   6.994 -13.578
  944    HA   SER 116           HA       SER 116 -15.901   4.847 -11.786
  945    HB2  SER 116           HB2      SER 116 -14.969   7.208 -10.708
  946    HB3  SER 116           HB3      SER 116 -14.109   6.199 -11.889
  947    HG   SER 116           HG       SER 116 -14.164   7.930 -13.105
  948    H    SER 117           H        SER 117 -18.568   6.832 -11.944
  949    HA   SER 117           HA       SER 117 -20.319   7.355 -10.675
  950    HB2  SER 117           HB2      SER 117 -19.209   5.600  -8.468
  951    HB3  SER 117           HB3      SER 117 -20.869   6.192  -8.644
  952    HG   SER 117           HG       SER 117 -20.609   4.029  -9.436
  953    H    THR 118           H        THR 118 -17.230   7.631  -8.892
  954    HA   THR 118           HA       THR 118 -17.953  10.442  -8.227
  955    HB   THR 118           HB       THR 118 -16.308  10.117  -6.295
  956    HG1  THR 118           HG1      THR 118 -15.486   8.067  -6.764
  957   HG21  THR 118          HG21      THR 118 -18.977   8.635  -6.218
  958   HG22  THR 118          HG22      THR 118 -18.072   9.247  -4.813
  959   HG23  THR 118          HG23      THR 118 -18.747  10.380  -5.993
  960    HA   PRO 119           HA       PRO 119 -14.541   9.895 -11.320
  961    HB2  PRO 119           HB2      PRO 119 -15.345  11.688 -13.202
  962    HB3  PRO 119           HB3      PRO 119 -16.185  10.129 -12.999
  963    HG2  PRO 119           HG2      PRO 119 -16.969  12.800 -11.787
  964    HG3  PRO 119           HG3      PRO 119 -17.990  11.702 -12.773
  965    HD2  PRO 119           HD2      PRO 119 -18.045  11.612 -10.071
  966    HD3  PRO 119           HD3      PRO 119 -18.124  10.109 -11.042
  967    H    GLU 120           H        GLU 120 -13.201  11.841 -12.475
  968    HA   GLU 120           HA       GLU 120 -12.821  13.994 -10.431
  969    HB2  GLU 120           HB2      GLU 120 -10.819  12.888 -12.429
  970    HB3  GLU 120           HB3      GLU 120 -10.585  14.304 -11.388
  971    HG2  GLU 120           HG2      GLU 120 -11.375  12.537  -9.490
  972    HG3  GLU 120           HG3      GLU 120 -10.644  11.406 -10.633
  973    H    PHE 121           H        PHE 121 -14.273  13.505 -13.493
  974    HA   PHE 121           HA       PHE 121 -13.830  16.371 -14.140
  975    HB2  PHE 121           HB2      PHE 121 -13.675  14.027 -16.040
  976    HB3  PHE 121           HB3      PHE 121 -13.714  15.718 -16.518
  977    HD1  PHE 121           HD1      PHE 121 -11.897  17.249 -15.126
  978    HD2  PHE 121           HD2      PHE 121 -11.524  13.057 -16.076
  979    HE1  PHE 121           HE1      PHE 121  -9.440  17.434 -14.980
  980    HE2  PHE 121           HE2      PHE 121  -9.051  13.247 -15.891
  981    HZ   PHE 121           HZ       PHE 121  -8.007  15.438 -15.352
  982    H    ASP 122           H        ASP 122 -15.376  17.408 -15.311
  983    HA   ASP 122           HA       ASP 122 -18.148  16.291 -15.079
  984    HB2  ASP 122           HB2      ASP 122 -17.744  17.914 -13.389
  985    HB3  ASP 122           HB3      ASP 122 -16.957  19.016 -14.518
  986    H    GLY 123           H        GLY 123 -15.898  18.188 -17.148
  987    HA2  GLY 123           HA2      GLY 123 -17.428  17.555 -19.500
  988    HA3  GLY 123           HA3      GLY 123 -17.560  19.276 -19.069
  989    H    TRP 124           H        TRP 124 -16.244  17.965 -21.372
  990    HA   TRP 124           HA       TRP 124 -13.383  18.603 -20.897
  991    HB2  TRP 124           HB2      TRP 124 -13.002  17.048 -22.792
  992    HB3  TRP 124           HB3      TRP 124 -13.680  16.299 -21.360
  993    HD1  TRP 124           HD1      TRP 124 -14.436  16.989 -25.010
  994    HE1  TRP 124           HE1      TRP 124 -16.621  15.881 -25.733
  995    HE3  TRP 124           HE3      TRP 124 -16.085  15.423 -20.420
  996    HZ2  TRP 124           HZ2      TRP 124 -18.777  14.388 -24.468
  997    HZ3  TRP 124           HZ3      TRP 124 -18.196  14.153 -20.210
  998    HH2  TRP 124           HH2      TRP 124 -19.553  13.630 -22.231
  999    H    ARG 125           H        ARG 125 -12.264  19.796 -22.387
 1000    HA   ARG 125           HA       ARG 125 -13.484  20.633 -24.914
 1001    HB2  ARG 125           HB2      ARG 125 -14.277  22.386 -23.315
 1002    HB3  ARG 125           HB3      ARG 125 -12.605  22.730 -22.861
 1003    HG2  ARG 125           HG2      ARG 125 -12.115  23.458 -25.180
 1004    HG3  ARG 125           HG3      ARG 125 -13.773  23.045 -25.662
 1005    HD2  ARG 125           HD2      ARG 125 -14.648  24.725 -24.064
 1006    HD3  ARG 125           HD3      ARG 125 -12.986  25.127 -23.574
 1007    HE   ARG 125           HE       ARG 125 -13.172  25.399 -26.387
 1008   HH11  ARG 125          HH21      ARG 125 -14.445  27.021 -23.489
 1009   HH12  ARG 125          HH22      ARG 125 -14.592  28.568 -24.249
 1010   HH21  ARG 125          HH11      ARG 125 -13.385  27.459 -27.405
 1011   HH22  ARG 125          HH12      ARG 125 -13.976  28.816 -26.518
 1012    H    TRP 126           H        TRP 126 -11.795  20.553 -26.478
 1013    HA   TRP 126           HA       TRP 126  -9.092  20.138 -25.451
 1014    HB2  TRP 126           HB2      TRP 126  -9.918  20.305 -28.344
 1015    HB3  TRP 126           HB3      TRP 126  -8.527  19.476 -27.644
 1016    HD1  TRP 126           HD1      TRP 126 -11.340  18.472 -29.364
 1017    HE1  TRP 126           HE1      TRP 126 -12.582  16.418 -28.533
 1018    HE3  TRP 126           HE3      TRP 126  -9.386  18.200 -24.642
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.758  14.851 -26.100
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.212  16.486 -23.043
 1021    HH2  TRP 126           HH2      TRP 126 -11.884  14.816 -23.750
 1022    H    VAL 127           H        VAL 127  -7.295  21.501 -25.779
 1023    HA   VAL 127           HA       VAL 127  -7.872  24.282 -26.621
 1024    HB   VAL 127           HB       VAL 127  -8.619  23.904 -24.263
 1025   HG11  VAL 127          HG11      VAL 127  -7.034  23.593 -22.462
 1026   HG12  VAL 127          HG12      VAL 127  -6.917  22.235 -23.583
 1027   HG13  VAL 127          HG13      VAL 127  -5.675  23.502 -23.608
 1028   HG21  VAL 127          HG21      VAL 127  -6.311  25.866 -24.393
 1029   HG22  VAL 127          HG22      VAL 127  -7.940  26.145 -25.053
 1030   HG23  VAL 127          HG23      VAL 127  -7.717  25.893 -23.318
 1031    H    SER 128           H        SER 128  -5.843  25.644 -26.563
 1032    HA   SER 128           HA       SER 128  -3.839  24.655 -28.106
 1033    HB2  SER 128           HB2      SER 128  -3.433  26.796 -25.986
 1034    HB3  SER 128           HB3      SER 128  -2.591  26.633 -27.535
 1035    HG   SER 128           HG       SER 128  -4.304  28.194 -27.654
 1036    H    TYR 129           H        TYR 129  -1.848  23.766 -27.843
 1037    HA   TYR 129           HA       TYR 129  -1.691  21.693 -26.115
 1038    HB2  TYR 129           HB2      TYR 129  -0.457  22.249 -28.290
 1039    HB3  TYR 129           HB3      TYR 129   0.808  22.955 -27.269
 1040    HD1  TYR 129           HD1      TYR 129   1.910  21.383 -25.503
 1041    HD2  TYR 129           HD2      TYR 129  -0.713  19.967 -28.638
 1042    HE1  TYR 129           HE1      TYR 129   2.522  19.032 -24.974
 1043    HE2  TYR 129           HE2      TYR 129  -0.133  17.644 -28.067
 1044    HH   TYR 129           HH       TYR 129   0.930  16.239 -26.576
 1045    H    TRP 130           H        TRP 130  -0.143  24.864 -25.526
 1046    HA   TRP 130           HA       TRP 130   1.069  23.800 -23.071
 1047    HB2  TRP 130           HB2      TRP 130   1.280  26.541 -24.351
 1048    HB3  TRP 130           HB3      TRP 130   2.279  25.914 -23.042
 1049    HD1  TRP 130           HD1      TRP 130   1.819  25.750 -26.796
 1050    HE1  TRP 130           HE1      TRP 130   3.614  24.343 -27.890
 1051    HE3  TRP 130           HE3      TRP 130   4.087  23.973 -22.562
 1052    HZ2  TRP 130           HZ2      TRP 130   5.843  22.642 -27.029
 1053    HZ3  TRP 130           HZ3      TRP 130   6.070  22.480 -22.732
 1054    HH2  TRP 130           HH2      TRP 130   6.922  21.775 -24.948
 1055    H    TYR 131           H        TYR 131  -1.956  25.239 -23.762
 1056    HA   TYR 131           HA       TYR 131  -2.078  27.274 -21.807
 1057    HB2  TYR 131           HB2      TYR 131  -3.668  27.219 -23.567
 1058    HB3  TYR 131           HB3      TYR 131  -4.238  25.619 -23.147
 1059    HD1  TYR 131           HD2      TYR 131  -4.330  29.196 -22.217
 1060    HD2  TYR 131           HD1      TYR 131  -5.791  25.240 -21.283
 1061    HE1  TYR 131           HE2      TYR 131  -6.099  30.186 -20.795
 1062    HE2  TYR 131           HE1      TYR 131  -7.565  26.219 -19.880
 1063    HH   TYR 131           HH       TYR 131  -8.556  28.193 -19.076
 1064    HA   PRO 132           HA       PRO 132  -3.951  24.073 -18.719
 1065    HB2  PRO 132           HB2      PRO 132  -2.412  21.624 -19.580
 1066    HB3  PRO 132           HB3      PRO 132  -3.991  21.737 -18.766
 1067    HG2  PRO 132           HG2      PRO 132  -3.929  21.266 -21.398
 1068    HG3  PRO 132           HG3      PRO 132  -5.042  22.548 -20.803
 1069    HD2  PRO 132           HD2      PRO 132  -2.239  22.903 -21.928
 1070    HD3  PRO 132           HD3      PRO 132  -3.743  23.735 -22.396
 1071    H    VAL 133           H        VAL 133  -0.567  24.197 -19.842
 1072    HA   VAL 133           HA       VAL 133   0.542  23.017 -17.523
 1073    HB   VAL 133           HB       VAL 133   1.442  23.572 -19.996
 1074   HG11  VAL 133          HG11      VAL 133   1.799  26.026 -19.585
 1075   HG12  VAL 133          HG12      VAL 133   2.992  25.596 -18.336
 1076   HG13  VAL 133          HG13      VAL 133   3.260  25.144 -20.030
 1077   HG21  VAL 133          HG21      VAL 133   2.339  21.913 -18.477
 1078   HG22  VAL 133          HG22      VAL 133   3.618  22.853 -19.258
 1079   HG23  VAL 133          HG23      VAL 133   3.199  23.182 -17.559
 1080    H    ARG 134           H        ARG 134  -0.271  26.405 -18.321
 1081    HA   ARG 134           HA       ARG 134   0.688  27.240 -15.662
 1082    HB2  ARG 134           HB2      ARG 134   1.121  28.672 -17.610
 1083    HB3  ARG 134           HB3      ARG 134  -0.603  28.803 -17.928
 1084    HG2  ARG 134           HG2      ARG 134   0.232  30.824 -16.936
 1085    HG3  ARG 134           HG3      ARG 134  -0.945  30.093 -15.872
 1086    HD2  ARG 134           HD2      ARG 134   2.080  29.887 -15.482
 1087    HD3  ARG 134           HD3      ARG 134   1.058  31.136 -14.762
 1088    HE   ARG 134           HE       ARG 134   0.041  28.512 -14.153
 1089   HH11  ARG 134          HH11      ARG 134   2.333  30.966 -12.969
 1090   HH12  ARG 134          HH12      ARG 134   2.340  30.319 -11.361
 1091   HH21  ARG 134          HH21      ARG 134   0.120  27.641 -12.101
 1092   HH22  ARG 134          HH22      ARG 134   1.026  28.473 -10.851
 1093    H    GLN 135           H        GLN 135  -2.351  26.045 -17.060
 1094    HA   GLN 135           HA       GLN 135  -3.990  27.444 -15.087
 1095    HB2  GLN 135           HB2      GLN 135  -4.588  24.843 -16.540
 1096    HB3  GLN 135           HB3      GLN 135  -5.714  25.810 -15.598
 1097    HG2  GLN 135           HG2      GLN 135  -4.773  26.186 -18.373
 1098    HG3  GLN 135           HG3      GLN 135  -6.326  26.531 -17.654
 1099   HE21  GLN 135          HE22      GLN 135  -3.454  27.905 -18.887
 1100   HE22  GLN 135          HE21      GLN 135  -3.707  29.550 -18.322
 1101    H    VAL 136           H        VAL 136  -2.001  24.545 -15.096
 1102    HA   VAL 136           HA       VAL 136  -2.889  23.535 -12.551
 1103    HB   VAL 136           HB       VAL 136  -0.643  23.037 -14.510
 1104   HG11  VAL 136          HG11      VAL 136   0.427  22.593 -12.371
 1105   HG12  VAL 136          HG12      VAL 136  -0.944  21.543 -11.880
 1106   HG13  VAL 136          HG13      VAL 136   0.108  21.086 -13.241
 1107   HG21  VAL 136          HG21      VAL 136  -3.003  21.401 -13.475
 1108   HG22  VAL 136          HG22      VAL 136  -2.832  22.162 -15.081
 1109   HG23  VAL 136          HG23      VAL 136  -1.792  20.805 -14.625
 1110    H    VAL 137           H        VAL 137  -1.665  23.490 -10.572
 1111    HA   VAL 137           HA       VAL 137  -0.937  26.088  -9.679
 1112    HB   VAL 137           HB       VAL 137  -0.388  24.999  -7.540
 1113   HG11  VAL 137          HG11      VAL 137  -2.999  23.988  -8.749
 1114   HG12  VAL 137          HG12      VAL 137  -2.634  24.235  -7.029
 1115   HG13  VAL 137          HG13      VAL 137  -2.712  25.627  -8.118
 1116   HG21  VAL 137          HG21      VAL 137  -0.756  22.607  -7.186
 1117   HG22  VAL 137          HG22      VAL 137  -1.049  22.349  -8.914
 1118   HG23  VAL 137          HG23      VAL 137   0.562  22.843  -8.339
 1119    H    SER 138           H        SER 138   1.051  26.923  -8.858
 1120    HA   SER 138           HA       SER 138   2.967  26.865 -10.843
 1121    HB2  SER 138           HB2      SER 138   3.250  27.834  -7.984
 1122    HB3  SER 138           HB3      SER 138   4.166  28.411  -9.395
 1123    HG   SER 138           HG       SER 138   2.211  29.665  -8.747
 1124    H    PHE 139           H        PHE 139   3.059  24.871  -7.804
 1125    HA   PHE 139           HA       PHE 139   5.834  24.206  -8.351
 1126    HB2  PHE 139           HB2      PHE 139   5.857  22.925  -6.494
 1127    HB3  PHE 139           HB3      PHE 139   4.661  24.125  -6.079
 1128    HD1  PHE 139           HD2      PHE 139   5.313  20.586  -6.888
 1129    HD2  PHE 139           HD1      PHE 139   2.280  23.442  -5.752
 1130    HE1  PHE 139           HE2      PHE 139   3.813  18.733  -6.234
 1131    HE2  PHE 139           HE1      PHE 139   0.787  21.588  -5.090
 1132    HZ   PHE 139           HZ       PHE 139   1.564  19.221  -5.299
 1133    H    LYS 140           H        LYS 140   2.728  22.871  -9.372
 1134    HA   LYS 140           HA       LYS 140   3.979  20.480 -10.542
 1135    HB2  LYS 140           HB2      LYS 140   1.124  21.474 -10.550
 1136    HB3  LYS 140           HB3      LYS 140   1.670  19.989 -11.352
 1137    HG2  LYS 140           HG2      LYS 140   2.494  19.172  -9.109
 1138    HG3  LYS 140           HG3      LYS 140   1.780  20.628  -8.381
 1139    HD2  LYS 140           HD2      LYS 140  -0.448  19.949  -9.423
 1140    HD3  LYS 140           HD3      LYS 140   0.319  18.415  -9.891
 1141    HE2  LYS 140           HE2      LYS 140   0.893  18.032  -7.461
 1142    HE3  LYS 140           HE3      LYS 140   0.034  19.530  -7.051
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.391  17.588  -6.726
 1144    HZ2  LYS 140           HZ2      LYS 140  -2.018  18.511  -7.919
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.205  17.119  -8.282
 1146    H    ARG 141           H        ARG 141   2.965  23.696 -11.688
 1147    HA   ARG 141           HA       ARG 141   2.719  23.356 -14.400
 1148    HB2  ARG 141           HB2      ARG 141   2.479  25.549 -13.398
 1149    HB3  ARG 141           HB3      ARG 141   4.154  25.542 -12.829
 1150    HG2  ARG 141           HG2      ARG 141   4.953  25.680 -15.206
 1151    HG3  ARG 141           HG3      ARG 141   3.264  25.764 -15.735
 1152    HD2  ARG 141           HD2      ARG 141   2.977  27.829 -14.377
 1153    HD3  ARG 141           HD3      ARG 141   4.665  27.703 -13.856
 1154    HE   ARG 141           HE       ARG 141   4.138  27.803 -16.773
 1155   HH11  ARG 141          HH11      ARG 141   5.241  29.605 -13.902
 1156   HH12  ARG 141          HH12      ARG 141   5.916  30.905 -14.816
 1157   HH21  ARG 141          HH21      ARG 141   5.047  29.538 -17.977
 1158   HH22  ARG 141          HH22      ARG 141   5.813  30.854 -17.169
 1159    H    ASP 142           H        ASP 142   5.897  23.577 -12.697
 1160    HA   ASP 142           HA       ASP 142   7.424  23.553 -15.092
 1161    HB2  ASP 142           HB2      ASP 142   8.355  24.302 -12.958
 1162    HB3  ASP 142           HB3      ASP 142   8.195  22.676 -12.282
 1163    H    VAL 143           H        VAL 143   6.448  20.837 -12.946
 1164    HA   VAL 143           HA       VAL 143   7.849  18.906 -14.582
 1165    HB   VAL 143           HB       VAL 143   7.698  18.448 -12.286
 1166   HG11  VAL 143          HG11      VAL 143   5.706  19.731 -11.667
 1167   HG12  VAL 143          HG12      VAL 143   4.653  18.523 -12.459
 1168   HG13  VAL 143          HG13      VAL 143   5.618  18.122 -11.031
 1169   HG21  VAL 143          HG21      VAL 143   6.828  16.196 -12.247
 1170   HG22  VAL 143          HG22      VAL 143   5.764  16.509 -13.641
 1171   HG23  VAL 143          HG23      VAL 143   7.528  16.496 -13.839
 1172    H    TYR 144           H        TYR 144   4.472  20.160 -14.490
 1173    HA   TYR 144           HA       TYR 144   3.537  18.266 -16.398
 1174    HB2  TYR 144           HB2      TYR 144   2.156  19.755 -14.899
 1175    HB3  TYR 144           HB3      TYR 144   2.500  21.090 -15.982
 1176    HD1  TYR 144           HD1      TYR 144   1.878  17.669 -17.490
 1177    HD2  TYR 144           HD2      TYR 144   0.054  21.358 -16.160
 1178    HE1  TYR 144           HE1      TYR 144  -0.248  16.934 -18.395
 1179    HE2  TYR 144           HE2      TYR 144  -2.070  20.674 -17.217
 1180    HH   TYR 144           HH       TYR 144  -3.203  18.996 -18.424
 1181    H    ARG 145           H        ARG 145   5.274  21.433 -16.766
 1182    HA   ARG 145           HA       ARG 145   5.266  21.499 -19.565
 1183    HB2  ARG 145           HB2      ARG 145   6.294  23.097 -17.594
 1184    HB3  ARG 145           HB3      ARG 145   7.780  22.275 -18.108
 1185    HG2  ARG 145           HG2      ARG 145   7.167  22.923 -20.493
 1186    HG3  ARG 145           HG3      ARG 145   5.795  23.819 -19.805
 1187    HD2  ARG 145           HD2      ARG 145   7.654  25.333 -20.315
 1188    HD3  ARG 145           HD3      ARG 145   7.376  25.292 -18.579
 1189    HE   ARG 145           HE       ARG 145   9.620  24.050 -20.118
 1190   HH11  ARG 145          HH11      ARG 145   8.418  25.119 -16.934
 1191   HH12  ARG 145          HH12      ARG 145   9.766  24.427 -16.066
 1192   HH21  ARG 145          HH21      ARG 145  11.514  23.412 -18.956
 1193   HH22  ARG 145          HH22      ARG 145  11.595  23.641 -17.244
 1194    H    ARG 146           H        ARG 146   7.262  19.437 -17.413
 1195    HA   ARG 146           HA       ARG 146   8.999  18.489 -19.513
 1196    HB2  ARG 146           HB2      ARG 146   8.156  16.941 -16.997
 1197    HB3  ARG 146           HB3      ARG 146   9.524  16.600 -18.031
 1198    HG2  ARG 146           HG2      ARG 146  10.554  18.789 -17.452
 1199    HG3  ARG 146           HG3      ARG 146   9.157  19.167 -16.445
 1200    HD2  ARG 146           HD2      ARG 146   9.747  17.006 -15.127
 1201    HD3  ARG 146           HD3      ARG 146  11.322  17.138 -15.936
 1202    HE   ARG 146           HE       ARG 146  10.509  19.664 -14.785
 1203   HH11  ARG 146          HH11      ARG 146  11.976  16.556 -13.821
 1204   HH12  ARG 146          HH12      ARG 146  12.670  17.201 -12.376
 1205   HH21  ARG 146          HH21      ARG 146  11.317  20.470 -12.893
 1206   HH22  ARG 146          HH22      ARG 146  12.329  19.507 -11.843
 1207    H    VAL 147           H        VAL 147   5.823  17.256 -18.290
 1208    HA   VAL 147           HA       VAL 147   5.525  15.140 -20.156
 1209    HB   VAL 147           HB       VAL 147   3.273  16.949 -19.188
 1210   HG11  VAL 147          HG11      VAL 147   2.609  15.368 -20.925
 1211   HG12  VAL 147          HG12      VAL 147   3.327  14.028 -20.000
 1212   HG13  VAL 147          HG13      VAL 147   1.909  14.900 -19.370
 1213   HG21  VAL 147          HG21      VAL 147   2.963  15.498 -17.271
 1214   HG22  VAL 147          HG22      VAL 147   4.333  14.499 -17.761
 1215   HG23  VAL 147          HG23      VAL 147   4.590  16.164 -17.179
 1216    H    MET 148           H        MET 148   4.436  18.599 -20.432
 1217    HA   MET 148           HA       MET 148   3.363  18.276 -22.965
 1218    HB2  MET 148           HB2      MET 148   4.677  20.781 -21.836
 1219    HB3  MET 148           HB3      MET 148   3.671  20.733 -23.281
 1220    HG2  MET 148           HG2      MET 148   2.766  20.140 -20.445
 1221    HG3  MET 148           HG3      MET 148   2.444  21.590 -21.378
 1222    HE1  MET 148           HE1      MET 148  -1.127  20.253 -21.102
 1223    HE2  MET 148           HE2      MET 148   0.153  20.384 -19.877
 1224    HE3  MET 148           HE3      MET 148  -0.084  21.691 -21.059
 1225    H    LYS 149           H        LYS 149   6.711  19.227 -22.061
 1226    HA   LYS 149           HA       LYS 149   7.741  19.717 -24.643
 1227    HB2  LYS 149           HB2      LYS 149   8.879  20.518 -22.739
 1228    HB3  LYS 149           HB3      LYS 149   8.923  18.954 -21.950
 1229    HG2  LYS 149           HG2      LYS 149  10.447  19.265 -24.538
 1230    HG3  LYS 149           HG3      LYS 149  11.068  20.040 -23.079
 1231    HD2  LYS 149           HD2      LYS 149  11.064  17.916 -21.852
 1232    HD3  LYS 149           HD3      LYS 149  10.430  17.063 -23.270
 1233    HE2  LYS 149           HE2      LYS 149  12.437  17.673 -24.566
 1234    HE3  LYS 149           HE3      LYS 149  13.081  18.565 -23.184
 1235    HZ1  LYS 149           HZ1      LYS 149  13.981  16.286 -23.376
 1236    HZ2  LYS 149           HZ2      LYS 149  13.228  16.509 -21.949
 1237    HZ3  LYS 149           HZ3      LYS 149  12.479  15.645 -23.133
 1238    H    GLU 150           H        GLU 150   7.416  16.651 -22.836
 1239    HA   GLU 150           HA       GLU 150   9.082  15.158 -24.655
 1240    HB2  GLU 150           HB2      GLU 150   7.047  14.407 -22.535
 1241    HB3  GLU 150           HB3      GLU 150   7.818  13.178 -23.532
 1242    HG2  GLU 150           HG2      GLU 150   9.375  15.186 -21.853
 1243    HG3  GLU 150           HG3      GLU 150   8.915  13.574 -21.302
 1244    H    PHE 151           H        PHE 151   5.760  16.253 -24.878
 1245    HA   PHE 151           HA       PHE 151   5.219  14.281 -27.051
 1246    HB2  PHE 151           HB2      PHE 151   3.402  15.670 -25.071
 1247    HB3  PHE 151           HB3      PHE 151   2.847  14.580 -26.340
 1248    HD1  PHE 151           HD2      PHE 151   5.294  12.528 -25.844
 1249    HD2  PHE 151           HD1      PHE 151   2.327  14.418 -23.341
 1250    HE1  PHE 151           HE2      PHE 151   5.492  10.701 -24.234
 1251    HE2  PHE 151           HE1      PHE 151   2.477  12.517 -21.757
 1252    HZ   PHE 151           HZ       PHE 151   4.064  10.672 -22.178
 1253    H    ALA 152           H        ALA 152   5.223  17.758 -26.400
 1254    HA   ALA 152           HA       ALA 152   3.314  18.632 -28.126
 1255    HB1  ALA 152           HB1      ALA 152   6.045  19.923 -27.672
 1256    HB2  ALA 152           HB2      ALA 152   4.605  20.730 -28.336
 1257    HB3  ALA 152           HB3      ALA 152   4.594  20.140 -26.667
 1258    H    SER 153           H        SER 153   6.767  18.094 -29.206
 1259    HA   SER 153           HA       SER 153   6.170  18.735 -31.877
 1260    HB2  SER 153           HB2      SER 153   8.363  16.833 -31.013
 1261    HB3  SER 153           HB3      SER 153   8.339  17.943 -32.403
 1262    HG   SER 153           HG       SER 153   9.573  18.790 -30.644
 1263    H    VAL 154           H        VAL 154   5.496  15.753 -30.135
 1264    HA   VAL 154           HA       VAL 154   5.477  13.996 -32.464
 1265    HB   VAL 154           HB       VAL 154   4.058  13.598 -29.807
 1266   HG11  VAL 154          HG11      VAL 154   4.378  11.192 -30.340
 1267   HG12  VAL 154          HG12      VAL 154   3.407  12.010 -31.575
 1268   HG13  VAL 154          HG13      VAL 154   5.115  11.637 -31.889
 1269   HG21  VAL 154          HG21      VAL 154   6.087  12.321 -29.098
 1270   HG22  VAL 154          HG22      VAL 154   6.937  12.909 -30.544
 1271   HG23  VAL 154          HG23      VAL 154   6.423  14.041 -29.277
 1272    H    VAL 155           H        VAL 155   3.184  16.054 -30.695
 1273    HA   VAL 155           HA       VAL 155   0.939  15.266 -32.397
 1274    HB   VAL 155           HB       VAL 155   1.255  17.353 -30.202
 1275   HG11  VAL 155          HG11      VAL 155  -1.248  17.279 -30.103
 1276   HG12  VAL 155          HG12      VAL 155  -0.629  17.932 -31.621
 1277   HG13  VAL 155          HG13      VAL 155  -1.258  16.263 -31.567
 1278   HG21  VAL 155          HG21      VAL 155   1.603  15.143 -29.278
 1279   HG22  VAL 155          HG22      VAL 155  -0.054  15.575 -28.900
 1280   HG23  VAL 155          HG23      VAL 155   0.274  14.463 -30.239
 1281    H    MET 156           H        MET 156   3.167  18.082 -32.096
 1282    HA   MET 156           HA       MET 156   1.637  19.624 -33.975
 1283    HB2  MET 156           HB2      MET 156   4.453  19.959 -32.884
 1284    HB3  MET 156           HB3      MET 156   3.707  21.104 -34.005
 1285    HG2  MET 156           HG2      MET 156   2.556  20.327 -31.295
 1286    HG3  MET 156           HG3      MET 156   3.454  21.802 -31.640
 1287    HE1  MET 156           HE1      MET 156   1.343  23.014 -30.413
 1288    HE2  MET 156           HE2      MET 156  -0.328  22.876 -31.007
 1289    HE3  MET 156           HE3      MET 156   0.483  21.458 -30.303
 1290    H    SER 157           H        SER 157   4.253  17.243 -34.440
 1291    HA   SER 157           HA       SER 157   4.817  17.840 -37.139
 1292    HB2  SER 157           HB2      SER 157   4.575  15.121 -35.779
 1293    HB3  SER 157           HB3      SER 157   5.330  15.417 -37.355
 1294    HG   SER 157           HG       SER 157   6.184  16.315 -34.788
 1295    H    LEU 158           H        LEU 158   1.946  16.298 -35.720
 1296    HA   LEU 158           HA       LEU 158   0.872  15.220 -38.173
 1297    HB2  LEU 158           HB2      LEU 158  -0.612  16.218 -35.726
 1298    HB3  LEU 158           HB3      LEU 158  -1.265  15.142 -36.943
 1299    HG   LEU 158           HG       LEU 158   1.020  14.444 -35.050
 1300   HD11  LEU 158          HD11      LEU 158  -1.092  14.853 -33.826
 1301   HD12  LEU 158          HD12      LEU 158  -1.934  13.709 -34.889
 1302   HD13  LEU 158          HD13      LEU 158  -0.643  13.137 -33.807
 1303   HD21  LEU 158          HD21      LEU 158   0.562  12.113 -35.748
 1304   HD22  LEU 158          HD22      LEU 158  -0.649  12.697 -36.912
 1305   HD23  LEU 158          HD23      LEU 158   1.068  13.105 -37.117
 1306    H    GLN 159           H        GLN 159   0.946  18.456 -36.766
 1307    HA   GLN 159           HA       GLN 159  -1.225  19.451 -38.516
 1308    HB2  GLN 159           HB2      GLN 159   0.262  21.045 -36.395
 1309    HB3  GLN 159           HB3      GLN 159  -1.336  21.347 -37.069
 1310    HG2  GLN 159           HG2      GLN 159  -0.522  19.171 -35.125
 1311    HG3  GLN 159           HG3      GLN 159  -1.578  20.546 -34.869
 1312   HE21  GLN 159          HE22      GLN 159  -1.944  17.389 -34.796
 1313   HE22  GLN 159          HE21      GLN 159  -3.461  17.207 -35.675
 1314    H    GLU 160           H        GLU 160   2.260  19.913 -37.844
 1315    HA   GLU 160           HA       GLU 160   2.699  21.998 -39.696
 1316    HB2  GLU 160           HB2      GLU 160   4.094  21.350 -37.715
 1317    HB3  GLU 160           HB3      GLU 160   4.584  19.885 -38.551
 1318    HG2  GLU 160           HG2      GLU 160   6.329  21.573 -38.642
 1319    HG3  GLU 160           HG3      GLU 160   5.768  21.171 -40.251
 1320    H    ASN 161           H        ASN 161   2.446  18.522 -40.149
 1321    HA   ASN 161           HA       ASN 161   4.153  18.360 -42.451
 1322    HB2  ASN 161           HB2      ASN 161   3.806  16.454 -40.995
 1323    HB3  ASN 161           HB3      ASN 161   2.077  16.419 -41.368
 1324   HD21  ASN 161          HD22      ASN 161   1.386  15.463 -43.363
 1325   HD22  ASN 161          HD21      ASN 161   2.513  14.608 -44.397
 1326    H    THR 162           H        THR 162   0.564  18.354 -42.159
 1327    HA   THR 162           HA       THR 162   0.373  18.973 -45.000
 1328    HB   THR 162           HB       THR 162  -1.765  17.271 -44.549
 1329    HG1  THR 162           HG1      THR 162  -1.096  15.607 -43.352
 1330   HG21  THR 162          HG21      THR 162  -0.349  17.296 -46.545
 1331   HG22  THR 162          HG22      THR 162   1.020  16.650 -45.613
 1332   HG23  THR 162          HG23      THR 162  -0.430  15.651 -45.888
 1333    HA   PRO 163           HA       PRO 163  -3.611  20.697 -43.008
 1334    HB2  PRO 163           HB2      PRO 163  -2.603  20.990 -40.164
 1335    HB3  PRO 163           HB3      PRO 163  -4.287  20.789 -40.744
 1336    HG2  PRO 163           HG2      PRO 163  -2.965  18.641 -39.785
 1337    HG3  PRO 163           HG3      PRO 163  -3.899  18.489 -41.309
 1338    HD2  PRO 163           HD2      PRO 163  -0.905  18.873 -41.000
 1339    HD3  PRO 163           HD3      PRO 163  -1.801  17.782 -42.084
 1340    H    LYS 164           H        LYS 164  -0.443  21.704 -41.684
 1341    HA   LYS 164           HA       LYS 164  -0.983  24.531 -41.814
 1342    HB2  LYS 164           HB2      LYS 164   0.755  23.572 -40.339
 1343    HB3  LYS 164           HB3      LYS 164   1.633  22.975 -41.747
 1344    HG2  LYS 164           HG2      LYS 164   2.701  24.959 -40.883
 1345    HG3  LYS 164           HG3      LYS 164   2.063  25.287 -42.493
 1346    HD2  LYS 164           HD2      LYS 164   0.142  26.498 -41.511
 1347    HD3  LYS 164           HD3      LYS 164   0.704  26.083 -39.875
 1348    HE2  LYS 164           HE2      LYS 164   2.813  27.329 -40.291
 1349    HE3  LYS 164           HE3      LYS 164   2.265  27.721 -41.929
 1350    HZ1  LYS 164           HZ1      LYS 164   1.868  29.548 -40.400
 1351    HZ2  LYS 164           HZ2      LYS 164   0.438  28.986 -40.944
 1352    HZ3  LYS 164           HZ3      LYS 164   0.940  28.616 -39.426
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  -0.383   1.202  -0.486
    2    H2   MET   1           H2       MET   1  -1.539   2.096  -1.229
    3    H3   MET   1           H3       MET   1  -1.681   0.468  -1.162
    4    HA   MET   1           HA       MET   1   0.253   0.151  -2.561
    5    HB2  MET   1           HB2      MET   1  -2.033   0.306  -3.574
    6    HB3  MET   1           HB3      MET   1  -1.791   2.027  -3.840
    7    HG2  MET   1           HG2      MET   1  -1.416   0.784  -5.878
    8    HG3  MET   1           HG3      MET   1   0.099   1.514  -5.374
    9    HE1  MET   1           HE1      MET   1  -0.302  -0.774  -7.594
   10    HE2  MET   1           HE2      MET   1   1.301  -0.100  -7.216
   11    HE3  MET   1           HE3      MET   1   1.067  -1.857  -7.240
   12    H    ILE   2           H        ILE   2   2.178   1.182  -1.653
   13    HA   ILE   2           HA       ILE   2   2.855   3.784  -2.907
   14    HB   ILE   2           HB       ILE   2   3.329   2.978  -0.010
   15   HG12  ILE   2          HG12      ILE   2   1.141   4.055  -0.321
   16   HG13  ILE   2          HG13      ILE   2   2.235   5.036   0.638
   17   HG21  ILE   2          HG21      ILE   2   5.375   3.933  -0.608
   18   HG22  ILE   2          HG22      ILE   2   4.626   5.155  -1.660
   19   HG23  ILE   2          HG23      ILE   2   4.497   5.283   0.103
   20   HD11  ILE   2          HD11      ILE   2   0.943   6.426  -0.904
   21   HD12  ILE   2          HD12      ILE   2   2.663   6.517  -1.310
   22   HD13  ILE   2          HD13      ILE   2   1.563   5.530  -2.295
   23    H    ASP   3           H        ASP   3   4.790   3.735  -3.849
   24    HA   ASP   3           HA       ASP   3   6.321   1.272  -4.184
   25    HB2  ASP   3           HB2      ASP   3   5.965   2.897  -6.008
   26    HB3  ASP   3           HB3      ASP   3   6.769   4.144  -5.069
   27    H    ASP   4           H        ASP   4   8.405   0.997  -3.327
   28    HA   ASP   4           HA       ASP   4   8.682   1.390  -0.664
   29    HB2  ASP   4           HB2      ASP   4   9.909  -0.269  -1.966
   30    HB3  ASP   4           HB3      ASP   4  10.904   1.002  -2.691
   31    H    ASP   5           H        ASP   5   9.885   3.741  -3.059
   32    HA   ASP   5           HA       ASP   5  11.574   5.060  -1.134
   33    HB2  ASP   5           HB2      ASP   5  12.007   4.965  -3.618
   34    HB3  ASP   5           HB3      ASP   5  10.709   6.151  -3.814
   35    H    GLY   6           H        GLY   6   8.253   5.042  -1.438
   36    HA2  GLY   6           HA2      GLY   6   6.858   6.174   0.084
   37    HA3  GLY   6           HA3      GLY   6   7.925   7.584   0.059
   38    H    TYR   7           H        TYR   7   6.835   5.781  -2.876
   39    HA   TYR   7           HA       TYR   7   5.674   8.380  -3.821
   40    HB2  TYR   7           HB2      TYR   7   7.409   6.312  -5.163
   41    HB3  TYR   7           HB3      TYR   7   6.256   7.262  -6.091
   42    HD1  TYR   7           HD2      TYR   7   8.845   7.899  -3.403
   43    HD2  TYR   7           HD1      TYR   7   7.071   9.159  -7.117
   44    HE1  TYR   7           HE2      TYR   7  10.360   9.819  -3.462
   45    HE2  TYR   7           HE1      TYR   7   8.552  11.116  -7.169
   46    HH   TYR   7           HH       TYR   7  11.058  11.726  -4.657
   47    H    ARG   8           H        ARG   8   3.727   8.362  -4.982
   48    HA   ARG   8           HA       ARG   8   2.116   5.872  -4.544
   49    HB2  ARG   8           HB2      ARG   8   1.388   8.300  -4.058
   50    HB3  ARG   8           HB3      ARG   8   1.086   8.464  -5.759
   51    HG2  ARG   8           HG2      ARG   8  -0.192   6.535  -3.767
   52    HG3  ARG   8           HG3      ARG   8  -0.918   7.981  -4.442
   53    HD2  ARG   8           HD2      ARG   8  -0.915   6.822  -6.724
   54    HD3  ARG   8           HD3      ARG   8  -0.375   5.368  -5.898
   55    HE   ARG   8           HE       ARG   8  -2.384   5.196  -4.734
   56   HH11  ARG   8          HH22      ARG   8  -2.646   7.827  -7.198
   57   HH12  ARG   8          HH21      ARG   8  -4.260   8.217  -6.734
   58   HH21  ARG   8          HH11      ARG   8  -4.585   5.644  -4.316
   59   HH22  ARG   8          HH12      ARG   8  -5.421   6.859  -5.203
   60    HA   PRO   9           HA       PRO   9   3.138   5.010  -8.906
   61    HB2  PRO   9           HB2      PRO   9   1.357   2.629  -8.520
   62    HB3  PRO   9           HB3      PRO   9   3.024   2.697  -9.169
   63    HG2  PRO   9           HG2      PRO   9   2.538   1.745  -6.669
   64    HG3  PRO   9           HG3      PRO   9   3.935   2.831  -6.968
   65    HD2  PRO   9           HD2      PRO   9   1.185   3.575  -5.917
   66    HD3  PRO   9           HD3      PRO   9   2.792   3.963  -5.237
   67    H    ASN  10           H        ASN  10   2.081   6.021 -10.571
   68    HA   ASN  10           HA       ASN  10  -0.888   5.914 -10.718
   69    HB2  ASN  10           HB2      ASN  10   0.852   8.429 -10.813
   70    HB3  ASN  10           HB3      ASN  10  -0.836   8.397 -11.305
   71   HD21  ASN  10          HD22      ASN  10   1.337   8.205  -8.515
   72   HD22  ASN  10          HD21      ASN  10   0.068   8.742  -7.408
   73    H    VAL  11           H        VAL  11  -1.669   6.734 -12.798
   74    HA   VAL  11           HA       VAL  11   0.226   6.709 -15.092
   75    HB   VAL  11           HB       VAL  11  -1.741   5.765 -16.400
   76   HG11  VAL  11          HG11      VAL  11   0.239   4.415 -15.855
   77   HG12  VAL  11          HG12      VAL  11  -0.481   3.953 -14.300
   78   HG13  VAL  11          HG13      VAL  11  -1.228   3.430 -15.818
   79   HG21  VAL  11          HG21      VAL  11  -3.513   6.121 -14.652
   80   HG22  VAL  11          HG22      VAL  11  -3.431   4.449 -15.208
   81   HG23  VAL  11          HG23      VAL  11  -2.751   4.869 -13.644
   82    H    GLY  12           H        GLY  12  -0.271   8.392 -16.624
   83    HA2  GLY  12           HA2      GLY  12  -2.651  10.115 -16.048
   84    HA3  GLY  12           HA3      GLY  12  -1.071  10.810 -16.425
   85    H    ILE  13           H        ILE  13  -3.766  10.805 -17.919
   86    HA   ILE  13           HA       ILE  13  -2.990   9.376 -20.420
   87    HB   ILE  13           HB       ILE  13  -5.724  10.589 -19.952
   88   HG12  ILE  13          HG12      ILE  13  -5.545   9.146 -18.004
   89   HG13  ILE  13          HG13      ILE  13  -6.702   8.547 -19.175
   90   HG21  ILE  13          HG21      ILE  13  -4.777   8.231 -21.634
   91   HG22  ILE  13          HG22      ILE  13  -6.426   8.883 -21.567
   92   HG23  ILE  13          HG23      ILE  13  -5.109   9.873 -22.224
   93   HD11  ILE  13          HD11      ILE  13  -3.877   7.456 -18.874
   94   HD12  ILE  13          HD12      ILE  13  -5.326   6.750 -18.145
   95   HD13  ILE  13          HD13      ILE  13  -5.174   6.787 -19.901
   96    H    VAL  14           H        VAL  14  -1.987  10.772 -21.919
   97    HA   VAL  14           HA       VAL  14  -2.835  13.639 -21.946
   98    HB   VAL  14           HB       VAL  14  -0.594  12.405 -23.581
   99   HG11  VAL  14          HG11      VAL  14  -1.604  14.560 -24.382
  100   HG12  VAL  14          HG12      VAL  14  -1.147  15.305 -22.835
  101   HG13  VAL  14          HG13      VAL  14   0.095  14.685 -23.950
  102   HG21  VAL  14          HG21      VAL  14   0.996  13.456 -22.045
  103   HG22  VAL  14          HG22      VAL  14  -0.329  13.808 -20.923
  104   HG23  VAL  14          HG23      VAL  14   0.115  12.117 -21.316
  105    H    ILE  15           H        ILE  15  -5.028  13.033 -22.729
  106    HA   ILE  15           HA       ILE  15  -5.254  11.668 -25.294
  107    HB   ILE  15           HB       ILE  15  -7.214  13.644 -24.027
  108   HG12  ILE  15          HG12      ILE  15  -6.945  11.510 -22.734
  109   HG13  ILE  15          HG13      ILE  15  -8.559  11.812 -23.360
  110   HG21  ILE  15          HG21      ILE  15  -8.854  12.725 -25.668
  111   HG22  ILE  15          HG22      ILE  15  -7.591  13.719 -26.385
  112   HG23  ILE  15          HG23      ILE  15  -7.498  11.953 -26.534
  113   HD11  ILE  15          HD11      ILE  15  -7.738   9.427 -23.627
  114   HD12  ILE  15          HD12      ILE  15  -8.322  10.189 -25.114
  115   HD13  ILE  15          HD13      ILE  15  -6.581  10.038 -24.839
  116    H    CYS  16           H        CYS  16  -4.852  12.466 -27.235
  117    HA   CYS  16           HA       CYS  16  -4.374  15.409 -27.520
  118    HB2  CYS  16           HB2      CYS  16  -2.935  13.104 -28.898
  119    HB3  CYS  16           HB3      CYS  16  -2.777  14.832 -29.331
  120    HG   CYS  16           HG       CYS  16  -2.263  13.383 -26.387
  121    H    ASN  17           H        ASN  17  -5.698  16.324 -28.895
  122    HA   ASN  17           HA       ASN  17  -7.502  14.640 -30.529
  123    HB2  ASN  17           HB2      ASN  17  -8.519  16.459 -29.127
  124    HB3  ASN  17           HB3      ASN  17  -7.568  17.655 -30.026
  125   HD21  ASN  17          HD22      ASN  17 -10.448  15.672 -30.100
  126   HD22  ASN  17          HD21      ASN  17 -10.891  15.984 -31.765
  127    H    ARG  18           H        ARG  18  -7.233  14.598 -32.686
  128    HA   ARG  18           HA       ARG  18  -4.708  15.100 -33.786
  129    HB2  ARG  18           HB2      ARG  18  -7.314  14.625 -35.293
  130    HB3  ARG  18           HB3      ARG  18  -5.673  14.263 -35.853
  131    HG2  ARG  18           HG2      ARG  18  -5.430  12.653 -33.928
  132    HG3  ARG  18           HG3      ARG  18  -7.147  12.940 -33.535
  133    HD2  ARG  18           HD2      ARG  18  -7.742  12.317 -35.878
  134    HD3  ARG  18           HD3      ARG  18  -6.029  11.887 -36.139
  135    HE   ARG  18           HE       ARG  18  -7.424  10.627 -33.833
  136   HH11  ARG  18          HH11      ARG  18  -6.511  10.153 -37.246
  137   HH12  ARG  18          HH12      ARG  18  -6.601   8.428 -37.160
  138   HH21  ARG  18          HH21      ARG  18  -7.518   8.422 -33.711
  139   HH22  ARG  18          HH22      ARG  18  -7.199   7.401 -35.093
  140    H    GLN  19           H        GLN  19  -7.178  17.462 -33.402
  141    HA   GLN  19           HA       GLN  19  -6.356  19.090 -35.691
  142    HB2  GLN  19           HB2      GLN  19  -7.895  19.669 -33.139
  143    HB3  GLN  19           HB3      GLN  19  -7.624  20.868 -34.415
  144    HG2  GLN  19           HG2      GLN  19  -8.939  19.707 -35.998
  145    HG3  GLN  19           HG3      GLN  19  -8.941  18.212 -35.063
  146   HE21  GLN  19          HE22      GLN  19 -10.106  18.148 -33.018
  147   HE22  GLN  19          HE21      GLN  19 -11.485  19.209 -32.732
  148    H    GLY  20           H        GLY  20  -4.785  18.171 -32.796
  149    HA2  GLY  20           HA2      GLY  20  -2.479  18.708 -32.504
  150    HA3  GLY  20           HA3      GLY  20  -2.778  20.334 -33.163
  151    H    GLN  21           H        GLN  21  -4.630  18.612 -30.623
  152    HA   GLN  21           HA       GLN  21  -4.007  20.815 -28.729
  153    HB2  GLN  21           HB2      GLN  21  -6.760  20.229 -29.916
  154    HB3  GLN  21           HB3      GLN  21  -6.559  20.969 -28.339
  155    HG2  GLN  21           HG2      GLN  21  -6.755  22.859 -29.605
  156    HG3  GLN  21           HG3      GLN  21  -5.008  22.711 -29.569
  157   HE21  GLN  21          HE22      GLN  21  -3.942  22.676 -31.655
  158   HE22  GLN  21          HE21      GLN  21  -4.780  22.364 -33.149
  159    H    VAL  22           H        VAL  22  -4.863  20.300 -26.512
  160    HA   VAL  22           HA       VAL  22  -4.535  17.360 -26.087
  161    HB   VAL  22           HB       VAL  22  -3.297  17.996 -24.039
  162   HG11  VAL  22          HG11      VAL  22  -1.221  18.615 -25.187
  163   HG12  VAL  22          HG12      VAL  22  -2.108  17.368 -26.082
  164   HG13  VAL  22          HG13      VAL  22  -2.143  19.056 -26.642
  165   HG21  VAL  22          HG21      VAL  22  -4.224  20.290 -23.742
  166   HG22  VAL  22          HG22      VAL  22  -2.450  20.257 -23.736
  167   HG23  VAL  22          HG23      VAL  22  -3.323  20.834 -25.165
  168    H    MET  23           H        MET  23  -5.194  16.495 -24.164
  169    HA   MET  23           HA       MET  23  -7.776  16.745 -23.267
  170    HB2  MET  23           HB2      MET  23  -6.069  14.906 -22.817
  171    HB3  MET  23           HB3      MET  23  -5.310  15.943 -21.638
  172    HG2  MET  23           HG2      MET  23  -6.761  14.345 -20.524
  173    HG3  MET  23           HG3      MET  23  -7.384  15.975 -20.292
  174    HE1  MET  23           HE1      MET  23  -9.785  15.267 -19.535
  175    HE2  MET  23           HE2      MET  23 -10.732  13.999 -20.346
  176    HE3  MET  23           HE3      MET  23  -9.197  13.584 -19.542
  177    H    TRP  24           H        TRP  24  -8.846  18.159 -21.949
  178    HA   TRP  24           HA       TRP  24  -7.695  18.998 -19.525
  179    HB2  TRP  24           HB2      TRP  24  -6.985  20.846 -21.265
  180    HB3  TRP  24           HB3      TRP  24  -8.666  21.337 -21.179
  181    HD1  TRP  24           HD1      TRP  24  -8.757  23.368 -19.658
  182    HE1  TRP  24           HE1      TRP  24  -7.763  24.117 -17.435
  183    HE3  TRP  24           HE3      TRP  24  -5.745  19.310 -18.689
  184    HZ2  TRP  24           HZ2      TRP  24  -5.727  23.181 -15.565
  185    HZ3  TRP  24           HZ3      TRP  24  -4.365  19.250 -16.660
  186    HH2  TRP  24           HH2      TRP  24  -4.317  21.187 -15.102
  187    H    ALA  25           H        ALA  25  -9.417  19.485 -18.042
  188    HA   ALA  25           HA       ALA  25 -12.156  19.523 -19.014
  189    HB1  ALA  25           HB1      ALA  25 -11.117  17.095 -17.493
  190    HB2  ALA  25           HB2      ALA  25 -12.821  17.476 -17.841
  191    HB3  ALA  25           HB3      ALA  25 -11.713  17.115 -19.174
  192    H    ARG  26           H        ARG  26 -13.564  20.280 -17.407
  193    HA   ARG  26           HA       ARG  26 -12.232  21.703 -15.225
  194    HB2  ARG  26           HB2      ARG  26 -13.960  22.734 -16.659
  195    HB3  ARG  26           HB3      ARG  26 -15.121  21.506 -16.162
  196    HG2  ARG  26           HG2      ARG  26 -14.971  22.372 -13.811
  197    HG3  ARG  26           HG3      ARG  26 -13.816  23.604 -14.369
  198    HD2  ARG  26           HD2      ARG  26 -16.060  24.577 -14.217
  199    HD3  ARG  26           HD3      ARG  26 -15.526  24.510 -15.906
  200    HE   ARG  26           HE       ARG  26 -17.007  22.126 -15.278
  201   HH11  ARG  26          HH11      ARG  26 -17.537  25.605 -15.942
  202   HH12  ARG  26          HH12      ARG  26 -19.113  25.368 -16.596
  203   HH21  ARG  26          HH21      ARG  26 -19.087  21.830 -16.106
  204   HH22  ARG  26          HH22      ARG  26 -20.021  23.171 -16.698
  205    H    ARG  27           H        ARG  27 -12.670  21.317 -12.951
  206    HA   ARG  27           HA       ARG  27 -13.025  18.488 -12.386
  207    HB2  ARG  27           HB2      ARG  27 -11.335  20.158 -11.328
  208    HB3  ARG  27           HB3      ARG  27 -12.657  20.678 -10.310
  209    HG2  ARG  27           HG2      ARG  27 -11.504  17.870 -10.525
  210    HG3  ARG  27           HG3      ARG  27 -11.152  19.016  -9.240
  211    HD2  ARG  27           HD2      ARG  27 -13.470  18.905  -8.431
  212    HD3  ARG  27           HD3      ARG  27 -13.881  17.779  -9.744
  213    HE   ARG  27           HE       ARG  27 -11.770  16.559  -8.465
  214   HH11  ARG  27          HH12      ARG  27 -15.167  17.420  -7.731
  215   HH12  ARG  27          HH11      ARG  27 -15.347  16.131  -6.590
  216   HH21  ARG  27          HH21      ARG  27 -12.052  14.880  -7.205
  217   HH22  ARG  27          HH22      ARG  27 -13.516  14.570  -6.289
  218    H    PHE  28           H        PHE  28 -14.902  17.591 -11.772
  219    HA   PHE  28           HA       PHE  28 -17.396  18.978 -11.840
  220    HB2  PHE  28           HB2      PHE  28 -18.044  16.860 -12.181
  221    HB3  PHE  28           HB3      PHE  28 -16.427  16.287 -11.899
  222    HD1  PHE  28           HD1      PHE  28 -15.797  15.310  -9.685
  223    HD2  PHE  28           HD2      PHE  28 -19.807  16.653 -10.616
  224    HE1  PHE  28           HE1      PHE  28 -16.761  13.848  -7.870
  225    HE2  PHE  28           HE2      PHE  28 -20.713  15.266  -8.810
  226    HZ   PHE  28           HZ       PHE  28 -19.191  13.866  -7.405
  227    H    GLY  29           H        GLY  29 -18.726  19.714 -10.161
  228    HA2  GLY  29           HA2      GLY  29 -19.443  20.207  -8.048
  229    HA3  GLY  29           HA3      GLY  29 -18.177  19.174  -7.376
  230    H    GLN  30           H        GLN  30 -15.854  20.475  -8.464
  231    HA   GLN  30           HA       GLN  30 -15.729  22.772  -6.670
  232    HB2  GLN  30           HB2      GLN  30 -14.005  20.995  -6.792
  233    HB3  GLN  30           HB3      GLN  30 -13.619  21.481  -8.449
  234    HG2  GLN  30           HG2      GLN  30 -12.859  23.672  -7.669
  235    HG3  GLN  30           HG3      GLN  30 -13.411  23.311  -6.031
  236   HE21  GLN  30          HE22      GLN  30 -10.995  22.259  -8.548
  237   HE22  GLN  30          HE21      GLN  30  -9.870  21.617  -7.382
  238    H    HIS  31           H        HIS  31 -15.858  22.178 -10.171
  239    HA   HIS  31           HA       HIS  31 -15.907  23.452 -11.965
  240    HB2  HIS  31           HB2      HIS  31 -17.296  25.470 -10.190
  241    HB3  HIS  31           HB3      HIS  31 -17.324  25.442 -11.955
  242    HD1  HIS  31           HD1      HIS  31 -18.540  23.131 -13.057
  243    HD2  HIS  31           HD2      HIS  31 -19.062  23.948  -8.959
  244    HE1  HIS  31           HE1      HIS  31 -20.487  21.688 -12.281
  245    H    SER  32           H        SER  32 -13.483  23.380 -10.786
  246    HA   SER  32           HA       SER  32 -12.218  25.741 -11.997
  247    HB2  SER  32           HB2      SER  32 -11.266  24.556  -9.348
  248    HB3  SER  32           HB3      SER  32 -10.529  25.892 -10.246
  249    HG   SER  32           HG       SER  32 -11.820  26.669  -8.528
  250    H    TRP  33           H        TRP  33  -9.731  24.988 -12.362
  251    HA   TRP  33           HA       TRP  33  -9.994  22.494 -13.818
  252    HB2  TRP  33           HB2      TRP  33  -7.568  24.288 -13.510
  253    HB3  TRP  33           HB3      TRP  33  -7.880  23.079 -14.765
  254    HD1  TRP  33           HD1      TRP  33  -8.436  26.679 -13.979
  255    HE1  TRP  33           HE1      TRP  33 -10.131  27.771 -15.550
  256    HE3  TRP  33           HE3      TRP  33 -10.042  22.504 -16.473
  257    HZ2  TRP  33           HZ2      TRP  33 -11.911  26.962 -17.682
  258    HZ3  TRP  33           HZ3      TRP  33 -11.750  22.700 -18.257
  259    HH2  TRP  33           HH2      TRP  33 -12.701  24.915 -18.851
  260    H    GLN  34           H        GLN  34  -8.319  20.759 -13.761
  261    HA   GLN  34           HA       GLN  34  -6.924  20.314 -11.241
  262    HB2  GLN  34           HB2      GLN  34  -9.055  19.530 -10.544
  263    HB3  GLN  34           HB3      GLN  34  -9.392  18.783 -12.099
  264    HG2  GLN  34           HG2      GLN  34  -9.075  17.127 -10.404
  265    HG3  GLN  34           HG3      GLN  34  -7.845  16.961 -11.640
  266   HE21  GLN  34          HE22      GLN  34  -7.570  15.715  -9.148
  267   HE22  GLN  34          HE21      GLN  34  -6.249  16.486  -8.274
  268    H    PHE  35           H        PHE  35  -5.340  18.663 -11.451
  269    HA   PHE  35           HA       PHE  35  -4.443  18.237 -14.201
  270    HB2  PHE  35           HB2      PHE  35  -2.511  17.072 -12.930
  271    HB3  PHE  35           HB3      PHE  35  -2.658  18.810 -12.910
  272    HD1  PHE  35           HD1      PHE  35  -3.095  15.751 -10.854
  273    HD2  PHE  35           HD2      PHE  35  -3.120  20.060 -10.867
  274    HE1  PHE  35           HE1      PHE  35  -3.134  15.767  -8.365
  275    HE2  PHE  35           HE2      PHE  35  -3.135  20.069  -8.390
  276    HZ   PHE  35           HZ       PHE  35  -3.150  17.924  -7.133
  277    HA   PRO  36           HA       PRO  36  -6.082  14.019 -14.258
  278    HB2  PRO  36           HB2      PRO  36  -4.051  13.669 -16.459
  279    HB3  PRO  36           HB3      PRO  36  -5.781  13.202 -16.432
  280    HG2  PRO  36           HG2      PRO  36  -4.969  15.413 -17.792
  281    HG3  PRO  36           HG3      PRO  36  -6.471  15.460 -16.811
  282    HD2  PRO  36           HD2      PRO  36  -3.711  16.472 -16.057
  283    HD3  PRO  36           HD3      PRO  36  -5.314  17.255 -15.869
  284    H    GLN  37           H        GLN  37  -5.436  12.151 -13.283
  285    HA   GLN  37           HA       GLN  37  -2.972  10.837 -13.409
  286    HB2  GLN  37           HB2      GLN  37  -2.207  10.916 -11.086
  287    HB3  GLN  37           HB3      GLN  37  -1.884  12.360 -12.011
  288    HG2  GLN  37           HG2      GLN  37  -3.860  13.493 -10.898
  289    HG3  GLN  37           HG3      GLN  37  -4.106  12.038  -9.933
  290   HE21  GLN  37          HE22      GLN  37  -3.287  12.295  -7.853
  291   HE22  GLN  37          HE21      GLN  37  -1.859  13.222  -7.460
  292    H    GLY  38           H        GLY  38  -3.347   8.682 -12.513
  293    HA2  GLY  38           HA2      GLY  38  -5.540   8.337 -10.561
  294    HA3  GLY  38           HA3      GLY  38  -5.695   7.464 -12.096
  295    H    GLY  39           H        GLY  39  -5.136   6.495  -9.218
  296    HA2  GLY  39           HA2      GLY  39  -2.442   5.624  -9.028
  297    HA3  GLY  39           HA3      GLY  39  -3.820   5.064  -8.074
  298    H    ILE  40           H        ILE  40  -1.709   3.475  -9.095
  299    HA   ILE  40           HA       ILE  40  -2.832   1.850 -11.292
  300    HB   ILE  40           HB       ILE  40  -0.287   1.657  -9.649
  301   HG12  ILE  40          HG12      ILE  40  -0.926   2.419 -12.541
  302   HG13  ILE  40          HG13      ILE  40  -0.414   3.512 -11.270
  303   HG21  ILE  40          HG21      ILE  40  -1.100  -0.143 -11.967
  304   HG22  ILE  40          HG22      ILE  40   0.445  -0.161 -11.090
  305   HG23  ILE  40          HG23      ILE  40  -1.026  -0.636 -10.258
  306   HD11  ILE  40          HD11      ILE  40   1.797   2.278 -11.183
  307   HD12  ILE  40          HD12      ILE  40   1.266   1.367 -12.618
  308   HD13  ILE  40          HD13      ILE  40   1.458   3.121 -12.709
  309    H    ASN  41           H        ASN  41  -4.110   0.185 -11.032
  310    HA   ASN  41           HA       ASN  41  -5.218  -0.571  -8.482
  311    HB2  ASN  41           HB2      ASN  41  -6.590  -0.642 -10.452
  312    HB3  ASN  41           HB3      ASN  41  -5.411  -1.620 -11.316
  313   HD21  ASN  41          HD22      ASN  41  -6.908  -3.228 -11.827
  314   HD22  ASN  41          HD21      ASN  41  -7.560  -4.338 -10.619
  315    HA   PRO  42           HA       PRO  42  -1.785  -3.055  -7.374
  316    HB2  PRO  42           HB2      PRO  42  -3.761  -4.518  -5.601
  317    HB3  PRO  42           HB3      PRO  42  -2.100  -3.960  -5.220
  318    HG2  PRO  42           HG2      PRO  42  -4.226  -2.493  -4.423
  319    HG3  PRO  42           HG3      PRO  42  -2.805  -1.679  -5.141
  320    HD2  PRO  42           HD2      PRO  42  -5.436  -2.373  -6.463
  321    HD3  PRO  42           HD3      PRO  42  -4.466  -0.872  -6.570
  322    H    GLY  43           H        GLY  43  -0.996  -4.347  -8.754
  323    HA2  GLY  43           HA2      GLY  43  -0.382  -6.502  -9.480
  324    HA3  GLY  43           HA3      GLY  43  -1.990  -7.115  -9.074
  325    H    GLU  44           H        GLU  44  -2.467  -4.211 -10.693
  326    HA   GLU  44           HA       GLU  44  -2.771  -5.494 -13.376
  327    HB2  GLU  44           HB2      GLU  44  -4.734  -4.411 -12.348
  328    HB3  GLU  44           HB3      GLU  44  -3.858  -2.868 -12.305
  329    HG2  GLU  44           HG2      GLU  44  -3.790  -2.703 -14.642
  330    HG3  GLU  44           HG3      GLU  44  -4.167  -4.413 -14.874
  331    H    SER  45           H        SER  45  -1.269  -5.073 -14.893
  332    HA   SER  45           HA       SER  45   1.076  -3.596 -14.245
  333    HB2  SER  45           HB2      SER  45   1.439  -4.224 -16.821
  334    HB3  SER  45           HB3      SER  45   1.621  -5.369 -15.486
  335    HG   SER  45           HG       SER  45   0.288  -6.462 -16.763
  336    H    ALA  46           H        ALA  46   2.040  -1.951 -15.617
  337    HA   ALA  46           HA       ALA  46   0.734   0.410 -15.166
  338    HB1  ALA  46           HB1      ALA  46   2.485   1.418 -16.627
  339    HB2  ALA  46           HB2      ALA  46   3.158   0.189 -15.530
  340    HB3  ALA  46           HB3      ALA  46   2.879  -0.208 -17.247
  341    H    GLU  47           H        GLU  47   0.804  -1.358 -18.322
  342    HA   GLU  47           HA       GLU  47  -0.508   0.798 -19.716
  343    HB2  GLU  47           HB2      GLU  47  -0.133  -2.144 -20.443
  344    HB3  GLU  47           HB3      GLU  47  -0.839  -0.928 -21.501
  345    HG2  GLU  47           HG2      GLU  47   1.470  -1.292 -22.108
  346    HG3  GLU  47           HG3      GLU  47   1.231   0.346 -21.515
  347    H    GLN  48           H        GLN  48  -1.527  -2.335 -18.342
  348    HA   GLN  48           HA       GLN  48  -4.271  -2.239 -19.008
  349    HB2  GLN  48           HB2      GLN  48  -2.756  -3.683 -16.779
  350    HB3  GLN  48           HB3      GLN  48  -4.454  -3.919 -17.128
  351    HG2  GLN  48           HG2      GLN  48  -2.995  -5.664 -18.118
  352    HG3  GLN  48           HG3      GLN  48  -4.066  -4.866 -19.259
  353   HE21  GLN  48          HE22      GLN  48  -0.624  -4.686 -18.068
  354   HE22  GLN  48          HE21      GLN  48   0.031  -4.191 -19.613
  355    H    ALA  49           H        ALA  49  -2.521  -0.926 -16.170
  356    HA   ALA  49           HA       ALA  49  -4.839   0.116 -14.820
  357    HB1  ALA  49           HB1      ALA  49  -1.896   0.924 -14.662
  358    HB2  ALA  49           HB2      ALA  49  -3.179   1.412 -13.539
  359    HB3  ALA  49           HB3      ALA  49  -2.711  -0.306 -13.655
  360    H    MET  50           H        MET  50  -2.642   1.419 -17.357
  361    HA   MET  50           HA       MET  50  -3.672   4.082 -17.236
  362    HB2  MET  50           HB2      MET  50  -1.539   3.581 -18.244
  363    HB3  MET  50           HB3      MET  50  -2.281   2.597 -19.492
  364    HG2  MET  50           HG2      MET  50  -2.974   5.509 -19.064
  365    HG3  MET  50           HG3      MET  50  -1.697   4.982 -20.129
  366    HE1  MET  50           HE1      MET  50  -3.353   3.395 -23.169
  367    HE2  MET  50           HE2      MET  50  -1.872   4.078 -22.475
  368    HE3  MET  50           HE3      MET  50  -2.560   2.580 -21.801
  369    H    TYR  51           H        TYR  51  -4.757   1.189 -19.095
  370    HA   TYR  51           HA       TYR  51  -7.027   2.549 -20.147
  371    HB2  TYR  51           HB2      TYR  51  -6.756  -0.397 -19.528
  372    HB3  TYR  51           HB3      TYR  51  -8.032   0.370 -20.453
  373    HD1  TYR  51           HD2      TYR  51  -7.541   1.374 -22.738
  374    HD2  TYR  51           HD1      TYR  51  -4.590  -0.714 -20.441
  375    HE1  TYR  51           HE2      TYR  51  -6.199   1.054 -24.777
  376    HE2  TYR  51           HE1      TYR  51  -3.130  -0.936 -22.409
  377    HH   TYR  51           HH       TYR  51  -4.236   0.151 -25.709
  378    H    ARG  52           H        ARG  52  -6.533   0.933 -16.951
  379    HA   ARG  52           HA       ARG  52  -9.264   1.038 -16.125
  380    HB2  ARG  52           HB2      ARG  52  -7.335  -0.140 -14.915
  381    HB3  ARG  52           HB3      ARG  52  -6.835   1.434 -14.323
  382    HG2  ARG  52           HG2      ARG  52  -8.077   0.559 -12.555
  383    HG3  ARG  52           HG3      ARG  52  -9.146   1.736 -13.317
  384    HD2  ARG  52           HD2      ARG  52 -10.327  -0.342 -12.672
  385    HD3  ARG  52           HD3      ARG  52 -10.399  -0.072 -14.419
  386    HE   ARG  52           HE       ARG  52  -8.137  -1.749 -13.741
  387   HH11  ARG  52          HH11      ARG  52 -11.701  -2.013 -13.750
  388   HH12  ARG  52          HH12      ARG  52 -11.696  -3.658 -14.257
  389   HH21  ARG  52          HH21      ARG  52  -8.141  -3.802 -14.596
  390   HH22  ARG  52          HH22      ARG  52  -9.606  -4.754 -14.656
  391    H    ALA  53           H        ALA  53  -6.624   3.504 -15.798
  392    HA   ALA  53           HA       ALA  53  -8.347   5.453 -14.578
  393    HB1  ALA  53           HB1      ALA  53  -6.470   7.018 -15.054
  394    HB2  ALA  53           HB2      ALA  53  -5.920   5.512 -14.292
  395    HB3  ALA  53           HB3      ALA  53  -5.690   5.760 -16.041
  396    H    LEU  54           H        LEU  54  -7.681   4.618 -17.968
  397    HA   LEU  54           HA       LEU  54  -8.692   7.001 -19.221
  398    HB2  LEU  54           HB2      LEU  54  -7.319   5.298 -20.341
  399    HB3  LEU  54           HB3      LEU  54  -8.517   4.083 -19.944
  400    HG   LEU  54           HG       LEU  54 -10.144   5.161 -21.519
  401   HD11  LEU  54          HD11      LEU  54  -7.626   6.698 -22.333
  402   HD12  LEU  54          HD12      LEU  54  -9.151   6.658 -23.247
  403   HD13  LEU  54          HD13      LEU  54  -9.100   7.413 -21.641
  404   HD21  LEU  54          HD21      LEU  54  -9.050   4.107 -23.430
  405   HD22  LEU  54          HD22      LEU  54  -7.509   4.054 -22.517
  406   HD23  LEU  54          HD23      LEU  54  -8.934   3.155 -21.940
  407    H    PHE  55           H        PHE  55 -10.116   3.923 -18.157
  408    HA   PHE  55           HA       PHE  55 -12.844   4.652 -18.726
  409    HB2  PHE  55           HB2      PHE  55 -12.616   2.382 -18.683
  410    HB3  PHE  55           HB3      PHE  55 -11.426   2.387 -17.393
  411    HD1  PHE  55           HD1      PHE  55 -15.076   3.128 -17.957
  412    HD2  PHE  55           HD2      PHE  55 -12.000   1.827 -15.241
  413    HE1  PHE  55           HE1      PHE  55 -16.804   2.729 -16.207
  414    HE2  PHE  55           HE2      PHE  55 -13.742   1.369 -13.496
  415    HZ   PHE  55           HZ       PHE  55 -16.137   1.839 -13.983
  416    H    GLU  56           H        GLU  56 -11.121   4.525 -15.480
  417    HA   GLU  56           HA       GLU  56 -13.456   5.410 -14.179
  418    HB2  GLU  56           HB2      GLU  56 -10.536   5.517 -13.313
  419    HB3  GLU  56           HB3      GLU  56 -11.884   6.003 -12.279
  420    HG2  GLU  56           HG2      GLU  56 -12.906   3.729 -12.601
  421    HG3  GLU  56           HG3      GLU  56 -11.414   3.224 -13.402
  422    H    GLU  57           H        GLU  57 -10.706   7.332 -15.468
  423    HA   GLU  57           HA       GLU  57 -11.818   9.751 -14.241
  424    HB2  GLU  57           HB2      GLU  57  -9.346   9.537 -15.984
  425    HB3  GLU  57           HB3      GLU  57  -9.771  10.818 -14.866
  426    HG2  GLU  57           HG2      GLU  57  -8.991   7.956 -14.171
  427    HG3  GLU  57           HG3      GLU  57  -8.030   9.402 -13.915
  428    H    VAL  58           H        VAL  58 -11.388   8.458 -17.567
  429    HA   VAL  58           HA       VAL  58 -12.646  10.942 -18.621
  430    HB   VAL  58           HB       VAL  58 -11.039   8.940 -20.226
  431   HG11  VAL  58          HG11      VAL  58 -11.759  11.863 -20.673
  432   HG12  VAL  58          HG12      VAL  58 -10.721  10.878 -21.729
  433   HG13  VAL  58          HG13      VAL  58 -12.426  10.464 -21.537
  434   HG21  VAL  58          HG21      VAL  58  -9.127  10.573 -20.006
  435   HG22  VAL  58          HG22      VAL  58 -10.023  11.395 -18.711
  436   HG23  VAL  58          HG23      VAL  58  -9.479   9.716 -18.507
  437    H    GLY  59           H        GLY  59 -13.211   7.509 -18.179
  438    HA2  GLY  59           HA2      GLY  59 -15.088   6.263 -18.670
  439    HA3  GLY  59           HA3      GLY  59 -15.927   7.744 -19.143
  440    H    LEU  60           H        LEU  60 -12.976   6.088 -20.324
  441    HA   LEU  60           HA       LEU  60 -14.243   5.464 -22.937
  442    HB2  LEU  60           HB2      LEU  60 -11.512   6.702 -22.416
  443    HB3  LEU  60           HB3      LEU  60 -11.935   5.885 -23.914
  444    HG   LEU  60           HG       LEU  60 -13.178   8.409 -22.775
  445   HD11  LEU  60          HD11      LEU  60 -12.114   9.467 -24.782
  446   HD12  LEU  60          HD12      LEU  60 -10.915   8.674 -23.755
  447   HD13  LEU  60          HD13      LEU  60 -11.466   7.897 -25.258
  448   HD21  LEU  60          HD21      LEU  60 -13.905   6.938 -25.352
  449   HD22  LEU  60          HD22      LEU  60 -14.967   7.275 -23.981
  450   HD23  LEU  60          HD23      LEU  60 -14.391   8.598 -24.974
  451    H    SER  61           H        SER  61 -13.286   3.544 -23.894
  452    HA   SER  61           HA       SER  61 -12.220   1.701 -21.794
  453    HB2  SER  61           HB2      SER  61 -14.001   1.178 -24.196
  454    HB3  SER  61           HB3      SER  61 -13.517  -0.003 -22.960
  455    HG   SER  61           HG       SER  61 -15.621   0.902 -22.561
  456    H    ARG  62           H        ARG  62 -11.393  -0.411 -23.194
  457    HA   ARG  62           HA       ARG  62  -8.825   0.506 -24.058
  458    HB2  ARG  62           HB2      ARG  62  -9.744  -2.392 -24.140
  459    HB3  ARG  62           HB3      ARG  62  -8.124  -1.747 -23.886
  460    HG2  ARG  62           HG2      ARG  62  -9.277  -0.700 -21.719
  461    HG3  ARG  62           HG3      ARG  62 -10.439  -1.993 -21.961
  462    HD2  ARG  62           HD2      ARG  62  -8.693  -3.685 -21.769
  463    HD3  ARG  62           HD3      ARG  62  -7.437  -2.429 -21.706
  464    HE   ARG  62           HE       ARG  62  -9.354  -1.979 -19.634
  465   HH11  ARG  62          HH11      ARG  62  -6.882  -4.403 -20.394
  466   HH12  ARG  62          HH12      ARG  62  -6.496  -4.723 -18.741
  467   HH21  ARG  62          HH21      ARG  62  -8.685  -2.257 -17.441
  468   HH22  ARG  62          HH22      ARG  62  -7.381  -3.311 -17.028
  469    H    LYS  63           H        LYS  63 -10.541   1.516 -25.870
  470    HA   LYS  63           HA       LYS  63  -9.785   0.305 -28.433
  471    HB2  LYS  63           HB2      LYS  63 -12.050  -0.217 -29.126
  472    HB3  LYS  63           HB3      LYS  63 -11.646  -1.085 -27.636
  473    HG2  LYS  63           HG2      LYS  63 -12.986   0.485 -26.292
  474    HG3  LYS  63           HG3      LYS  63 -13.314   1.470 -27.713
  475    HD2  LYS  63           HD2      LYS  63 -15.247   0.133 -27.223
  476    HD3  LYS  63           HD3      LYS  63 -14.550  -0.375 -28.768
  477    HE2  LYS  63           HE2      LYS  63 -13.467  -2.318 -27.634
  478    HE3  LYS  63           HE3      LYS  63 -14.148  -1.799 -26.088
  479    HZ1  LYS  63           HZ1      LYS  63 -15.491  -3.531 -27.114
  480    HZ2  LYS  63           HZ2      LYS  63 -16.372  -2.165 -27.031
  481    HZ3  LYS  63           HZ3      LYS  63 -15.731  -2.649 -28.461
  482    H    ASP  64           H        ASP  64 -11.075   2.968 -26.532
  483    HA   ASP  64           HA       ASP  64 -12.136   4.418 -28.825
  484    HB2  ASP  64           HB2      ASP  64 -11.743   5.021 -25.877
  485    HB3  ASP  64           HB3      ASP  64 -12.478   6.171 -26.989
  486    H    VAL  65           H        VAL  65  -9.014   3.922 -27.905
  487    HA   VAL  65           HA       VAL  65  -8.000   6.494 -28.867
  488    HB   VAL  65           HB       VAL  65  -6.625   6.794 -26.854
  489   HG11  VAL  65          HG11      VAL  65  -9.564   6.781 -26.105
  490   HG12  VAL  65          HG12      VAL  65  -8.279   7.778 -25.424
  491   HG13  VAL  65          HG13      VAL  65  -8.793   8.023 -27.109
  492   HG21  VAL  65          HG21      VAL  65  -6.691   4.437 -25.957
  493   HG22  VAL  65          HG22      VAL  65  -7.144   5.648 -24.744
  494   HG23  VAL  65          HG23      VAL  65  -8.399   4.683 -25.546
  495    H    ARG  66           H        ARG  66  -5.520   6.353 -28.919
  496    HA   ARG  66           HA       ARG  66  -4.541   3.635 -29.685
  497    HB2  ARG  66           HB2      ARG  66  -5.395   4.640 -31.709
  498    HB3  ARG  66           HB3      ARG  66  -4.848   6.242 -31.240
  499    HG2  ARG  66           HG2      ARG  66  -3.516   5.527 -33.027
  500    HG3  ARG  66           HG3      ARG  66  -2.506   5.594 -31.592
  501    HD2  ARG  66           HD2      ARG  66  -3.781   2.940 -32.291
  502    HD3  ARG  66           HD3      ARG  66  -2.539   3.543 -33.396
  503    HE   ARG  66           HE       ARG  66  -1.213   3.830 -31.080
  504   HH11  ARG  66          HH11      ARG  66  -2.939   1.014 -32.421
  505   HH12  ARG  66          HH12      ARG  66  -1.859  -0.135 -31.720
  506   HH21  ARG  66          HH21      ARG  66   0.205   2.348 -30.202
  507   HH22  ARG  66          HH22      ARG  66  -0.024   0.640 -30.407
  508    H    ILE  67           H        ILE  67  -2.560   3.415 -28.466
  509    HA   ILE  67           HA       ILE  67  -1.374   5.780 -27.272
  510    HB   ILE  67           HB       ILE  67  -0.378   2.915 -27.470
  511   HG12  ILE  67          HG12      ILE  67  -1.715   4.243 -25.070
  512   HG13  ILE  67          HG13      ILE  67  -2.654   3.344 -26.247
  513   HG21  ILE  67          HG21      ILE  67   0.471   5.230 -25.674
  514   HG22  ILE  67          HG22      ILE  67   1.075   3.562 -25.552
  515   HG23  ILE  67          HG23      ILE  67   1.430   4.507 -26.991
  516   HD11  ILE  67          HD11      ILE  67  -2.114   1.866 -24.407
  517   HD12  ILE  67          HD12      ILE  67  -1.220   1.326 -25.833
  518   HD13  ILE  67          HD13      ILE  67  -0.388   2.214 -24.533
  519    H    LEU  68           H        LEU  68   0.053   7.129 -28.182
  520    HA   LEU  68           HA       LEU  68   1.387   6.205 -30.713
  521    HB2  LEU  68           HB2      LEU  68  -0.051   8.609 -30.077
  522    HB3  LEU  68           HB3      LEU  68   1.638   9.051 -30.286
  523    HG   LEU  68           HG       LEU  68   0.370   9.315 -32.333
  524   HD11  LEU  68          HD11      LEU  68   1.860   8.154 -33.882
  525   HD12  LEU  68          HD12      LEU  68   2.782   8.757 -32.498
  526   HD13  LEU  68          HD13      LEU  68   2.381   7.032 -32.615
  527   HD21  LEU  68          HD21      LEU  68  -0.053   6.295 -32.375
  528   HD22  LEU  68          HD22      LEU  68  -1.290   7.501 -31.951
  529   HD23  LEU  68          HD23      LEU  68  -0.586   7.481 -33.578
  530    H    ALA  69           H        ALA  69   1.951   7.507 -27.452
  531    HA   ALA  69           HA       ALA  69   4.736   6.717 -27.581
  532    HB1  ALA  69           HB1      ALA  69   5.599   8.980 -26.991
  533    HB2  ALA  69           HB2      ALA  69   4.864   8.990 -28.599
  534    HB3  ALA  69           HB3      ALA  69   3.973   9.665 -27.219
  535    H    SER  70           H        SER  70   5.694   6.938 -25.374
  536    HA   SER  70           HA       SER  70   3.833   7.493 -23.161
  537    HB2  SER  70           HB2      SER  70   5.537   4.983 -23.197
  538    HB3  SER  70           HB3      SER  70   4.273   5.442 -22.033
  539    HG   SER  70           HG       SER  70   3.674   3.822 -23.687
  540    H    THR  71           H        THR  71   5.147   7.973 -21.110
  541    HA   THR  71           HA       THR  71   7.436   9.509 -21.772
  542    HB   THR  71           HB       THR  71   7.807   9.396 -19.194
  543    HG1  THR  71           HG1      THR  71   6.549   7.593 -18.709
  544   HG21  THR  71          HG21      THR  71   6.760  11.291 -20.352
  545   HG22  THR  71          HG22      THR  71   5.205  10.438 -20.382
  546   HG23  THR  71          HG23      THR  71   5.912  10.951 -18.830
  547    H    ARG  72           H        ARG  72   9.624   9.125 -21.723
  548    HA   ARG  72           HA       ARG  72  10.326   6.531 -22.620
  549    HB2  ARG  72           HB2      ARG  72  12.014   8.912 -21.745
  550    HB3  ARG  72           HB3      ARG  72  12.707   7.445 -22.452
  551    HG2  ARG  72           HG2      ARG  72  11.370   7.723 -24.490
  552    HG3  ARG  72           HG3      ARG  72  10.605   9.182 -23.838
  553    HD2  ARG  72           HD2      ARG  72  13.606   8.870 -24.266
  554    HD3  ARG  72           HD3      ARG  72  12.502   9.581 -25.458
  555    HE   ARG  72           HE       ARG  72  11.905  11.078 -23.287
  556   HH11  ARG  72          HH21      ARG  72  15.085  10.343 -24.745
  557   HH12  ARG  72          HH22      ARG  72  15.779  11.842 -24.232
  558   HH21  ARG  72          HH11      ARG  72  12.735  12.925 -22.690
  559   HH22  ARG  72          HH12      ARG  72  14.406  13.396 -22.981
  560    H    ASN  73           H        ASN  73  10.421   7.882 -19.392
  561    HA   ASN  73           HA       ASN  73  10.602   5.282 -18.258
  562    HB2  ASN  73           HB2      ASN  73  12.464   5.520 -16.806
  563    HB3  ASN  73           HB3      ASN  73  13.069   5.827 -18.422
  564   HD21  ASN  73          HD22      ASN  73  13.070   8.363 -19.025
  565   HD22  ASN  73          HD21      ASN  73  13.645   9.397 -17.741
  566    H    TRP  74           H        TRP  74  10.374   5.715 -15.677
  567    HA   TRP  74           HA       TRP  74   7.886   7.000 -15.535
  568    HB2  TRP  74           HB2      TRP  74   9.751   6.048 -13.333
  569    HB3  TRP  74           HB3      TRP  74   8.120   6.649 -13.047
  570    HD1  TRP  74           HD1      TRP  74   9.934   3.701 -14.743
  571    HE1  TRP  74           HE1      TRP  74   8.289   1.819 -15.213
  572    HE3  TRP  74           HE3      TRP  74   5.660   5.842 -12.944
  573    HZ2  TRP  74           HZ2      TRP  74   5.439   1.435 -15.216
  574    HZ3  TRP  74           HZ3      TRP  74   3.461   4.707 -13.236
  575    HH2  TRP  74           HH2      TRP  74   3.308   2.578 -14.491
  576    H    LEU  75           H        LEU  75   7.253   8.965 -15.186
  577    HA   LEU  75           HA       LEU  75   9.190  11.158 -15.144
  578    HB2  LEU  75           HB2      LEU  75   7.224  10.741 -16.786
  579    HB3  LEU  75           HB3      LEU  75   6.155  11.253 -15.503
  580    HG   LEU  75           HG       LEU  75   6.616  12.958 -17.188
  581   HD11  LEU  75          HD11      LEU  75   7.836  13.928 -14.572
  582   HD12  LEU  75          HD12      LEU  75   6.915  14.863 -15.763
  583   HD13  LEU  75          HD13      LEU  75   6.097  13.640 -14.821
  584   HD21  LEU  75          HD21      LEU  75   8.721  13.916 -17.628
  585   HD22  LEU  75          HD22      LEU  75   9.485  13.149 -16.222
  586   HD23  LEU  75          HD23      LEU  75   8.991  12.177 -17.630
  587    H    ARG  76           H        ARG  76   9.493  10.133 -12.844
  588    HA   ARG  76           HA       ARG  76   7.301  10.593 -10.975
  589    HB2  ARG  76           HB2      ARG  76   8.530   9.542  -9.251
  590    HB3  ARG  76           HB3      ARG  76   8.749   8.579 -10.703
  591    HG2  ARG  76           HG2      ARG  76  10.811  10.477  -9.478
  592    HG3  ARG  76           HG3      ARG  76  10.781   8.705  -9.380
  593    HD2  ARG  76           HD2      ARG  76  10.864   8.618 -11.871
  594    HD3  ARG  76           HD3      ARG  76  11.136  10.384 -11.889
  595    HE   ARG  76           HE       ARG  76  13.109   9.381 -10.229
  596   HH11  ARG  76          HH21      ARG  76  12.061   8.830 -13.587
  597   HH12  ARG  76          HH22      ARG  76  13.602   8.376 -14.178
  598   HH21  ARG  76          HH11      ARG  76  15.240   8.828 -11.005
  599   HH22  ARG  76          HH12      ARG  76  15.489   8.435 -12.667
  600    H    TYR  77           H        TYR  77   7.251  11.987  -9.196
  601    HA   TYR  77           HA       TYR  77   9.082  14.327  -9.354
  602    HB2  TYR  77           HB2      TYR  77   7.259  14.627 -10.984
  603    HB3  TYR  77           HB3      TYR  77   6.053  14.328  -9.723
  604    HD1  TYR  77           HD2      TYR  77   8.927  16.605 -10.587
  605    HD2  TYR  77           HD1      TYR  77   5.200  16.086  -8.466
  606    HE1  TYR  77           HE2      TYR  77   8.920  19.005 -10.034
  607    HE2  TYR  77           HE1      TYR  77   5.205  18.451  -7.860
  608    HH   TYR  77           HH       TYR  77   7.824  20.738  -8.842
  609    H    LYS  78           H        LYS  78   9.150  15.550  -7.465
  610    HA   LYS  78           HA       LYS  78   8.155  14.111  -5.074
  611    HB2  LYS  78           HB2      LYS  78  10.606  14.379  -5.522
  612    HB3  LYS  78           HB3      LYS  78  10.444  16.115  -5.342
  613    HG2  LYS  78           HG2      LYS  78   9.481  14.269  -3.134
  614    HG3  LYS  78           HG3      LYS  78  11.213  14.535  -3.345
  615    HD2  LYS  78           HD2      LYS  78  11.049  16.882  -2.962
  616    HD3  LYS  78           HD3      LYS  78   9.294  16.862  -3.107
  617    HE2  LYS  78           HE2      LYS  78   9.207  15.350  -1.064
  618    HE3  LYS  78           HE3      LYS  78  10.950  15.618  -0.870
  619    HZ1  LYS  78           HZ1      LYS  78  10.467  18.017  -0.671
  620    HZ2  LYS  78           HZ2      LYS  78   8.848  17.727  -0.833
  621    HZ3  LYS  78           HZ3      LYS  78   9.673  17.173   0.483
  622    H    LEU  79           H        LEU  79   6.825  15.122  -3.625
  623    HA   LEU  79           HA       LEU  79   5.346  17.435  -4.602
  624    HB2  LEU  79           HB2      LEU  79   5.146  15.654  -2.151
  625    HB3  LEU  79           HB3      LEU  79   4.054  17.008  -2.393
  626    HG   LEU  79           HG       LEU  79   4.301  14.597  -4.236
  627   HD11  LEU  79          HD11      LEU  79   2.157  13.902  -3.251
  628   HD12  LEU  79          HD12      LEU  79   3.395  14.043  -2.001
  629   HD13  LEU  79          HD13      LEU  79   2.169  15.317  -2.175
  630   HD21  LEU  79          HD21      LEU  79   2.320  16.921  -4.224
  631   HD22  LEU  79          HD22      LEU  79   3.514  16.542  -5.491
  632   HD23  LEU  79          HD23      LEU  79   2.167  15.448  -5.210
  633    HA   PRO  80           HA       PRO  80   7.316  20.494  -1.883
  634    HB2  PRO  80           HB2      PRO  80   5.355  22.343  -1.628
  635    HB3  PRO  80           HB3      PRO  80   6.137  22.056  -3.218
  636    HG2  PRO  80           HG2      PRO  80   3.611  20.745  -2.144
  637    HG3  PRO  80           HG3      PRO  80   3.753  21.717  -3.666
  638    HD2  PRO  80           HD2      PRO  80   3.961  19.047  -3.779
  639    HD3  PRO  80           HD3      PRO  80   5.144  20.041  -4.680
  640    H    LYS  81           H        LYS  81   7.249  20.977   0.399
  641    HA   LYS  81           HA       LYS  81   6.333  19.028   2.027
  642    HB2  LYS  81           HB2      LYS  81   7.920  21.211   2.311
  643    HB3  LYS  81           HB3      LYS  81   6.496  21.868   3.125
  644    HG2  LYS  81           HG2      LYS  81   6.494  19.766   4.550
  645    HG3  LYS  81           HG3      LYS  81   8.010  19.317   3.728
  646    HD2  LYS  81           HD2      LYS  81   9.130  21.315   4.616
  647    HD3  LYS  81           HD3      LYS  81   7.611  21.871   5.358
  648    HE2  LYS  81           HE2      LYS  81   7.540  19.833   6.763
  649    HE3  LYS  81           HE3      LYS  81   9.039  19.255   6.023
  650    HZ1  LYS  81           HZ1      LYS  81  10.174  21.200   6.967
  651    HZ2  LYS  81           HZ2      LYS  81   8.784  21.714   7.669
  652    HZ3  LYS  81           HZ3      LYS  81   9.475  20.314   8.141
  653    H    ARG  82           H        ARG  82   4.509  21.843   1.039
  654    HA   ARG  82           HA       ARG  82   2.455  21.696   3.018
  655    HB2  ARG  82           HB2      ARG  82   1.953  22.936   0.310
  656    HB3  ARG  82           HB3      ARG  82   1.423  23.477   1.895
  657    HG2  ARG  82           HG2      ARG  82   4.181  23.749   0.644
  658    HG3  ARG  82           HG3      ARG  82   3.039  25.034   0.967
  659    HD2  ARG  82           HD2      ARG  82   3.453  25.067   3.257
  660    HD3  ARG  82           HD3      ARG  82   4.074  23.413   3.307
  661    HE   ARG  82           HE       ARG  82   5.927  24.528   1.724
  662   HH11  ARG  82          HH21      ARG  82   4.631  25.603   4.866
  663   HH12  ARG  82          HH22      ARG  82   6.062  26.455   5.323
  664   HH21  ARG  82          HH11      ARG  82   7.821  25.700   2.324
  665   HH22  ARG  82          HH12      ARG  82   7.915  26.491   3.853
  666    H    LEU  83           H        LEU  83   2.864  20.064  -0.081
  667    HA   LEU  83           HA       LEU  83   0.022  19.166  -0.084
  668    HB2  LEU  83           HB2      LEU  83   2.197  19.118  -2.184
  669    HB3  LEU  83           HB3      LEU  83   0.876  18.001  -2.280
  670    HG   LEU  83           HG       LEU  83   0.573  20.006  -3.669
  671   HD11  LEU  83          HD11      LEU  83  -1.795  20.310  -3.183
  672   HD12  LEU  83          HD12      LEU  83  -1.337  18.615  -2.983
  673   HD13  LEU  83          HD13      LEU  83  -1.587  19.644  -1.551
  674   HD21  LEU  83          HD21      LEU  83   1.473  21.751  -2.139
  675   HD22  LEU  83          HD22      LEU  83  -0.137  22.136  -2.745
  676   HD23  LEU  83          HD23      LEU  83   0.053  21.538  -1.088
  677    H    VAL  84           H        VAL  84   3.270  18.005   0.614
  678    HA   VAL  84           HA       VAL  84   2.646  15.215   0.722
  679    HB   VAL  84           HB       VAL  84   4.553  16.842   2.467
  680   HG11  VAL  84          HG11      VAL  84   4.422  13.816   2.030
  681   HG12  VAL  84          HG12      VAL  84   5.689  14.686   2.915
  682   HG13  VAL  84          HG13      VAL  84   4.050  14.656   3.548
  683   HG21  VAL  84          HG21      VAL  84   5.140  16.895   0.049
  684   HG22  VAL  84          HG22      VAL  84   6.310  15.965   0.981
  685   HG23  VAL  84          HG23      VAL  84   5.081  15.121   0.018
  686    H    ARG  85           H        ARG  85   1.342  14.119   2.038
  687    HA   ARG  85           HA       ARG  85  -0.508  15.546   3.760
  688    HB2  ARG  85           HB2      ARG  85  -0.169  12.684   2.833
  689    HB3  ARG  85           HB3      ARG  85  -1.120  12.958   4.281
  690    HG2  ARG  85           HG2      ARG  85  -2.605  12.891   2.410
  691    HG3  ARG  85           HG3      ARG  85  -2.605  14.484   3.166
  692    HD2  ARG  85           HD2      ARG  85  -2.677  14.875   0.840
  693    HD3  ARG  85           HD3      ARG  85  -1.032  15.268   1.332
  694    HE   ARG  85           HE       ARG  85  -1.138  12.524   0.518
  695   HH11  ARG  85          HH12      ARG  85  -0.903  15.728  -0.894
  696   HH12  ARG  85          HH11      ARG  85  -1.171  15.223  -2.536
  697   HH21  ARG  85          HH21      ARG  85  -1.352  11.761  -1.660
  698   HH22  ARG  85          HH22      ARG  85  -1.266  12.868  -2.980
  699    H    TRP  86           H        TRP  86   2.124  13.324   4.401
  700    HA   TRP  86           HA       TRP  86   3.134  12.450   6.222
  701    HB2  TRP  86           HB2      TRP  86   2.211  14.865   7.772
  702    HB3  TRP  86           HB3      TRP  86   3.585  13.831   8.116
  703    HD1  TRP  86           HD1      TRP  86   2.447  16.595   5.781
  704    HE1  TRP  86           HE1      TRP  86   4.441  17.754   4.684
  705    HE3  TRP  86           HE3      TRP  86   6.102  13.402   7.355
  706    HZ2  TRP  86           HZ2      TRP  86   7.310  17.239   4.422
  707    HZ3  TRP  86           HZ3      TRP  86   8.453  13.726   6.629
  708    HH2  TRP  86           HH2      TRP  86   9.064  15.634   5.159
  709    H    ASP  87           H        ASP  87  -0.082  12.497   5.971
  710    HA   ASP  87           HA       ASP  87  -0.671  11.126   8.555
  711    HB2  ASP  87           HB2      ASP  87  -2.194  12.920   7.830
  712    HB3  ASP  87           HB3      ASP  87  -2.474  12.084   6.305
  713    H    THR  88           H        THR  88   0.041  10.490   5.195
  714    HA   THR  88           HA       THR  88  -1.200   7.894   5.026
  715    HB   THR  88           HB       THR  88   0.347   7.975   2.882
  716    HG1  THR  88           HG1      THR  88   0.510  10.386   2.374
  717   HG21  THR  88          HG21      THR  88  -2.127   8.264   2.894
  718   HG22  THR  88          HG22      THR  88  -1.918   9.992   3.246
  719   HG23  THR  88          HG23      THR  88  -1.342   9.308   1.703
  720    H    LYS  89           H        LYS  89  -0.054   5.947   5.093
  721    HA   LYS  89           HA       LYS  89   2.761   5.987   6.056
  722    HB2  LYS  89           HB2      LYS  89   0.472   4.519   7.384
  723    HB3  LYS  89           HB3      LYS  89   2.179   4.070   7.572
  724    HG2  LYS  89           HG2      LYS  89   2.721   6.334   8.406
  725    HG3  LYS  89           HG3      LYS  89   1.036   6.827   8.202
  726    HD2  LYS  89           HD2      LYS  89   1.470   6.401  10.503
  727    HD3  LYS  89           HD3      LYS  89   0.315   5.207   9.882
  728    HE2  LYS  89           HE2      LYS  89   2.143   3.525   9.713
  729    HE3  LYS  89           HE3      LYS  89   3.311   4.731  10.275
  730    HZ1  LYS  89           HZ1      LYS  89   1.026   3.693  11.867
  731    HZ2  LYS  89           HZ2      LYS  89   2.594   3.281  12.066
  732    HZ3  LYS  89           HZ3      LYS  89   2.112   4.806  12.387
  733    HA   PRO  90           HA       PRO  90   4.664   5.162   5.231
  734    HB2  PRO  90           HB2      PRO  90   5.194   4.930   2.280
  735    HB3  PRO  90           HB3      PRO  90   6.307   4.666   3.649
  736    HG2  PRO  90           HG2      PRO  90   5.249   2.554   2.301
  737    HG3  PRO  90           HG3      PRO  90   5.379   2.512   4.092
  738    HD2  PRO  90           HD2      PRO  90   2.951   3.198   2.401
  739    HD3  PRO  90           HD3      PRO  90   3.065   2.108   3.812
  740    H    VAL  91           H        VAL  91   5.192   7.408   4.928
  741    HA   VAL  91           HA       VAL  91   3.171   9.134   4.027
  742    HB   VAL  91           HB       VAL  91   4.640   9.845   5.755
  743   HG11  VAL  91          HG11      VAL  91   7.023  10.387   5.444
  744   HG12  VAL  91          HG12      VAL  91   6.731   8.658   5.261
  745   HG13  VAL  91          HG13      VAL  91   6.992   9.666   3.821
  746   HG21  VAL  91          HG21      VAL  91   5.246  12.057   5.005
  747   HG22  VAL  91          HG22      VAL  91   5.296  11.537   3.311
  748   HG23  VAL  91          HG23      VAL  91   3.749  11.566   4.180
  749    H    CYS  92           H        CYS  92   2.771  10.059   2.182
  750    HA   CYS  92           HA       CYS  92   4.126   8.973  -0.197
  751    HB2  CYS  92           HB2      CYS  92   1.724   8.758   0.063
  752    HB3  CYS  92           HB3      CYS  92   1.545  10.523   0.223
  753    HG   CYS  92           HG       CYS  92   0.747   9.756  -2.169
  754    H    ILE  93           H        ILE  93   5.914  10.116  -0.716
  755    HA   ILE  93           HA       ILE  93   5.901  13.070  -0.351
  756    HB   ILE  93           HB       ILE  93   8.302  12.961  -0.388
  757   HG12  ILE  93          HG12      ILE  93   8.031   9.936  -0.679
  758   HG13  ILE  93          HG13      ILE  93   8.643  11.045  -1.910
  759   HG21  ILE  93          HG21      ILE  93   7.209  10.909   1.584
  760   HG22  ILE  93          HG22      ILE  93   8.608  11.979   1.798
  761   HG23  ILE  93          HG23      ILE  93   6.985  12.668   1.733
  762   HD11  ILE  93          HD11      ILE  93  10.524  10.026  -0.879
  763   HD12  ILE  93          HD12      ILE  93  10.472  11.691  -0.265
  764   HD13  ILE  93          HD13      ILE  93   9.906  10.335   0.753
  765    H    GLY  94           H        GLY  94   5.333  10.884  -2.929
  766    HA2  GLY  94           HA2      GLY  94   5.705  13.040  -4.842
  767    HA3  GLY  94           HA3      GLY  94   6.908  11.768  -4.985
  768    H    GLN  95           H        GLN  95   5.268  12.315  -7.077
  769    HA   GLN  95           HA       GLN  95   3.235  10.113  -7.165
  770    HB2  GLN  95           HB2      GLN  95   3.514  12.759  -8.609
  771    HB3  GLN  95           HB3      GLN  95   3.068  11.382  -9.591
  772    HG2  GLN  95           HG2      GLN  95   1.002  12.213  -9.074
  773    HG3  GLN  95           HG3      GLN  95   1.154  10.910  -7.932
  774   HE21  GLN  95          HE22      GLN  95   1.491  11.491  -5.547
  775   HE22  GLN  95          HE21      GLN  95   1.021  13.092  -5.048
  776    H    LYS  96           H        LYS  96   4.114   8.215  -7.928
  777    HA   LYS  96           HA       LYS  96   6.481   8.284  -9.772
  778    HB2  LYS  96           HB2      LYS  96   6.733   6.565  -8.104
  779    HB3  LYS  96           HB3      LYS  96   5.051   6.064  -8.224
  780    HG2  LYS  96           HG2      LYS  96   5.518   5.178 -10.544
  781    HG3  LYS  96           HG3      LYS  96   7.206   5.681 -10.378
  782    HD2  LYS  96           HD2      LYS  96   7.407   4.186  -8.382
  783    HD3  LYS  96           HD3      LYS  96   5.720   3.678  -8.621
  784    HE2  LYS  96           HE2      LYS  96   6.360   2.853 -10.940
  785    HE3  LYS  96           HE3      LYS  96   8.037   3.295 -10.573
  786    HZ1  LYS  96           HZ1      LYS  96   7.837   1.012 -10.074
  787    HZ2  LYS  96           HZ2      LYS  96   7.822   1.726  -8.590
  788    HZ3  LYS  96           HZ3      LYS  96   6.432   1.176  -9.263
  789    H    GLN  97           H        GLN  97   5.851   8.443 -11.968
  790    HA   GLN  97           HA       GLN  97   3.105   7.568 -12.652
  791    HB2  GLN  97           HB2      GLN  97   2.546   9.823 -13.589
  792    HB3  GLN  97           HB3      GLN  97   2.666   9.766 -11.828
  793    HG2  GLN  97           HG2      GLN  97   4.984  10.693 -11.951
  794    HG3  GLN  97           HG3      GLN  97   4.827  10.791 -13.709
  795   HE21  GLN  97          HE22      GLN  97   5.593  12.978 -12.479
  796   HE22  GLN  97          HE21      GLN  97   4.278  14.163 -12.372
  797    H    LYS  98           H        LYS  98   2.827   6.926 -14.709
  798    HA   LYS  98           HA       LYS  98   4.956   7.560 -16.709
  799    HB2  LYS  98           HB2      LYS  98   4.974   5.175 -16.099
  800    HB3  LYS  98           HB3      LYS  98   3.246   5.038 -16.441
  801    HG2  LYS  98           HG2      LYS  98   3.709   5.522 -18.838
  802    HG3  LYS  98           HG3      LYS  98   5.432   5.722 -18.457
  803    HD2  LYS  98           HD2      LYS  98   5.564   3.389 -17.656
  804    HD3  LYS  98           HD3      LYS  98   3.831   3.165 -17.986
  805    HE2  LYS  98           HE2      LYS  98   4.236   3.604 -20.406
  806    HE3  LYS  98           HE3      LYS  98   5.956   3.864 -20.066
  807    HZ1  LYS  98           HZ1      LYS  98   6.023   1.501 -19.278
  808    HZ2  LYS  98           HZ2      LYS  98   4.475   1.275 -19.806
  809    HZ3  LYS  98           HZ3      LYS  98   5.657   1.638 -20.863
  810    H    TRP  99           H        TRP  99   4.142   8.804 -18.322
  811    HA   TRP  99           HA       TRP  99   1.179   9.164 -18.381
  812    HB2  TRP  99           HB2      TRP  99   3.425  11.050 -19.071
  813    HB3  TRP  99           HB3      TRP  99   1.794  11.248 -19.691
  814    HD1  TRP  99           HD1      TRP  99   3.553  11.039 -16.243
  815    HE1  TRP  99           HE1      TRP  99   2.289  12.565 -14.589
  816    HE3  TRP  99           HE3      TRP  99  -0.415  12.365 -19.167
  817    HZ2  TRP  99           HZ2      TRP  99   0.109  14.464 -14.704
  818    HZ3  TRP  99           HZ3      TRP  99  -2.061  14.054 -18.391
  819    HH2  TRP  99           HH2      TRP  99  -1.776  15.132 -16.161
  820    H    PHE 100           H        PHE 100   0.140   8.799 -20.296
  821    HA   PHE 100           HA       PHE 100   1.767   7.587 -22.504
  822    HB2  PHE 100           HB2      PHE 100  -0.982   6.852 -21.445
  823    HB3  PHE 100           HB3      PHE 100  -0.303   6.271 -22.955
  824    HD1  PHE 100           HD2      PHE 100   0.358   6.286 -19.237
  825    HD2  PHE 100           HD1      PHE 100   1.014   4.344 -23.033
  826    HE1  PHE 100           HE2      PHE 100   1.227   4.281 -18.067
  827    HE2  PHE 100           HE1      PHE 100   1.930   2.369 -21.858
  828    HZ   PHE 100           HZ       PHE 100   1.969   2.300 -19.370
  829    H    LEU 101           H        LEU 101   1.521   8.580 -24.429
  830    HA   LEU 101           HA       LEU 101  -0.495  10.717 -24.682
  831    HB2  LEU 101           HB2      LEU 101   1.777  11.191 -25.480
  832    HB3  LEU 101           HB3      LEU 101   1.653   9.877 -26.663
  833    HG   LEU 101           HG       LEU 101  -0.547  11.962 -26.551
  834   HD11  LEU 101          HD11      LEU 101   0.745  13.379 -28.148
  835   HD12  LEU 101          HD12      LEU 101   1.435  13.341 -26.523
  836   HD13  LEU 101          HD13      LEU 101   2.172  12.378 -27.840
  837   HD21  LEU 101          HD21      LEU 101  -0.725  11.641 -28.903
  838   HD22  LEU 101          HD22      LEU 101   0.791  10.710 -28.976
  839   HD23  LEU 101          HD23      LEU 101  -0.669  10.029 -28.231
  840    H    LEU 102           H        LEU 102  -2.373  10.287 -25.391
  841    HA   LEU 102           HA       LEU 102  -2.847   7.821 -26.986
  842    HB2  LEU 102           HB2      LEU 102  -4.414   9.253 -24.809
  843    HB3  LEU 102           HB3      LEU 102  -5.294   8.436 -26.072
  844    HG   LEU 102           HG       LEU 102  -5.135   6.956 -24.227
  845   HD11  LEU 102          HD11      LEU 102  -3.032   5.822 -26.050
  846   HD12  LEU 102          HD12      LEU 102  -4.468   5.033 -25.391
  847   HD13  LEU 102          HD13      LEU 102  -4.573   6.205 -26.753
  848   HD21  LEU 102          HD21      LEU 102  -3.073   7.920 -23.165
  849   HD22  LEU 102          HD22      LEU 102  -3.058   6.154 -23.265
  850   HD23  LEU 102          HD23      LEU 102  -2.088   7.104 -24.395
  851    H    GLN 103           H        GLN 103  -3.457   8.132 -29.004
  852    HA   GLN 103           HA       GLN 103  -4.317  10.872 -29.818
  853    HB2  GLN 103           HB2      GLN 103  -3.591   8.371 -31.386
  854    HB3  GLN 103           HB3      GLN 103  -4.493   9.701 -32.127
  855    HG2  GLN 103           HG2      GLN 103  -1.762   9.951 -30.803
  856    HG3  GLN 103           HG3      GLN 103  -2.056   9.884 -32.544
  857   HE21  GLN 103          HE22      GLN 103  -0.672  12.054 -31.085
  858   HE22  GLN 103          HE21      GLN 103  -1.671  13.481 -31.360
  859    H    LEU 104           H        LEU 104  -6.417  11.330 -30.057
  860    HA   LEU 104           HA       LEU 104  -8.355   9.558 -28.913
  861    HB2  LEU 104           HB2      LEU 104  -8.354  12.065 -28.929
  862    HB3  LEU 104           HB3      LEU 104  -8.708  12.033 -30.655
  863    HG   LEU 104           HG       LEU 104 -10.897  11.014 -30.215
  864   HD11  LEU 104          HD11      LEU 104 -10.145  11.190 -27.251
  865   HD12  LEU 104          HD12      LEU 104 -11.781  10.896 -27.867
  866   HD13  LEU 104          HD13      LEU 104 -10.514   9.705 -28.163
  867   HD21  LEU 104          HD21      LEU 104 -11.853  13.028 -29.002
  868   HD22  LEU 104          HD22      LEU 104 -10.207  13.502 -28.568
  869   HD23  LEU 104          HD23      LEU 104 -10.701  13.424 -30.285
  870    H    VAL 105           H        VAL 105  -9.755   8.059 -29.882
  871    HA   VAL 105           HA       VAL 105  -9.737   7.864 -32.869
  872    HB   VAL 105           HB       VAL 105  -9.989   5.641 -30.821
  873   HG11  VAL 105          HG11      VAL 105 -10.060   5.481 -33.842
  874   HG12  VAL 105          HG12      VAL 105  -9.925   4.095 -32.732
  875   HG13  VAL 105          HG13      VAL 105 -11.376   5.099 -32.698
  876   HG21  VAL 105          HG21      VAL 105  -7.749   6.108 -32.825
  877   HG22  VAL 105          HG22      VAL 105  -7.615   6.452 -31.089
  878   HG23  VAL 105          HG23      VAL 105  -7.871   4.797 -31.638
  879    H    SER 106           H        SER 106 -11.666   7.601 -29.826
  880    HA   SER 106           HA       SER 106 -14.156   7.878 -31.384
  881    HB2  SER 106           HB2      SER 106 -13.698   7.597 -28.402
  882    HB3  SER 106           HB3      SER 106 -15.258   7.541 -29.260
  883    HG   SER 106           HG       SER 106 -14.332   5.467 -28.824
  884    H    GLY 107           H        GLY 107 -14.890   9.660 -28.664
  885    HA2  GLY 107           HA2      GLY 107 -13.780  12.213 -29.306
  886    HA3  GLY 107           HA3      GLY 107 -15.331  12.000 -30.121
  887    H    ASP 108           H        ASP 108 -15.257  14.001 -28.392
  888    HA   ASP 108           HA       ASP 108 -15.827  13.715 -25.715
  889    HB2  ASP 108           HB2      ASP 108 -15.586  15.852 -26.821
  890    HB3  ASP 108           HB3      ASP 108 -17.055  15.575 -27.758
  891    H    ALA 109           H        ALA 109 -17.994  12.996 -28.455
  892    HA   ALA 109           HA       ALA 109 -20.413  12.782 -26.948
  893    HB1  ALA 109           HB1      ALA 109 -19.605  11.455 -29.574
  894    HB2  ALA 109           HB2      ALA 109 -21.256  11.609 -28.944
  895    HB3  ALA 109           HB3      ALA 109 -20.353  13.066 -29.401
  896    H    GLU 110           H        GLU 110 -17.703  10.542 -27.347
  897    HA   GLU 110           HA       GLU 110 -19.276   8.304 -26.255
  898    HB2  GLU 110           HB2      GLU 110 -16.486   8.360 -27.440
  899    HB3  GLU 110           HB3      GLU 110 -17.316   6.926 -26.844
  900    HG2  GLU 110           HG2      GLU 110 -18.091   8.625 -29.245
  901    HG3  GLU 110           HG3      GLU 110 -17.471   6.981 -29.260
  902    H    ILE 111           H        ILE 111 -16.738  10.593 -25.492
  903    HA   ILE 111           HA       ILE 111 -15.737   9.481 -23.058
  904    HB   ILE 111           HB       ILE 111 -15.998  12.205 -24.296
  905   HG12  ILE 111          HG12      ILE 111 -13.636  10.527 -23.499
  906   HG13  ILE 111          HG13      ILE 111 -14.249  10.800 -25.139
  907   HG21  ILE 111          HG21      ILE 111 -14.857  13.336 -22.503
  908   HG22  ILE 111          HG22      ILE 111 -16.328  12.654 -21.869
  909   HG23  ILE 111          HG23      ILE 111 -14.766  11.841 -21.540
  910   HD11  ILE 111          HD11      ILE 111 -12.274  12.101 -24.894
  911   HD12  ILE 111          HD12      ILE 111 -13.642  13.228 -24.874
  912   HD13  ILE 111          HD13      ILE 111 -12.804  12.788 -23.358
  913    H    ASN 112           H        ASN 112 -16.433   9.819 -20.932
  914    HA   ASN 112           HA       ASN 112 -19.242  10.815 -20.562
  915    HB2  ASN 112           HB2      ASN 112 -19.332   8.391 -20.650
  916    HB3  ASN 112           HB3      ASN 112 -18.044   8.240 -19.464
  917   HD21  ASN 112          HD22      ASN 112 -20.301   6.852 -18.873
  918   HD22  ASN 112          HD21      ASN 112 -21.158   7.658 -17.574
  919    H    MET 113           H        MET 113 -16.164   9.929 -18.950
  920    HA   MET 113           HA       MET 113 -15.081  10.642 -17.185
  921    HB2  MET 113           HB2      MET 113 -16.440  13.337 -17.267
  922    HB3  MET 113           HB3      MET 113 -14.860  12.894 -16.640
  923    HG2  MET 113           HG2      MET 113 -14.333  12.221 -19.116
  924    HG3  MET 113           HG3      MET 113 -15.731  13.240 -19.500
  925    HE1  MET 113           HE1      MET 113 -12.907  15.684 -20.584
  926    HE2  MET 113           HE2      MET 113 -13.095  13.942 -20.907
  927    HE3  MET 113           HE3      MET 113 -14.505  15.027 -20.974
  928    H    GLN 114           H        GLN 114 -18.511  10.286 -16.846
  929    HA   GLN 114           HA       GLN 114 -18.217  10.570 -13.906
  930    HB2  GLN 114           HB2      GLN 114 -20.784  10.617 -15.531
  931    HB3  GLN 114           HB3      GLN 114 -20.629  10.834 -13.790
  932    HG2  GLN 114           HG2      GLN 114 -19.245  12.902 -14.207
  933    HG3  GLN 114           HG3      GLN 114 -19.545  12.716 -15.933
  934   HE21  GLN 114          HE22      GLN 114 -21.257  13.136 -12.760
  935   HE22  GLN 114          HE21      GLN 114 -22.646  13.943 -13.450
  936    H    THR 115           H        THR 115 -17.269   8.333 -15.523
  937    HA   THR 115           HA       THR 115 -18.977   6.073 -15.189
  938    HB   THR 115           HB       THR 115 -16.417   5.111 -15.548
  939    HG1  THR 115           HG1      THR 115 -15.138   6.611 -16.380
  940   HG21  THR 115          HG21      THR 115 -18.057   6.473 -17.725
  941   HG22  THR 115          HG22      THR 115 -16.898   5.138 -17.937
  942   HG23  THR 115          HG23      THR 115 -18.419   4.854 -17.079
  943    H    SER 116           H        SER 116 -16.680   7.712 -13.097
  944    HA   SER 116           HA       SER 116 -16.159   5.480 -11.367
  945    HB2  SER 116           HB2      SER 116 -15.231   7.775 -10.160
  946    HB3  SER 116           HB3      SER 116 -14.334   6.784 -11.338
  947    HG   SER 116           HG       SER 116 -14.494   8.314 -12.762
  948    H    SER 117           H        SER 117 -18.793   7.513 -11.532
  949    HA   SER 117           HA       SER 117 -20.613   7.918 -10.311
  950    HB2  SER 117           HB2      SER 117 -19.542   6.049  -8.181
  951    HB3  SER 117           HB3      SER 117 -21.211   6.591  -8.392
  952    HG   SER 117           HG       SER 117 -20.859   4.492  -9.303
  953    H    THR 118           H        THR 118 -17.600   8.169  -8.444
  954    HA   THR 118           HA       THR 118 -18.445  10.866  -7.525
  955    HB   THR 118           HB       THR 118 -16.834  10.418  -5.592
  956    HG1  THR 118           HG1      THR 118 -15.896   8.476  -6.239
  957   HG21  THR 118          HG21      THR 118 -19.284  10.536  -5.315
  958   HG22  THR 118          HG22      THR 118 -19.424   8.806  -5.696
  959   HG23  THR 118          HG23      THR 118 -18.567   9.337  -4.228
  960    HA   PRO 119           HA       PRO 119 -15.038  10.443 -10.631
  961    HB2  PRO 119           HB2      PRO 119 -15.855  12.280 -12.499
  962    HB3  PRO 119           HB3      PRO 119 -16.611  10.678 -12.313
  963    HG2  PRO 119           HG2      PRO 119 -17.532  13.307 -11.114
  964    HG3  PRO 119           HG3      PRO 119 -18.487  12.155 -12.100
  965    HD2  PRO 119           HD2      PRO 119 -18.595  12.037  -9.411
  966    HD3  PRO 119           HD3      PRO 119 -18.527  10.548 -10.407
  967    H    GLU 120           H        GLU 120 -13.846  12.403 -11.917
  968    HA   GLU 120           HA       GLU 120 -13.077  14.466  -9.915
  969    HB2  GLU 120           HB2      GLU 120 -11.283  12.797 -10.625
  970    HB3  GLU 120           HB3      GLU 120 -11.453  13.442 -12.269
  971    HG2  GLU 120           HG2      GLU 120  -9.823  14.862 -11.617
  972    HG3  GLU 120           HG3      GLU 120 -11.166  15.765 -10.925
  973    H    PHE 121           H        PHE 121 -13.841  13.794 -13.421
  974    HA   PHE 121           HA       PHE 121 -13.831  16.733 -13.842
  975    HB2  PHE 121           HB2      PHE 121 -13.387  14.435 -15.751
  976    HB3  PHE 121           HB3      PHE 121 -13.371  16.142 -16.173
  977    HD1  PHE 121           HD1      PHE 121 -11.688  17.664 -14.771
  978    HD2  PHE 121           HD2      PHE 121 -11.321  13.389 -15.255
  979    HE1  PHE 121           HE1      PHE 121  -9.277  17.818 -14.291
  980    HE2  PHE 121           HE2      PHE 121  -8.904  13.546 -14.730
  981    HZ   PHE 121           HZ       PHE 121  -7.873  15.765 -14.241
  982    H    ASP 122           H        ASP 122 -15.340  17.773 -15.103
  983    HA   ASP 122           HA       ASP 122 -17.778  16.258 -15.865
  984    HB2  ASP 122           HB2      ASP 122 -19.199  17.741 -15.023
  985    HB3  ASP 122           HB3      ASP 122 -17.903  18.045 -13.912
  986    H    GLY 123           H        GLY 123 -15.151  17.134 -17.263
  987    HA2  GLY 123           HA2      GLY 123 -14.770  17.097 -19.549
  988    HA3  GLY 123           HA3      GLY 123 -16.445  17.531 -19.862
  989    H    TRP 124           H        TRP 124 -14.650  18.702 -21.414
  990    HA   TRP 124           HA       TRP 124 -15.280  21.416 -21.063
  991    HB2  TRP 124           HB2      TRP 124 -13.392  21.522 -19.494
  992    HB3  TRP 124           HB3      TRP 124 -12.324  20.841 -20.710
  993    HD1  TRP 124           HD1      TRP 124 -10.724  22.665 -21.370
  994    HE1  TRP 124           HE1      TRP 124 -10.817  25.140 -21.968
  995    HE3  TRP 124           HE3      TRP 124 -15.726  23.521 -20.547
  996    HZ2  TRP 124           HZ2      TRP 124 -12.805  27.236 -22.106
  997    HZ3  TRP 124           HZ3      TRP 124 -16.677  25.770 -20.933
  998    HH2  TRP 124           HH2      TRP 124 -15.229  27.634 -21.708
  999    H    ARG 125           H        ARG 125 -12.296  21.240 -22.658
 1000    HA   ARG 125           HA       ARG 125 -13.338  20.757 -25.386
 1001    HB2  ARG 125           HB2      ARG 125 -12.040  23.302 -24.258
 1002    HB3  ARG 125           HB3      ARG 125 -12.156  22.943 -25.979
 1003    HG2  ARG 125           HG2      ARG 125 -14.563  23.147 -25.950
 1004    HG3  ARG 125           HG3      ARG 125 -14.588  23.298 -24.184
 1005    HD2  ARG 125           HD2      ARG 125 -14.794  25.515 -25.312
 1006    HD3  ARG 125           HD3      ARG 125 -13.405  25.392 -24.251
 1007    HE   ARG 125           HE       ARG 125 -11.934  25.575 -25.998
 1008   HH11  ARG 125          HH11      ARG 125 -15.218  25.224 -27.341
 1009   HH12  ARG 125          HH12      ARG 125 -14.762  25.661 -28.947
 1010   HH21  ARG 125          HH21      ARG 125 -11.332  26.166 -28.147
 1011   HH22  ARG 125          HH22      ARG 125 -12.511  26.210 -29.408
 1012    H    TRP 126           H        TRP 126 -11.423  20.597 -26.909
 1013    HA   TRP 126           HA       TRP 126  -8.934  19.855 -25.499
 1014    HB2  TRP 126           HB2      TRP 126  -9.373  19.833 -28.484
 1015    HB3  TRP 126           HB3      TRP 126  -8.228  18.894 -27.525
 1016    HD1  TRP 126           HD1      TRP 126 -11.130  18.290 -29.439
 1017    HE1  TRP 126           HE1      TRP 126 -12.750  16.532 -28.555
 1018    HE3  TRP 126           HE3      TRP 126  -9.363  17.906 -24.645
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.352  15.275 -26.025
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.608  16.576 -22.974
 1021    HH2  TRP 126           HH2      TRP 126 -12.616  15.290 -23.635
 1022    H    VAL 127           H        VAL 127  -7.170  21.197 -25.433
 1023    HA   VAL 127           HA       VAL 127  -7.569  23.969 -26.508
 1024    HB   VAL 127           HB       VAL 127  -6.637  24.754 -24.378
 1025   HG11  VAL 127          HG11      VAL 127  -8.560  24.416 -22.978
 1026   HG12  VAL 127          HG12      VAL 127  -9.085  24.587 -24.661
 1027   HG13  VAL 127          HG13      VAL 127  -9.053  22.982 -23.894
 1028   HG21  VAL 127          HG21      VAL 127  -6.863  21.840 -23.443
 1029   HG22  VAL 127          HG22      VAL 127  -5.343  22.688 -23.745
 1030   HG23  VAL 127          HG23      VAL 127  -6.416  23.221 -22.437
 1031    H    SER 128           H        SER 128  -5.425  25.288 -26.490
 1032    HA   SER 128           HA       SER 128  -3.583  24.108 -28.193
 1033    HB2  SER 128           HB2      SER 128  -2.927  26.319 -26.208
 1034    HB3  SER 128           HB3      SER 128  -2.157  26.005 -27.770
 1035    HG   SER 128           HG       SER 128  -3.754  27.686 -27.916
 1036    H    TYR 129           H        TYR 129  -1.473  23.282 -27.946
 1037    HA   TYR 129           HA       TYR 129  -1.370  21.181 -26.201
 1038    HB2  TYR 129           HB2      TYR 129  -0.198  21.435 -28.346
 1039    HB3  TYR 129           HB3      TYR 129   0.956  22.545 -27.601
 1040    HD1  TYR 129           HD1      TYR 129  -0.208  19.017 -27.793
 1041    HD2  TYR 129           HD2      TYR 129   2.726  21.713 -26.156
 1042    HE1  TYR 129           HE1      TYR 129   1.078  17.088 -26.901
 1043    HE2  TYR 129           HE2      TYR 129   4.103  19.799 -25.432
 1044    HH   TYR 129           HH       TYR 129   4.226  17.482 -25.271
 1045    H    TRP 130           H        TRP 130   0.225  24.367 -25.627
 1046    HA   TRP 130           HA       TRP 130   1.282  23.350 -23.074
 1047    HB2  TRP 130           HB2      TRP 130   1.666  26.062 -24.355
 1048    HB3  TRP 130           HB3      TRP 130   2.566  25.394 -22.998
 1049    HD1  TRP 130           HD1      TRP 130   2.380  25.388 -26.747
 1050    HE1  TRP 130           HE1      TRP 130   4.180  23.969 -27.781
 1051    HE3  TRP 130           HE3      TRP 130   4.207  23.251 -22.466
 1052    HZ2  TRP 130           HZ2      TRP 130   6.283  22.107 -26.844
 1053    HZ3  TRP 130           HZ3      TRP 130   6.116  21.673 -22.565
 1054    HH2  TRP 130           HH2      TRP 130   7.119  21.039 -24.739
 1055    H    TYR 131           H        TYR 131  -1.722  24.632 -23.896
 1056    HA   TYR 131           HA       TYR 131  -1.903  26.790 -22.038
 1057    HB2  TYR 131           HB2      TYR 131  -3.383  26.538 -23.964
 1058    HB3  TYR 131           HB3      TYR 131  -4.126  25.116 -23.260
 1059    HD1  TYR 131           HD2      TYR 131  -3.490  28.762 -22.626
 1060    HD2  TYR 131           HD1      TYR 131  -6.010  25.357 -21.808
 1061    HE1  TYR 131           HE2      TYR 131  -5.161  30.257 -21.578
 1062    HE2  TYR 131           HE1      TYR 131  -7.712  26.851 -20.802
 1063    HH   TYR 131           HH       TYR 131  -7.269  30.412 -20.563
 1064    HA   PRO 132           HA       PRO 132  -3.728  23.596 -18.899
 1065    HB2  PRO 132           HB2      PRO 132  -2.137  21.174 -19.709
 1066    HB3  PRO 132           HB3      PRO 132  -3.725  21.277 -18.935
 1067    HG2  PRO 132           HG2      PRO 132  -3.564  20.725 -21.552
 1068    HG3  PRO 132           HG3      PRO 132  -4.779  21.922 -20.985
 1069    HD2  PRO 132           HD2      PRO 132  -2.018  22.466 -22.138
 1070    HD3  PRO 132           HD3      PRO 132  -3.574  23.209 -22.575
 1071    H    VAL 133           H        VAL 133  -0.403  23.716 -20.141
 1072    HA   VAL 133           HA       VAL 133   0.831  23.197 -17.573
 1073    HB   VAL 133           HB       VAL 133   1.660  23.393 -20.305
 1074   HG11  VAL 133          HG11      VAL 133   3.766  24.540 -20.240
 1075   HG12  VAL 133          HG12      VAL 133   2.474  25.694 -19.898
 1076   HG13  VAL 133          HG13      VAL 133   3.493  25.075 -18.570
 1077   HG21  VAL 133          HG21      VAL 133   3.611  22.204 -19.453
 1078   HG22  VAL 133          HG22      VAL 133   3.205  22.668 -17.782
 1079   HG23  VAL 133          HG23      VAL 133   2.138  21.579 -18.704
 1080    H    ARG 134           H        ARG 134  -0.854  25.920 -18.804
 1081    HA   ARG 134           HA       ARG 134   0.390  27.555 -16.636
 1082    HB2  ARG 134           HB2      ARG 134   0.056  28.345 -19.174
 1083    HB3  ARG 134           HB3      ARG 134  -1.550  28.754 -18.590
 1084    HG2  ARG 134           HG2      ARG 134   1.129  29.763 -17.486
 1085    HG3  ARG 134           HG3      ARG 134   0.010  30.647 -18.508
 1086    HD2  ARG 134           HD2      ARG 134  -0.539  31.571 -16.509
 1087    HD3  ARG 134           HD3      ARG 134  -1.709  30.274 -16.550
 1088    HE   ARG 134           HE       ARG 134  -0.437  29.021 -14.942
 1089   HH11  ARG 134          HH21      ARG 134   1.042  32.214 -15.489
 1090   HH12  ARG 134          HH22      ARG 134   1.514  32.437 -13.843
 1091   HH21  ARG 134          HH11      ARG 134   0.060  29.394 -12.720
 1092   HH22  ARG 134          HH12      ARG 134   1.021  30.746 -12.258
 1093    H    GLN 135           H        GLN 135  -2.693  26.108 -17.858
 1094    HA   GLN 135           HA       GLN 135  -4.265  27.381 -15.822
 1095    HB2  GLN 135           HB2      GLN 135  -4.794  24.836 -17.409
 1096    HB3  GLN 135           HB3      GLN 135  -5.975  25.633 -16.371
 1097    HG2  GLN 135           HG2      GLN 135  -4.727  26.806 -18.884
 1098    HG3  GLN 135           HG3      GLN 135  -6.376  26.220 -18.681
 1099   HE21  GLN 135          HE22      GLN 135  -7.806  27.442 -17.069
 1100   HE22  GLN 135          HE21      GLN 135  -7.484  29.140 -16.837
 1101    H    VAL 136           H        VAL 136  -2.257  24.449 -15.691
 1102    HA   VAL 136           HA       VAL 136  -3.446  23.459 -13.291
 1103    HB   VAL 136           HB       VAL 136  -1.973  22.278 -15.059
 1104   HG11  VAL 136          HG11      VAL 136   0.403  22.042 -14.513
 1105   HG12  VAL 136          HG12      VAL 136  -0.020  23.686 -15.046
 1106   HG13  VAL 136          HG13      VAL 136   0.242  23.341 -13.320
 1107   HG21  VAL 136          HG21      VAL 136  -2.892  21.148 -13.149
 1108   HG22  VAL 136          HG22      VAL 136  -1.244  20.592 -13.495
 1109   HG23  VAL 136          HG23      VAL 136  -1.549  21.696 -12.132
 1110    H    VAL 137           H        VAL 137  -2.382  23.404 -11.114
 1111    HA   VAL 137           HA       VAL 137  -1.680  25.988 -10.148
 1112    HB   VAL 137           HB       VAL 137  -1.041  24.763  -8.069
 1113   HG11  VAL 137          HG11      VAL 137  -3.794  24.087  -9.222
 1114   HG12  VAL 137          HG12      VAL 137  -3.360  24.143  -7.505
 1115   HG13  VAL 137          HG13      VAL 137  -3.332  25.629  -8.465
 1116   HG21  VAL 137          HG21      VAL 137  -1.647  22.410  -7.781
 1117   HG22  VAL 137          HG22      VAL 137  -1.997  22.245  -9.510
 1118   HG23  VAL 137          HG23      VAL 137  -0.340  22.587  -8.952
 1119    H    SER 138           H        SER 138   0.223  26.851  -9.332
 1120    HA   SER 138           HA       SER 138   2.242  26.990 -11.075
 1121    HB2  SER 138           HB2      SER 138   2.500  27.476  -8.092
 1122    HB3  SER 138           HB3      SER 138   3.380  28.296  -9.395
 1123    HG   SER 138           HG       SER 138   1.554  29.521  -8.644
 1124    H    PHE 139           H        PHE 139   2.286  24.749  -8.238
 1125    HA   PHE 139           HA       PHE 139   5.054  24.047  -8.770
 1126    HB2  PHE 139           HB2      PHE 139   5.025  22.778  -6.908
 1127    HB3  PHE 139           HB3      PHE 139   3.785  23.934  -6.509
 1128    HD1  PHE 139           HD2      PHE 139   4.586  20.465  -7.313
 1129    HD2  PHE 139           HD1      PHE 139   1.375  23.167  -6.359
 1130    HE1  PHE 139           HE2      PHE 139   3.105  18.520  -6.841
 1131    HE2  PHE 139           HE1      PHE 139  -0.107  21.240  -5.886
 1132    HZ   PHE 139           HZ       PHE 139   0.748  18.917  -6.092
 1133    H    LYS 140           H        LYS 140   1.898  22.611  -9.598
 1134    HA   LYS 140           HA       LYS 140   2.966  20.219 -10.786
 1135    HB2  LYS 140           HB2      LYS 140   0.313  21.640 -10.986
 1136    HB3  LYS 140           HB3      LYS 140   0.656  20.231 -11.991
 1137    HG2  LYS 140           HG2      LYS 140   1.089  20.061  -9.007
 1138    HG3  LYS 140           HG3      LYS 140  -0.541  19.941  -9.661
 1139    HD2  LYS 140           HD2      LYS 140   0.070  18.031 -11.057
 1140    HD3  LYS 140           HD3      LYS 140   1.765  18.155 -10.543
 1141    HE2  LYS 140           HE2      LYS 140   1.127  17.691  -8.211
 1142    HE3  LYS 140           HE3      LYS 140  -0.583  17.664  -8.642
 1143    HZ1  LYS 140           HZ1      LYS 140   1.374  15.726  -9.783
 1144    HZ2  LYS 140           HZ2      LYS 140   0.511  15.422  -8.432
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.273  15.619  -9.838
 1146    H    ARG 141           H        ARG 141   2.231  23.474 -12.140
 1147    HA   ARG 141           HA       ARG 141   2.550  23.061 -14.838
 1148    HB2  ARG 141           HB2      ARG 141   4.193  25.177 -13.365
 1149    HB3  ARG 141           HB3      ARG 141   3.807  25.146 -15.074
 1150    HG2  ARG 141           HG2      ARG 141   1.354  25.571 -14.474
 1151    HG3  ARG 141           HG3      ARG 141   1.846  25.648 -12.800
 1152    HD2  ARG 141           HD2      ARG 141   1.729  27.885 -13.697
 1153    HD3  ARG 141           HD3      ARG 141   3.424  27.496 -13.355
 1154    HE   ARG 141           HE       ARG 141   2.612  26.851 -16.077
 1155   HH11  ARG 141          HH11      ARG 141   3.823  29.516 -14.040
 1156   HH12  ARG 141          HH12      ARG 141   4.522  30.389 -15.355
 1157   HH21  ARG 141          HH21      ARG 141   3.569  28.014 -17.822
 1158   HH22  ARG 141          HH22      ARG 141   4.368  29.517 -17.548
 1159    H    ASP 142           H        ASP 142   5.365  23.150 -12.575
 1160    HA   ASP 142           HA       ASP 142   7.308  22.936 -14.629
 1161    HB2  ASP 142           HB2      ASP 142   7.803  23.758 -12.377
 1162    HB3  ASP 142           HB3      ASP 142   7.466  22.161 -11.693
 1163    H    VAL 143           H        VAL 143   5.579  20.371 -12.831
 1164    HA   VAL 143           HA       VAL 143   7.284  18.311 -14.019
 1165    HB   VAL 143           HB       VAL 143   6.609  17.887 -11.860
 1166   HG11  VAL 143          HG11      VAL 143   4.305  17.568 -11.075
 1167   HG12  VAL 143          HG12      VAL 143   4.667  19.223 -11.532
 1168   HG13  VAL 143          HG13      VAL 143   3.692  18.188 -12.626
 1169   HG21  VAL 143          HG21      VAL 143   4.955  16.097 -13.671
 1170   HG22  VAL 143          HG22      VAL 143   6.691  15.924 -13.296
 1171   HG23  VAL 143          HG23      VAL 143   5.483  15.738 -12.010
 1172    H    TYR 144           H        TYR 144   4.050  19.724 -14.559
 1173    HA   TYR 144           HA       TYR 144   3.293  17.845 -16.538
 1174    HB2  TYR 144           HB2      TYR 144   1.897  19.521 -15.186
 1175    HB3  TYR 144           HB3      TYR 144   2.363  20.728 -16.365
 1176    HD1  TYR 144           HD2      TYR 144   1.711  17.340 -17.792
 1177    HD2  TYR 144           HD1      TYR 144  -0.131  21.017 -16.449
 1178    HE1  TYR 144           HE2      TYR 144  -0.411  16.618 -18.749
 1179    HE2  TYR 144           HE1      TYR 144  -2.263  20.288 -17.412
 1180    HH   TYR 144           HH       TYR 144  -2.670  17.156 -19.143
 1181    H    ARG 145           H        ARG 145   5.196  20.877 -16.712
 1182    HA   ARG 145           HA       ARG 145   5.529  21.003 -19.530
 1183    HB2  ARG 145           HB2      ARG 145   7.382  21.719 -17.225
 1184    HB3  ARG 145           HB3      ARG 145   7.883  21.879 -18.908
 1185    HG2  ARG 145           HG2      ARG 145   5.939  23.390 -19.350
 1186    HG3  ARG 145           HG3      ARG 145   5.502  23.283 -17.642
 1187    HD2  ARG 145           HD2      ARG 145   6.726  25.327 -17.972
 1188    HD3  ARG 145           HD3      ARG 145   7.738  24.215 -17.029
 1189    HE   ARG 145           HE       ARG 145   8.242  23.982 -19.873
 1190   HH11  ARG 145          HH21      ARG 145   8.941  26.132 -17.125
 1191   HH12  ARG 145          HH22      ARG 145  10.418  26.726 -17.789
 1192   HH21  ARG 145          HH11      ARG 145  10.231  24.746 -20.738
 1193   HH22  ARG 145          HH12      ARG 145  11.157  25.927 -19.886
 1194    H    ARG 146           H        ARG 146   7.151  18.772 -17.168
 1195    HA   ARG 146           HA       ARG 146   9.049  17.902 -19.190
 1196    HB2  ARG 146           HB2      ARG 146   8.139  16.061 -16.980
 1197    HB3  ARG 146           HB3      ARG 146   9.695  16.144 -17.761
 1198    HG2  ARG 146           HG2      ARG 146   8.540  17.970 -15.654
 1199    HG3  ARG 146           HG3      ARG 146   9.889  16.854 -15.488
 1200    HD2  ARG 146           HD2      ARG 146  11.245  18.285 -16.994
 1201    HD3  ARG 146           HD3      ARG 146   9.874  19.378 -17.218
 1202    HE   ARG 146           HE       ARG 146   9.920  19.981 -14.902
 1203   HH11  ARG 146          HH11      ARG 146  12.904  18.382 -16.056
 1204   HH12  ARG 146          HH12      ARG 146  13.860  18.930 -14.726
 1205   HH21  ARG 146          HH21      ARG 146  11.161  20.635 -13.141
 1206   HH22  ARG 146          HH22      ARG 146  12.860  20.269 -13.043
 1207    H    VAL 147           H        VAL 147   5.835  16.696 -18.116
 1208    HA   VAL 147           HA       VAL 147   5.690  14.467 -19.881
 1209    HB   VAL 147           HB       VAL 147   3.449  16.273 -18.879
 1210   HG11  VAL 147          HG11      VAL 147   2.664  14.838 -20.705
 1211   HG12  VAL 147          HG12      VAL 147   3.351  13.409 -19.903
 1212   HG13  VAL 147          HG13      VAL 147   1.991  14.299 -19.174
 1213   HG21  VAL 147          HG21      VAL 147   4.758  15.340 -16.972
 1214   HG22  VAL 147          HG22      VAL 147   3.131  14.685 -17.053
 1215   HG23  VAL 147          HG23      VAL 147   4.491  13.702 -17.623
 1216    H    MET 148           H        MET 148   4.825  17.947 -20.370
 1217    HA   MET 148           HA       MET 148   3.812  17.457 -23.002
 1218    HB2  MET 148           HB2      MET 148   4.670  19.979 -21.555
 1219    HB3  MET 148           HB3      MET 148   4.009  19.969 -23.201
 1220    HG2  MET 148           HG2      MET 148   1.996  18.760 -22.382
 1221    HG3  MET 148           HG3      MET 148   2.599  18.926 -20.723
 1222    HE1  MET 148           HE1      MET 148   0.317  20.104 -20.012
 1223    HE2  MET 148           HE2      MET 148  -0.354  21.492 -20.901
 1224    HE3  MET 148           HE3      MET 148  -0.272  19.899 -21.683
 1225    H    LYS 149           H        LYS 149   7.053  18.464 -21.803
 1226    HA   LYS 149           HA       LYS 149   8.170  18.922 -24.388
 1227    HB2  LYS 149           HB2      LYS 149   9.055  19.665 -22.165
 1228    HB3  LYS 149           HB3      LYS 149   9.542  18.016 -21.801
 1229    HG2  LYS 149           HG2      LYS 149  10.546  19.497 -24.271
 1230    HG3  LYS 149           HG3      LYS 149  11.267  19.742 -22.677
 1231    HD2  LYS 149           HD2      LYS 149  11.696  17.251 -22.542
 1232    HD3  LYS 149           HD3      LYS 149  11.239  17.115 -24.235
 1233    HE2  LYS 149           HE2      LYS 149  13.479  18.883 -23.151
 1234    HE3  LYS 149           HE3      LYS 149  13.700  17.280 -23.848
 1235    HZ1  LYS 149           HZ1      LYS 149  12.678  19.657 -25.321
 1236    HZ2  LYS 149           HZ2      LYS 149  14.140  18.965 -25.490
 1237    HZ3  LYS 149           HZ3      LYS 149  12.811  18.147 -25.959
 1238    H    GLU 150           H        GLU 150   7.783  15.995 -22.422
 1239    HA   GLU 150           HA       GLU 150   9.375  14.219 -23.929
 1240    HB2  GLU 150           HB2      GLU 150   6.964  13.907 -22.129
 1241    HB3  GLU 150           HB3      GLU 150   7.568  12.511 -23.002
 1242    HG2  GLU 150           HG2      GLU 150   9.427  14.206 -21.298
 1243    HG3  GLU 150           HG3      GLU 150   8.411  12.958 -20.586
 1244    H    PHE 151           H        PHE 151   6.132  15.500 -24.673
 1245    HA   PHE 151           HA       PHE 151   6.040  13.664 -27.024
 1246    HB2  PHE 151           HB2      PHE 151   3.660  14.791 -25.538
 1247    HB3  PHE 151           HB3      PHE 151   3.675  13.630 -26.847
 1248    HD1  PHE 151           HD1      PHE 151   5.544  11.576 -26.150
 1249    HD2  PHE 151           HD2      PHE 151   2.934  13.830 -23.563
 1250    HE1  PHE 151           HE1      PHE 151   5.497   9.701 -24.555
 1251    HE2  PHE 151           HE2      PHE 151   2.860  11.919 -21.978
 1252    HZ   PHE 151           HZ       PHE 151   4.112   9.845 -22.484
 1253    H    ALA 152           H        ALA 152   6.618  16.902 -26.507
 1254    HA   ALA 152           HA       ALA 152   4.681  18.272 -27.873
 1255    HB1  ALA 152           HB1      ALA 152   6.525  19.368 -26.692
 1256    HB2  ALA 152           HB2      ALA 152   7.687  18.817 -27.922
 1257    HB3  ALA 152           HB3      ALA 152   6.419  19.980 -28.353
 1258    H    SER 153           H        SER 153   7.629  16.901 -29.479
 1259    HA   SER 153           HA       SER 153   6.790  17.660 -32.070
 1260    HB2  SER 153           HB2      SER 153   8.539  15.892 -32.746
 1261    HB3  SER 153           HB3      SER 153   9.048  17.325 -31.844
 1262    HG   SER 153           HG       SER 153   9.941  15.371 -30.967
 1263    H    VAL 154           H        VAL 154   5.673  14.993 -30.095
 1264    HA   VAL 154           HA       VAL 154   5.045  13.197 -32.287
 1265    HB   VAL 154           HB       VAL 154   3.907  13.235 -29.457
 1266   HG11  VAL 154          HG11      VAL 154   4.099  10.985 -31.500
 1267   HG12  VAL 154          HG12      VAL 154   3.518  10.828 -29.825
 1268   HG13  VAL 154          HG13      VAL 154   2.611  11.809 -30.983
 1269   HG21  VAL 154          HG21      VAL 154   5.640  11.542 -28.913
 1270   HG22  VAL 154          HG22      VAL 154   6.357  11.761 -30.527
 1271   HG23  VAL 154          HG23      VAL 154   6.380  13.081 -29.344
 1272    H    VAL 155           H        VAL 155   3.281  15.738 -30.419
 1273    HA   VAL 155           HA       VAL 155   0.886  15.348 -32.085
 1274    HB   VAL 155           HB       VAL 155   1.580  17.575 -30.126
 1275   HG11  VAL 155          HG11      VAL 155  -1.099  16.763 -31.380
 1276   HG12  VAL 155          HG12      VAL 155  -0.868  18.008 -30.129
 1277   HG13  VAL 155          HG13      VAL 155  -0.186  18.255 -31.740
 1278   HG21  VAL 155          HG21      VAL 155   1.448  15.490 -28.912
 1279   HG22  VAL 155          HG22      VAL 155  -0.096  16.325 -28.676
 1280   HG23  VAL 155          HG23      VAL 155  -0.004  14.977 -29.820
 1281    H    MET 156           H        MET 156   3.665  17.660 -31.919
 1282    HA   MET 156           HA       MET 156   2.512  19.438 -33.810
 1283    HB2  MET 156           HB2      MET 156   5.397  18.998 -32.999
 1284    HB3  MET 156           HB3      MET 156   4.864  20.324 -34.040
 1285    HG2  MET 156           HG2      MET 156   3.488  21.272 -32.327
 1286    HG3  MET 156           HG3      MET 156   3.647  19.857 -31.298
 1287    HE1  MET 156           HE1      MET 156   3.945  22.660 -30.099
 1288    HE2  MET 156           HE2      MET 156   4.219  21.162 -29.171
 1289    HE3  MET 156           HE3      MET 156   5.413  22.485 -29.113
 1290    H    SER 157           H        SER 157   4.555  16.538 -34.397
 1291    HA   SER 157           HA       SER 157   5.098  17.053 -37.117
 1292    HB2  SER 157           HB2      SER 157   4.608  14.393 -35.707
 1293    HB3  SER 157           HB3      SER 157   5.377  14.589 -37.294
 1294    HG   SER 157           HG       SER 157   6.328  15.379 -34.744
 1295    H    LEU 158           H        LEU 158   2.043  16.164 -35.633
 1296    HA   LEU 158           HA       LEU 158   0.845  15.132 -38.095
 1297    HB2  LEU 158           HB2      LEU 158  -0.353  16.038 -35.473
 1298    HB3  LEU 158           HB3      LEU 158  -1.228  15.165 -36.733
 1299    HG   LEU 158           HG       LEU 158   1.092  14.049 -35.102
 1300   HD11  LEU 158          HD11      LEU 158  -1.917  13.605 -34.836
 1301   HD12  LEU 158          HD12      LEU 158  -0.641  12.778 -33.907
 1302   HD13  LEU 158          HD13      LEU 158  -0.898  14.525 -33.708
 1303   HD21  LEU 158          HD21      LEU 158   0.896  12.931 -37.278
 1304   HD22  LEU 158          HD22      LEU 158   0.355  11.859 -35.978
 1305   HD23  LEU 158          HD23      LEU 158  -0.846  12.673 -37.009
 1306    H    GLN 159           H        GLN 159   1.396  18.284 -36.678
 1307    HA   GLN 159           HA       GLN 159  -0.887  19.508 -38.167
 1308    HB2  GLN 159           HB2      GLN 159   0.631  20.778 -35.866
 1309    HB3  GLN 159           HB3      GLN 159  -0.982  21.190 -36.463
 1310    HG2  GLN 159           HG2      GLN 159  -0.173  18.715 -34.912
 1311    HG3  GLN 159           HG3      GLN 159  -1.125  20.056 -34.362
 1312   HE21  GLN 159          HE22      GLN 159  -1.766  17.048 -34.626
 1313   HE22  GLN 159          HE21      GLN 159  -3.261  17.022 -35.556
 1314    H    GLU 160           H        GLU 160   2.585  19.762 -37.466
 1315    HA   GLU 160           HA       GLU 160   3.054  21.749 -39.591
 1316    HB2  GLU 160           HB2      GLU 160   4.921  20.330 -37.629
 1317    HB3  GLU 160           HB3      GLU 160   5.398  21.595 -38.770
 1318    HG2  GLU 160           HG2      GLU 160   3.690  23.115 -37.650
 1319    HG3  GLU 160           HG3      GLU 160   3.532  21.892 -36.388
 1320    H    ASN 161           H        ASN 161   1.875  19.191 -40.307
 1321    HA   ASN 161           HA       ASN 161   3.941  17.311 -41.035
 1322    HB2  ASN 161           HB2      ASN 161   1.506  16.773 -40.408
 1323    HB3  ASN 161           HB3      ASN 161   1.059  17.283 -42.038
 1324   HD21  ASN 161          HD22      ASN 161   3.154  15.083 -40.165
 1325   HD22  ASN 161          HD21      ASN 161   3.279  13.827 -41.393
 1326    H    THR 162           H        THR 162   1.812  19.485 -42.893
 1327    HA   THR 162           HA       THR 162   3.685  19.465 -45.114
 1328    HB   THR 162           HB       THR 162   1.540  19.767 -46.563
 1329    HG1  THR 162           HG1      THR 162  -0.311  18.893 -45.683
 1330   HG21  THR 162          HG21      THR 162   2.999  17.756 -46.629
 1331   HG22  THR 162          HG22      THR 162   2.096  17.056 -45.270
 1332   HG23  THR 162          HG23      THR 162   1.290  17.345 -46.828
 1333    HA   PRO 163           HA       PRO 163   1.880  23.896 -44.745
 1334    HB2  PRO 163           HB2      PRO 163   1.947  24.057 -41.730
 1335    HB3  PRO 163           HB3      PRO 163   0.884  24.925 -42.883
 1336    HG2  PRO 163           HG2      PRO 163  -0.066  22.788 -41.516
 1337    HG3  PRO 163           HG3      PRO 163  -0.430  22.954 -43.267
 1338    HD2  PRO 163           HD2      PRO 163   1.742  21.285 -41.952
 1339    HD3  PRO 163           HD3      PRO 163   0.589  20.819 -43.231
 1340    H    LYS 164           H        LYS 164   4.244  22.292 -42.686
 1341    HA   LYS 164           HA       LYS 164   6.208  24.497 -43.095
 1342    HB2  LYS 164           HB2      LYS 164   6.318  22.143 -41.167
 1343    HB3  LYS 164           HB3      LYS 164   7.581  23.340 -41.406
 1344    HG2  LYS 164           HG2      LYS 164   4.801  23.873 -40.268
 1345    HG3  LYS 164           HG3      LYS 164   6.323  23.792 -39.373
 1346    HD2  LYS 164           HD2      LYS 164   7.163  25.768 -40.653
 1347    HD3  LYS 164           HD3      LYS 164   5.571  25.904 -41.441
 1348    HE2  LYS 164           HE2      LYS 164   4.487  26.149 -39.223
 1349    HE3  LYS 164           HE3      LYS 164   6.061  26.006 -38.431
 1350    HZ1  LYS 164           HZ1      LYS 164   5.279  28.191 -40.293
 1351    HZ2  LYS 164           HZ2      LYS 164   5.400  28.318 -38.669
 1352    HZ3  LYS 164           HZ3      LYS 164   6.741  28.057 -39.558
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1  -0.575   1.233  -0.723
    2    H2   MET   1           H2       MET   1  -0.627  -0.387  -0.949
    3    H3   MET   1           H3       MET   1   0.748   0.315  -0.422
    4    HA   MET   1           HA       MET   1   0.967  -0.275  -2.749
    5    HB2  MET   1           HB2      MET   1  -1.479  -0.136  -3.242
    6    HB3  MET   1           HB3      MET   1  -1.384   1.625  -3.188
    7    HG2  MET   1           HG2      MET   1  -1.380   0.787  -5.485
    8    HG3  MET   1           HG3      MET   1   0.129   1.625  -5.134
    9    HE1  MET   1           HE1      MET   1  -0.485  -0.442  -7.674
   10    HE2  MET   1           HE2      MET   1   0.947   0.590  -7.453
   11    HE3  MET   1           HE3      MET   1   1.140  -1.151  -7.760
   12    H    ILE   2           H        ILE   2   3.013   0.730  -2.223
   13    HA   ILE   2           HA       ILE   2   3.303   3.447  -3.273
   14    HB   ILE   2           HB       ILE   2   4.127   2.552  -0.489
   15   HG12  ILE   2          HG12      ILE   2   2.011   3.802  -0.587
   16   HG13  ILE   2          HG13      ILE   2   3.248   4.670   0.288
   17   HG21  ILE   2          HG21      ILE   2   6.184   3.348  -1.400
   18   HG22  ILE   2          HG22      ILE   2   5.405   4.797  -2.075
   19   HG23  ILE   2          HG23      ILE   2   5.559   4.576  -0.311
   20   HD11  ILE   2          HD11      ILE   2   1.941   6.199  -1.075
   21   HD12  ILE   2          HD12      ILE   2   3.610   6.188  -1.646
   22   HD13  ILE   2          HD13      ILE   2   2.349   5.319  -2.552
   23    H    ASP   3           H        ASP   3   5.377   3.652  -4.264
   24    HA   ASP   3           HA       ASP   3   6.222   1.192  -5.462
   25    HB2  ASP   3           HB2      ASP   3   6.204   3.323  -6.648
   26    HB3  ASP   3           HB3      ASP   3   7.441   3.970  -5.564
   27    H    ASP   4           H        ASP   4   7.830   3.363  -3.115
   28    HA   ASP   4           HA       ASP   4   9.148   1.069  -1.915
   29    HB2  ASP   4           HB2      ASP   4  10.826   1.555  -3.589
   30    HB3  ASP   4           HB3      ASP   4  10.833   3.261  -3.143
   31    H    ASP   5           H        ASP   5  10.114   4.495  -1.698
   32    HA   ASP   5           HA       ASP   5   9.814   4.309   1.152
   33    HB2  ASP   5           HB2      ASP   5  11.772   5.349   0.183
   34    HB3  ASP   5           HB3      ASP   5  10.774   6.582  -0.598
   35    H    GLY   6           H        GLY   6   8.387   6.477  -1.285
   36    HA2  GLY   6           HA2      GLY   6   5.893   6.785   0.220
   37    HA3  GLY   6           HA3      GLY   6   6.967   8.178   0.314
   38    H    TYR   7           H        TYR   7   7.142   6.434  -2.712
   39    HA   TYR   7           HA       TYR   7   5.683   8.669  -4.019
   40    HB2  TYR   7           HB2      TYR   7   7.892   6.812  -4.945
   41    HB3  TYR   7           HB3      TYR   7   6.846   7.641  -6.089
   42    HD1  TYR   7           HD1      TYR   7   6.800  10.065  -6.307
   43    HD2  TYR   7           HD2      TYR   7   9.535   8.125  -3.592
   44    HE1  TYR   7           HE1      TYR   7   7.972  12.208  -5.960
   45    HE2  TYR   7           HE2      TYR   7  10.758  10.252  -3.296
   46    HH   TYR   7           HH       TYR   7  10.856  12.547  -3.833
   47    H    ARG   8           H        ARG   8   3.797   8.284  -5.024
   48    HA   ARG   8           HA       ARG   8   2.777   5.482  -4.969
   49    HB2  ARG   8           HB2      ARG   8   1.325   7.244  -4.102
   50    HB3  ARG   8           HB3      ARG   8   1.446   8.150  -5.606
   51    HG2  ARG   8           HG2      ARG   8  -0.694   7.102  -5.589
   52    HG3  ARG   8           HG3      ARG   8   0.267   6.224  -6.773
   53    HD2  ARG   8           HD2      ARG   8   0.763   4.548  -4.833
   54    HD3  ARG   8           HD3      ARG   8  -0.532   5.337  -3.970
   55    HE   ARG   8           HE       ARG   8  -0.691   3.759  -6.509
   56   HH11  ARG   8          HH11      ARG   8  -2.522   5.509  -4.008
   57   HH12  ARG   8          HH12      ARG   8  -4.008   4.694  -4.332
   58   HH21  ARG   8          HH21      ARG   8  -2.671   2.608  -6.890
   59   HH22  ARG   8          HH22      ARG   8  -4.093   3.055  -6.016
   60    HA   PRO   9           HA       PRO   9   4.039   5.456  -9.336
   61    HB2  PRO   9           HB2      PRO   9   3.279   2.949 -10.077
   62    HB3  PRO   9           HB3      PRO   9   4.696   3.268  -9.035
   63    HG2  PRO   9           HG2      PRO   9   1.896   2.495  -8.170
   64    HG3  PRO   9           HG3      PRO   9   3.455   1.766  -7.654
   65    HD2  PRO   9           HD2      PRO   9   2.165   3.647  -6.187
   66    HD3  PRO   9           HD3      PRO   9   3.950   3.600  -6.272
   67    H    ASN  10           H        ASN  10   2.989   6.225 -11.115
   68    HA   ASN  10           HA       ASN  10   0.017   6.169 -11.224
   69    HB2  ASN  10           HB2      ASN  10   1.898   8.569 -11.159
   70    HB3  ASN  10           HB3      ASN  10   0.339   8.676 -11.952
   71   HD21  ASN  10          HD22      ASN  10   1.850   7.945  -8.795
   72   HD22  ASN  10          HD21      ASN  10   0.413   8.373  -7.869
   73    H    VAL  11           H        VAL  11  -0.871   6.690 -13.214
   74    HA   VAL  11           HA       VAL  11   0.849   6.675 -15.664
   75    HB   VAL  11           HB       VAL  11  -1.235   5.834 -16.755
   76   HG11  VAL  11          HG11      VAL  11   0.200   4.073 -14.714
   77   HG12  VAL  11          HG12      VAL  11  -0.812   3.466 -16.022
   78   HG13  VAL  11          HG13      VAL  11   0.675   4.363 -16.398
   79   HG21  VAL  11          HG21      VAL  11  -2.867   6.294 -14.879
   80   HG22  VAL  11          HG22      VAL  11  -2.893   4.625 -15.428
   81   HG23  VAL  11          HG23      VAL  11  -2.084   5.014 -13.924
   82    H    GLY  12           H        GLY  12   0.634   8.584 -16.830
   83    HA2  GLY  12           HA2      GLY  12  -1.655  10.405 -16.171
   84    HA3  GLY  12           HA3      GLY  12  -0.051  10.966 -16.631
   85    H    ILE  13           H        ILE  13  -3.071  10.705 -17.890
   86    HA   ILE  13           HA       ILE  13  -2.226   9.615 -20.527
   87    HB   ILE  13           HB       ILE  13  -5.014  10.567 -19.858
   88   HG12  ILE  13          HG12      ILE  13  -4.725   8.935 -18.118
   89   HG13  ILE  13          HG13      ILE  13  -5.747   8.267 -19.377
   90   HG21  ILE  13          HG21      ILE  13  -4.433  10.183 -22.209
   91   HG22  ILE  13          HG22      ILE  13  -3.987   8.501 -21.819
   92   HG23  ILE  13          HG23      ILE  13  -5.662   9.041 -21.632
   93   HD11  ILE  13          HD11      ILE  13  -3.938   6.838 -20.184
   94   HD12  ILE  13          HD12      ILE  13  -2.768   7.605 -19.083
   95   HD13  ILE  13          HD13      ILE  13  -4.102   6.646 -18.435
   96    H    VAL  14           H        VAL  14  -1.226  11.174 -21.789
   97    HA   VAL  14           HA       VAL  14  -2.236  13.974 -21.655
   98    HB   VAL  14           HB       VAL  14  -0.023  12.780 -23.370
   99   HG11  VAL  14          HG11      VAL  14  -1.054  14.782 -24.404
  100   HG12  VAL  14          HG12      VAL  14  -0.820  15.687 -22.884
  101   HG13  VAL  14          HG13      VAL  14   0.575  15.134 -23.831
  102   HG21  VAL  14          HG21      VAL  14   1.464  14.150 -21.869
  103   HG22  VAL  14          HG22      VAL  14   0.088  14.332 -20.770
  104   HG23  VAL  14          HG23      VAL  14   0.755  12.709 -21.147
  105    H    ILE  15           H        ILE  15  -4.439  13.390 -22.325
  106    HA   ILE  15           HA       ILE  15  -4.827  12.114 -24.915
  107    HB   ILE  15           HB       ILE  15  -6.648  14.078 -23.451
  108   HG12  ILE  15          HG12      ILE  15  -6.341  11.911 -22.246
  109   HG13  ILE  15          HG13      ILE  15  -7.986  12.258 -22.749
  110   HG21  ILE  15          HG21      ILE  15  -7.247  14.234 -25.745
  111   HG22  ILE  15          HG22      ILE  15  -7.140  12.473 -25.970
  112   HG23  ILE  15          HG23      ILE  15  -8.441  13.188 -24.979
  113   HD11  ILE  15          HD11      ILE  15  -7.850  10.683 -24.607
  114   HD12  ILE  15          HD12      ILE  15  -6.111  10.463 -24.368
  115   HD13  ILE  15          HD13      ILE  15  -7.275   9.861 -23.155
  116    H    CYS  16           H        CYS  16  -4.487  12.935 -26.825
  117    HA   CYS  16           HA       CYS  16  -4.104  15.887 -27.118
  118    HB2  CYS  16           HB2      CYS  16  -2.109  14.703 -27.806
  119    HB3  CYS  16           HB3      CYS  16  -3.059  13.646 -28.891
  120    HG   CYS  16           HG       CYS  16  -2.911  16.981 -28.914
  121    H    ASN  17           H        ASN  17  -5.589  16.913 -28.440
  122    HA   ASN  17           HA       ASN  17  -7.995  15.254 -28.909
  123    HB2  ASN  17           HB2      ASN  17  -7.683  17.568 -27.544
  124    HB3  ASN  17           HB3      ASN  17  -8.129  18.249 -29.093
  125   HD21  ASN  17          HD22      ASN  17  -9.056  16.359 -26.367
  126   HD22  ASN  17          HD21      ASN  17 -10.757  16.211 -26.736
  127    H    ARG  18           H        ARG  18  -5.812  15.187 -30.896
  128    HA   ARG  18           HA       ARG  18  -5.305  15.355 -33.066
  129    HB2  ARG  18           HB2      ARG  18  -8.321  15.182 -33.384
  130    HB3  ARG  18           HB3      ARG  18  -7.132  15.031 -34.693
  131    HG2  ARG  18           HG2      ARG  18  -6.068  13.127 -33.499
  132    HG3  ARG  18           HG3      ARG  18  -7.348  13.182 -32.267
  133    HD2  ARG  18           HD2      ARG  18  -7.963  13.042 -35.228
  134    HD3  ARG  18           HD3      ARG  18  -7.601  11.574 -34.308
  135    HE   ARG  18           HE       ARG  18  -9.482  11.943 -32.883
  136   HH11  ARG  18          HH11      ARG  18  -9.549  13.880 -35.889
  137   HH12  ARG  18          HH12      ARG  18 -11.262  14.065 -35.890
  138   HH21  ARG  18          HH21      ARG  18 -11.804  12.159 -32.934
  139   HH22  ARG  18          HH22      ARG  18 -12.545  13.096 -34.177
  140    H    GLN  19           H        GLN  19  -6.897  18.047 -31.810
  141    HA   GLN  19           HA       GLN  19  -6.360  19.593 -34.264
  142    HB2  GLN  19           HB2      GLN  19  -7.489  21.438 -33.157
  143    HB3  GLN  19           HB3      GLN  19  -8.434  19.963 -33.161
  144    HG2  GLN  19           HG2      GLN  19  -7.267  19.736 -30.688
  145    HG3  GLN  19           HG3      GLN  19  -7.287  21.483 -30.867
  146   HE21  GLN  19          HE22      GLN  19  -9.501  18.564 -31.080
  147   HE22  GLN  19          HE21      GLN  19 -10.830  19.430 -30.349
  148    H    GLY  20           H        GLY  20  -4.181  18.306 -32.480
  149    HA2  GLY  20           HA2      GLY  20  -1.944  18.834 -32.239
  150    HA3  GLY  20           HA3      GLY  20  -2.272  20.513 -32.679
  151    H    GLN  21           H        GLN  21  -4.293  19.292 -30.123
  152    HA   GLN  21           HA       GLN  21  -2.742  20.909 -28.163
  153    HB2  GLN  21           HB2      GLN  21  -5.746  21.137 -28.383
  154    HB3  GLN  21           HB3      GLN  21  -4.589  22.171 -27.556
  155    HG2  GLN  21           HG2      GLN  21  -5.167  22.049 -30.503
  156    HG3  GLN  21           HG3      GLN  21  -5.423  23.394 -29.423
  157   HE21  GLN  21          HE22      GLN  21  -3.709  22.792 -32.040
  158   HE22  GLN  21          HE21      GLN  21  -2.182  23.545 -31.648
  159    H    VAL  22           H        VAL  22  -3.958  20.521 -25.834
  160    HA   VAL  22           HA       VAL  22  -4.307  17.577 -25.670
  161    HB   VAL  22           HB       VAL  22  -2.689  17.620 -23.715
  162   HG11  VAL  22          HG11      VAL  22  -1.609  18.188 -26.500
  163   HG12  VAL  22          HG12      VAL  22  -0.715  17.436 -25.156
  164   HG13  VAL  22          HG13      VAL  22  -2.123  16.612 -25.850
  165   HG21  VAL  22          HG21      VAL  22  -1.015  19.344 -23.588
  166   HG22  VAL  22          HG22      VAL  22  -1.705  20.224 -24.962
  167   HG23  VAL  22          HG23      VAL  22  -2.602  20.125 -23.428
  168    H    MET  23           H        MET  23  -4.700  16.815 -23.481
  169    HA   MET  23           HA       MET  23  -7.268  17.229 -22.882
  170    HB2  MET  23           HB2      MET  23  -5.636  15.362 -22.177
  171    HB3  MET  23           HB3      MET  23  -5.179  16.369 -20.825
  172    HG2  MET  23           HG2      MET  23  -6.883  14.735 -20.158
  173    HG3  MET  23           HG3      MET  23  -7.461  16.387 -19.993
  174    HE1  MET  23           HE1      MET  23  -9.838  15.274 -19.618
  175    HE2  MET  23           HE2      MET  23  -9.908  16.832 -20.463
  176    HE3  MET  23           HE3      MET  23 -10.929  15.484 -21.011
  177    H    TRP  24           H        TRP  24  -8.542  18.540 -21.595
  178    HA   TRP  24           HA       TRP  24  -7.627  19.534 -19.093
  179    HB2  TRP  24           HB2      TRP  24  -6.818  21.271 -20.870
  180    HB3  TRP  24           HB3      TRP  24  -8.505  21.717 -20.988
  181    HD1  TRP  24           HD1      TRP  24  -9.112  23.679 -19.509
  182    HE1  TRP  24           HE1      TRP  24  -8.132  24.843 -17.449
  183    HE3  TRP  24           HE3      TRP  24  -5.340  20.390 -18.442
  184    HZ2  TRP  24           HZ2      TRP  24  -5.873  24.477 -15.660
  185    HZ3  TRP  24           HZ3      TRP  24  -3.804  20.816 -16.546
  186    HH2  TRP  24           HH2      TRP  24  -4.038  22.866 -15.169
  187    H    ALA  25           H        ALA  25  -9.448  19.707 -17.740
  188    HA   ALA  25           HA       ALA  25 -12.167  19.900 -18.785
  189    HB1  ALA  25           HB1      ALA  25 -11.755  17.495 -19.128
  190    HB2  ALA  25           HB2      ALA  25 -11.126  17.328 -17.465
  191    HB3  ALA  25           HB3      ALA  25 -12.833  17.697 -17.742
  192    H    ARG  26           H        ARG  26 -13.724  20.072 -16.955
  193    HA   ARG  26           HA       ARG  26 -12.401  21.342 -14.607
  194    HB2  ARG  26           HB2      ARG  26 -14.188  22.519 -15.991
  195    HB3  ARG  26           HB3      ARG  26 -15.364  21.407 -15.293
  196    HG2  ARG  26           HG2      ARG  26 -14.700  22.181 -13.002
  197    HG3  ARG  26           HG3      ARG  26 -13.513  23.282 -13.718
  198    HD2  ARG  26           HD2      ARG  26 -16.515  23.388 -14.186
  199    HD3  ARG  26           HD3      ARG  26 -15.618  24.421 -13.051
  200    HE   ARG  26           HE       ARG  26 -14.360  24.781 -15.507
  201   HH11  ARG  26          HH11      ARG  26 -17.605  25.387 -14.159
  202   HH12  ARG  26          HH12      ARG  26 -17.955  26.696 -15.229
  203   HH21  ARG  26          HH21      ARG  26 -14.865  26.497 -16.963
  204   HH22  ARG  26          HH22      ARG  26 -16.360  27.350 -16.834
  205    H    ARG  27           H        ARG  27 -12.462  20.413 -12.584
  206    HA   ARG  27           HA       ARG  27 -13.045  17.602 -12.584
  207    HB2  ARG  27           HB2      ARG  27 -11.025  18.840 -11.617
  208    HB3  ARG  27           HB3      ARG  27 -12.023  19.239 -10.247
  209    HG2  ARG  27           HG2      ARG  27 -11.316  16.430 -11.229
  210    HG3  ARG  27           HG3      ARG  27 -10.518  17.283  -9.913
  211    HD2  ARG  27           HD2      ARG  27 -12.601  17.202  -8.592
  212    HD3  ARG  27           HD3      ARG  27 -13.397  16.320  -9.909
  213    HE   ARG  27           HE       ARG  27 -11.047  14.924  -9.238
  214   HH11  ARG  27          HH11      ARG  27 -14.265  15.641  -7.850
  215   HH12  ARG  27          HH12      ARG  27 -14.258  14.256  -6.810
  216   HH21  ARG  27          HH21      ARG  27 -11.141  13.023  -8.047
  217   HH22  ARG  27          HH22      ARG  27 -12.423  12.728  -6.903
  218    H    PHE  28           H        PHE  28 -14.772  16.631 -11.869
  219    HA   PHE  28           HA       PHE  28 -17.234  17.817 -11.145
  220    HB2  PHE  28           HB2      PHE  28 -17.182  15.691 -12.192
  221    HB3  PHE  28           HB3      PHE  28 -15.971  15.071 -11.098
  222    HD1  PHE  28           HD1      PHE  28 -19.604  15.818 -11.379
  223    HD2  PHE  28           HD2      PHE  28 -16.446  13.952  -9.110
  224    HE1  PHE  28           HE1      PHE  28 -21.291  14.502 -10.106
  225    HE2  PHE  28           HE2      PHE  28 -18.133  12.536  -7.931
  226    HZ   PHE  28           HZ       PHE  28 -20.558  12.865  -8.389
  227    H    GLY  29           H        GLY  29 -18.122  18.363  -9.190
  228    HA2  GLY  29           HA2      GLY  29 -18.476  18.560  -6.960
  229    HA3  GLY  29           HA3      GLY  29 -17.315  17.257  -6.680
  230    H    GLN  30           H        GLN  30 -15.263  19.064  -8.232
  231    HA   GLN  30           HA       GLN  30 -14.335  20.525  -5.831
  232    HB2  GLN  30           HB2      GLN  30 -13.074  18.617  -6.886
  233    HB3  GLN  30           HB3      GLN  30 -12.904  19.607  -8.338
  234    HG2  GLN  30           HG2      GLN  30 -11.684  21.309  -6.903
  235    HG3  GLN  30           HG3      GLN  30 -11.729  20.132  -5.590
  236   HE21  GLN  30          HE22      GLN  30 -10.165  21.016  -8.618
  237   HE22  GLN  30          HE21      GLN  30  -9.069  19.647  -8.710
  238    H    HIS  31           H        HIS  31 -15.163  20.942  -9.278
  239    HA   HIS  31           HA       HIS  31 -15.512  22.694 -10.577
  240    HB2  HIS  31           HB2      HIS  31 -16.096  24.232  -8.034
  241    HB3  HIS  31           HB3      HIS  31 -16.641  24.627  -9.663
  242    HD1  HIS  31           HD1      HIS  31 -18.565  22.925 -10.720
  243    HD2  HIS  31           HD2      HIS  31 -17.446  22.352  -6.698
  244    HE1  HIS  31           HE1      HIS  31 -20.299  21.368  -9.710
  245    H    SER  32           H        SER  32 -12.843  22.173 -10.143
  246    HA   SER  32           HA       SER  32 -11.755  24.719 -11.090
  247    HB2  SER  32           HB2      SER  32  -9.632  24.334  -9.777
  248    HB3  SER  32           HB3      SER  32 -11.032  24.860  -8.838
  249    HG   SER  32           HG       SER  32 -10.001  23.206  -7.756
  250    H    TRP  33           H        TRP  33  -9.464  24.117 -12.156
  251    HA   TRP  33           HA       TRP  33 -10.292  22.163 -14.099
  252    HB2  TRP  33           HB2      TRP  33  -7.837  23.915 -13.953
  253    HB3  TRP  33           HB3      TRP  33  -8.313  22.909 -15.322
  254    HD1  TRP  33           HD1      TRP  33  -8.966  26.276 -13.811
  255    HE1  TRP  33           HE1      TRP  33 -10.742  27.545 -15.130
  256    HE3  TRP  33           HE3      TRP  33 -10.543  22.503 -16.864
  257    HZ2  TRP  33           HZ2      TRP  33 -12.623  27.000 -17.279
  258    HZ3  TRP  33           HZ3      TRP  33 -12.386  22.862 -18.484
  259    HH2  TRP  33           HH2      TRP  33 -13.436  25.091 -18.706
  260    H    GLN  34           H        GLN  34  -9.057  20.537 -15.008
  261    HA   GLN  34           HA       GLN  34  -8.280  18.502 -13.295
  262    HB2  GLN  34           HB2      GLN  34  -9.221  18.268 -15.564
  263    HB3  GLN  34           HB3      GLN  34  -7.777  18.980 -16.269
  264    HG2  GLN  34           HG2      GLN  34  -6.480  17.025 -15.772
  265    HG3  GLN  34           HG3      GLN  34  -7.744  16.337 -14.764
  266   HE21  GLN  34          HE22      GLN  34  -7.826  14.334 -16.122
  267   HE22  GLN  34          HE21      GLN  34  -8.506  14.442 -17.723
  268    H    PHE  35           H        PHE  35  -6.382  17.331 -13.064
  269    HA   PHE  35           HA       PHE  35  -3.806  18.305 -14.067
  270    HB2  PHE  35           HB2      PHE  35  -2.895  17.614 -11.689
  271    HB3  PHE  35           HB3      PHE  35  -3.376  19.247 -12.067
  272    HD1  PHE  35           HD2      PHE  35  -4.398  16.204 -10.151
  273    HD2  PHE  35           HD1      PHE  35  -5.251  20.345 -11.038
  274    HE1  PHE  35           HE2      PHE  35  -5.914  16.318  -8.196
  275    HE2  PHE  35           HE1      PHE  35  -6.752  20.453  -9.075
  276    HZ   PHE  35           HZ       PHE  35  -7.086  18.438  -7.641
  277    HA   PRO  36           HA       PRO  36  -5.193  14.070 -14.867
  278    HB2  PRO  36           HB2      PRO  36  -2.919  13.875 -16.774
  279    HB3  PRO  36           HB3      PRO  36  -4.649  13.536 -17.046
  280    HG2  PRO  36           HG2      PRO  36  -3.468  15.813 -18.017
  281    HG3  PRO  36           HG3      PRO  36  -5.144  15.811 -17.399
  282    HD2  PRO  36           HD2      PRO  36  -2.621  16.731 -16.009
  283    HD3  PRO  36           HD3      PRO  36  -4.236  17.489 -16.028
  284    H    GLN  37           H        GLN  37  -4.587  12.044 -14.242
  285    HA   GLN  37           HA       GLN  37  -2.457  10.587 -14.159
  286    HB2  GLN  37           HB2      GLN  37  -1.972  12.438 -11.891
  287    HB3  GLN  37           HB3      GLN  37  -1.608  10.725 -11.690
  288    HG2  GLN  37           HG2      GLN  37  -0.002  10.618 -13.335
  289    HG3  GLN  37           HG3      GLN  37  -0.556  12.046 -14.182
  290   HE21  GLN  37          HE22      GLN  37  -0.446  14.138 -12.952
  291   HE22  GLN  37          HE21      GLN  37   0.866  14.383 -11.781
  292    H    GLY  38           H        GLY  38  -2.772   8.636 -13.078
  293    HA2  GLY  38           HA2      GLY  38  -4.835   8.456 -10.972
  294    HA3  GLY  38           HA3      GLY  38  -5.005   7.405 -12.390
  295    H    GLY  39           H        GLY  39  -4.331   6.770  -9.501
  296    HA2  GLY  39           HA2      GLY  39  -1.551   5.998  -9.362
  297    HA3  GLY  39           HA3      GLY  39  -2.842   5.593  -8.220
  298    H    ILE  40           H        ILE  40  -0.750   3.941  -9.577
  299    HA   ILE  40           HA       ILE  40  -2.199   2.109 -11.347
  300    HB   ILE  40           HB       ILE  40   0.559   2.004 -10.073
  301   HG12  ILE  40          HG12      ILE  40  -0.476   2.564 -12.891
  302   HG13  ILE  40          HG13      ILE  40   0.259   3.723 -11.802
  303   HG21  ILE  40          HG21      ILE  40   1.060   0.065 -11.486
  304   HG22  ILE  40          HG22      ILE  40  -0.242  -0.321 -10.386
  305   HG23  ILE  40          HG23      ILE  40  -0.606   0.041 -12.093
  306   HD11  ILE  40          HD11      ILE  40   2.408   2.313 -11.957
  307   HD12  ILE  40          HD12      ILE  40   1.612   1.442 -13.276
  308   HD13  ILE  40          HD13      ILE  40   1.912   3.183 -13.416
  309    H    ASN  41           H        ASN  41  -3.084   0.121 -10.812
  310    HA   ASN  41           HA       ASN  41  -3.915  -0.228  -8.011
  311    HB2  ASN  41           HB2      ASN  41  -5.624  -0.360  -9.753
  312    HB3  ASN  41           HB3      ASN  41  -4.688  -1.530 -10.663
  313   HD21  ASN  41          HD22      ASN  41  -6.914  -1.113  -7.958
  314   HD22  ASN  41          HD21      ASN  41  -7.094  -2.816  -7.621
  315    HA   PRO  42           HA       PRO  42  -0.683  -2.970  -7.124
  316    HB2  PRO  42           HB2      PRO  42  -1.799  -4.780  -5.315
  317    HB3  PRO  42           HB3      PRO  42  -1.244  -3.128  -4.926
  318    HG2  PRO  42           HG2      PRO  42  -4.053  -4.035  -5.607
  319    HG3  PRO  42           HG3      PRO  42  -3.532  -2.968  -4.266
  320    HD2  PRO  42           HD2      PRO  42  -4.523  -1.900  -6.509
  321    HD3  PRO  42           HD3      PRO  42  -3.073  -1.166  -5.770
  322    H    GLY  43           H        GLY  43   0.065  -4.160  -8.623
  323    HA2  GLY  43           HA2      GLY  43   0.609  -6.193  -9.639
  324    HA3  GLY  43           HA3      GLY  43  -0.939  -6.887  -9.123
  325    H    GLU  44           H        GLU  44  -1.580  -3.847 -10.470
  326    HA   GLU  44           HA       GLU  44  -2.266  -4.965 -13.141
  327    HB2  GLU  44           HB2      GLU  44  -3.922  -3.670 -11.834
  328    HB3  GLU  44           HB3      GLU  44  -2.875  -2.241 -11.941
  329    HG2  GLU  44           HG2      GLU  44  -3.291  -1.943 -14.193
  330    HG3  GLU  44           HG3      GLU  44  -3.552  -3.661 -14.486
  331    H    SER  45           H        SER  45  -0.916  -4.675 -14.847
  332    HA   SER  45           HA       SER  45   1.586  -3.308 -14.557
  333    HB2  SER  45           HB2      SER  45   1.494  -3.970 -17.159
  334    HB3  SER  45           HB3      SER  45   1.900  -5.093 -15.858
  335    HG   SER  45           HG       SER  45   0.340  -6.202 -16.818
  336    H    ALA  46           H        ALA  46   2.378  -1.646 -16.014
  337    HA   ALA  46           HA       ALA  46   1.064   0.704 -15.469
  338    HB1  ALA  46           HB1      ALA  46   2.611   1.752 -17.091
  339    HB2  ALA  46           HB2      ALA  46   3.452   0.533 -16.112
  340    HB3  ALA  46           HB3      ALA  46   2.965   0.148 -17.787
  341    H    GLU  47           H        GLU  47   1.007  -1.046 -18.609
  342    HA   GLU  47           HA       GLU  47  -0.551   0.922 -19.915
  343    HB2  GLU  47           HB2      GLU  47  -0.845  -1.915 -20.816
  344    HB3  GLU  47           HB3      GLU  47  -0.723  -0.433 -21.740
  345    HG2  GLU  47           HG2      GLU  47   1.284  -1.479 -22.202
  346    HG3  GLU  47           HG3      GLU  47   1.751  -0.356 -20.921
  347    H    GLN  48           H        GLN  48  -1.494  -2.112 -18.344
  348    HA   GLN  48           HA       GLN  48  -4.273  -2.005 -18.777
  349    HB2  GLN  48           HB2      GLN  48  -2.562  -3.297 -16.595
  350    HB3  GLN  48           HB3      GLN  48  -4.296  -3.513 -16.711
  351    HG2  GLN  48           HG2      GLN  48  -2.961  -5.369 -17.725
  352    HG3  GLN  48           HG3      GLN  48  -4.168  -4.658 -18.782
  353   HE21  GLN  48          HE22      GLN  48  -0.606  -4.340 -18.051
  354   HE22  GLN  48          HE21      GLN  48  -0.141  -3.959 -19.698
  355    H    ALA  49           H        ALA  49  -2.250  -0.466 -16.233
  356    HA   ALA  49           HA       ALA  49  -4.492   0.657 -14.803
  357    HB1  ALA  49           HB1      ALA  49  -1.549   1.411 -14.831
  358    HB2  ALA  49           HB2      ALA  49  -2.770   2.001 -13.683
  359    HB3  ALA  49           HB3      ALA  49  -2.333   0.271 -13.716
  360    H    MET  50           H        MET  50  -2.433   1.875 -17.545
  361    HA   MET  50           HA       MET  50  -3.373   4.575 -17.503
  362    HB2  MET  50           HB2      MET  50  -2.754   2.887 -19.935
  363    HB3  MET  50           HB3      MET  50  -2.937   4.636 -19.894
  364    HG2  MET  50           HG2      MET  50  -0.889   5.028 -19.009
  365    HG3  MET  50           HG3      MET  50  -0.739   3.438 -18.257
  366    HE1  MET  50           HE1      MET  50  -2.019   3.532 -22.078
  367    HE2  MET  50           HE2      MET  50  -1.251   5.109 -21.755
  368    HE3  MET  50           HE3      MET  50  -0.474   3.952 -22.855
  369    H    TYR  51           H        TYR  51  -4.681   1.695 -19.120
  370    HA   TYR  51           HA       TYR  51  -6.977   3.061 -20.103
  371    HB2  TYR  51           HB2      TYR  51  -6.646   0.095 -19.535
  372    HB3  TYR  51           HB3      TYR  51  -7.918   0.833 -20.488
  373    HD1  TYR  51           HD2      TYR  51  -7.179   2.242 -22.608
  374    HD2  TYR  51           HD1      TYR  51  -4.607  -0.515 -20.553
  375    HE1  TYR  51           HE2      TYR  51  -5.829   1.995 -24.655
  376    HE2  TYR  51           HE1      TYR  51  -3.118  -0.645 -22.504
  377    HH   TYR  51           HH       TYR  51  -2.905  -0.104 -24.817
  378    H    ARG  52           H        ARG  52  -6.360   1.639 -16.912
  379    HA   ARG  52           HA       ARG  52  -9.084   1.810 -16.009
  380    HB2  ARG  52           HB2      ARG  52  -7.013   0.586 -14.929
  381    HB3  ARG  52           HB3      ARG  52  -6.648   2.165 -14.226
  382    HG2  ARG  52           HG2      ARG  52  -7.875   1.059 -12.566
  383    HG3  ARG  52           HG3      ARG  52  -9.028   2.169 -13.309
  384    HD2  ARG  52           HD2      ARG  52 -10.195   0.148 -13.053
  385    HD3  ARG  52           HD3      ARG  52  -9.780   0.165 -14.780
  386    HE   ARG  52           HE       ARG  52  -7.689  -1.238 -13.560
  387   HH11  ARG  52          HH21      ARG  52 -11.259  -1.588 -13.608
  388   HH12  ARG  52          HH22      ARG  52 -11.221  -3.309 -13.503
  389   HH21  ARG  52          HH11      ARG  52  -7.672  -3.526 -13.588
  390   HH22  ARG  52          HH12      ARG  52  -9.147  -4.433 -13.423
  391    H    ALA  53           H        ALA  53  -6.281   4.119 -15.646
  392    HA   ALA  53           HA       ALA  53  -7.785   6.167 -14.451
  393    HB1  ALA  53           HB1      ALA  53  -5.919   7.636 -15.134
  394    HB2  ALA  53           HB2      ALA  53  -5.319   6.094 -14.484
  395    HB3  ALA  53           HB3      ALA  53  -5.323   6.389 -16.242
  396    H    LEU  54           H        LEU  54  -7.308   5.416 -17.886
  397    HA   LEU  54           HA       LEU  54  -8.358   7.724 -19.141
  398    HB2  LEU  54           HB2      LEU  54  -7.166   5.839 -20.219
  399    HB3  LEU  54           HB3      LEU  54  -8.476   4.763 -19.740
  400    HG   LEU  54           HG       LEU  54 -10.006   5.918 -21.319
  401   HD11  LEU  54          HD11      LEU  54  -8.959   7.301 -23.100
  402   HD12  LEU  54          HD12      LEU  54  -8.786   8.084 -21.517
  403   HD13  LEU  54          HD13      LEU  54  -7.400   7.235 -22.246
  404   HD21  LEU  54          HD21      LEU  54  -9.020   4.793 -23.247
  405   HD22  LEU  54          HD22      LEU  54  -7.478   4.632 -22.362
  406   HD23  LEU  54          HD23      LEU  54  -8.952   3.823 -21.754
  407    H    PHE  55           H        PHE  55  -9.922   4.822 -17.887
  408    HA   PHE  55           HA       PHE  55 -12.634   5.627 -18.514
  409    HB2  PHE  55           HB2      PHE  55 -12.548   3.363 -18.461
  410    HB3  PHE  55           HB3      PHE  55 -11.258   3.301 -17.290
  411    HD1  PHE  55           HD2      PHE  55 -14.944   3.577 -17.666
  412    HD2  PHE  55           HD1      PHE  55 -11.625   3.122 -14.957
  413    HE1  PHE  55           HE2      PHE  55 -16.523   3.019 -15.810
  414    HE2  PHE  55           HE1      PHE  55 -13.205   2.575 -13.106
  415    HZ   PHE  55           HZ       PHE  55 -15.655   2.536 -13.539
  416    H    GLU  56           H        GLU  56 -10.653   5.671 -15.475
  417    HA   GLU  56           HA       GLU  56 -12.781   6.589 -13.837
  418    HB2  GLU  56           HB2      GLU  56  -9.757   6.834 -13.544
  419    HB3  GLU  56           HB3      GLU  56 -10.896   7.344 -12.298
  420    HG2  GLU  56           HG2      GLU  56 -11.795   5.078 -12.098
  421    HG3  GLU  56           HG3      GLU  56 -10.706   4.502 -13.358
  422    H    GLU  57           H        GLU  57 -10.338   8.402 -15.734
  423    HA   GLU  57           HA       GLU  57 -11.204  10.963 -14.658
  424    HB2  GLU  57           HB2      GLU  57  -9.208  10.346 -16.883
  425    HB3  GLU  57           HB3      GLU  57  -9.561  11.921 -16.187
  426    HG2  GLU  57           HG2      GLU  57  -8.840  10.805 -13.915
  427    HG3  GLU  57           HG3      GLU  57  -8.109   9.567 -14.945
  428    H    VAL  58           H        VAL  58 -10.818   9.933 -18.088
  429    HA   VAL  58           HA       VAL  58 -12.841  11.935 -18.754
  430    HB   VAL  58           HB       VAL  58 -11.975  11.753 -21.029
  431   HG11  VAL  58          HG11      VAL  58  -9.824  12.779 -20.573
  432   HG12  VAL  58          HG12      VAL  58 -10.996  13.309 -19.345
  433   HG13  VAL  58          HG13      VAL  58  -9.753  12.094 -18.944
  434   HG21  VAL  58          HG21      VAL  58  -9.853   9.850 -19.939
  435   HG22  VAL  58          HG22      VAL  58 -11.219   9.353 -20.967
  436   HG23  VAL  58          HG23      VAL  58 -10.003  10.484 -21.586
  437    H    GLY  59           H        GLY  59 -12.986   8.576 -18.240
  438    HA2  GLY  59           HA2      GLY  59 -14.783   7.150 -18.529
  439    HA3  GLY  59           HA3      GLY  59 -15.758   8.528 -19.055
  440    H    LEU  60           H        LEU  60 -12.763   6.989 -20.252
  441    HA   LEU  60           HA       LEU  60 -14.034   6.309 -22.852
  442    HB2  LEU  60           HB2      LEU  60 -11.254   7.420 -22.277
  443    HB3  LEU  60           HB3      LEU  60 -11.657   6.573 -23.758
  444    HG   LEU  60           HG       LEU  60 -12.772   9.215 -22.758
  445   HD11  LEU  60          HD11      LEU  60 -11.634  10.086 -24.804
  446   HD12  LEU  60          HD12      LEU  60 -10.489   9.239 -23.763
  447   HD13  LEU  60          HD13      LEU  60 -11.130   8.457 -25.227
  448   HD21  LEU  60          HD21      LEU  60 -13.632   7.622 -25.207
  449   HD22  LEU  60          HD22      LEU  60 -14.644   8.189 -23.871
  450   HD23  LEU  60          HD23      LEU  60 -13.958   9.356 -24.993
  451    H    SER  61           H        SER  61 -13.129   4.347 -23.747
  452    HA   SER  61           HA       SER  61 -12.056   2.521 -21.637
  453    HB2  SER  61           HB2      SER  61 -13.867   1.959 -24.014
  454    HB3  SER  61           HB3      SER  61 -13.304   0.771 -22.814
  455    HG   SER  61           HG       SER  61 -15.426   1.579 -22.327
  456    H    ARG  62           H        ARG  62 -10.951   0.581 -22.733
  457    HA   ARG  62           HA       ARG  62  -8.595   1.563 -23.953
  458    HB2  ARG  62           HB2      ARG  62  -7.756  -0.703 -23.587
  459    HB3  ARG  62           HB3      ARG  62  -8.685  -0.147 -22.206
  460    HG2  ARG  62           HG2      ARG  62 -10.676  -1.500 -23.261
  461    HG3  ARG  62           HG3      ARG  62  -9.407  -2.275 -24.211
  462    HD2  ARG  62           HD2      ARG  62  -9.643  -3.681 -22.326
  463    HD3  ARG  62           HD3      ARG  62  -8.203  -2.735 -21.989
  464    HE   ARG  62           HE       ARG  62  -9.253  -1.727 -20.188
  465   HH11  ARG  62          HH11      ARG  62 -11.698  -3.542 -22.042
  466   HH12  ARG  62          HH12      ARG  62 -12.929  -3.360 -20.845
  467   HH21  ARG  62          HH21      ARG  62 -10.912  -1.477 -18.614
  468   HH22  ARG  62          HH22      ARG  62 -12.464  -2.179 -18.862
  469    H    LYS  63           H        LYS  63 -10.325   2.266 -25.712
  470    HA   LYS  63           HA       LYS  63  -9.626   0.893 -28.200
  471    HB2  LYS  63           HB2      LYS  63 -11.914   0.340 -28.800
  472    HB3  LYS  63           HB3      LYS  63 -11.458  -0.456 -27.283
  473    HG2  LYS  63           HG2      LYS  63 -12.778   1.121 -25.970
  474    HG3  LYS  63           HG3      LYS  63 -13.114   2.106 -27.388
  475    HD2  LYS  63           HD2      LYS  63 -15.062   0.803 -26.841
  476    HD3  LYS  63           HD3      LYS  63 -14.415   0.293 -28.408
  477    HE2  LYS  63           HE2      LYS  63 -13.338  -1.681 -27.314
  478    HE3  LYS  63           HE3      LYS  63 -13.973  -1.155 -25.746
  479    HZ1  LYS  63           HZ1      LYS  63 -15.371  -2.858 -26.755
  480    HZ2  LYS  63           HZ2      LYS  63 -16.223  -1.474 -26.627
  481    HZ3  LYS  63           HZ3      LYS  63 -15.638  -1.943 -28.081
  482    H    ASP  64           H        ASP  64 -10.841   3.622 -26.403
  483    HA   ASP  64           HA       ASP  64 -11.874   5.069 -28.735
  484    HB2  ASP  64           HB2      ASP  64 -11.550   5.680 -25.778
  485    HB3  ASP  64           HB3      ASP  64 -12.222   6.824 -26.922
  486    H    VAL  65           H        VAL  65  -8.777   4.474 -27.809
  487    HA   VAL  65           HA       VAL  65  -7.728   7.050 -28.699
  488    HB   VAL  65           HB       VAL  65  -6.316   7.274 -26.715
  489   HG11  VAL  65          HG11      VAL  65  -8.543   8.478 -26.907
  490   HG12  VAL  65          HG12      VAL  65  -9.225   7.247 -25.841
  491   HG13  VAL  65          HG13      VAL  65  -7.917   8.293 -25.255
  492   HG21  VAL  65          HG21      VAL  65  -8.067   5.127 -25.418
  493   HG22  VAL  65          HG22      VAL  65  -6.365   4.922 -25.863
  494   HG23  VAL  65          HG23      VAL  65  -6.811   6.092 -24.613
  495    H    ARG  66           H        ARG  66  -5.222   6.872 -28.697
  496    HA   ARG  66           HA       ARG  66  -4.286   4.163 -29.477
  497    HB2  ARG  66           HB2      ARG  66  -5.091   4.963 -31.575
  498    HB3  ARG  66           HB3      ARG  66  -4.707   6.641 -31.192
  499    HG2  ARG  66           HG2      ARG  66  -3.186   5.970 -32.885
  500    HG3  ARG  66           HG3      ARG  66  -2.318   6.163 -31.372
  501    HD2  ARG  66           HD2      ARG  66  -2.807   3.509 -31.195
  502    HD3  ARG  66           HD3      ARG  66  -2.921   3.662 -32.944
  503    HE   ARG  66           HE       ARG  66  -0.572   4.176 -31.174
  504   HH11  ARG  66          HH11      ARG  66  -1.751   3.871 -34.537
  505   HH12  ARG  66          HH12      ARG  66  -0.167   3.758 -35.215
  506   HH21  ARG  66          HH21      ARG  66   1.488   4.045 -32.073
  507   HH22  ARG  66          HH22      ARG  66   1.724   3.858 -33.779
  508    H    ILE  67           H        ILE  67  -2.197   3.962 -28.562
  509    HA   ILE  67           HA       ILE  67  -0.972   6.312 -27.330
  510    HB   ILE  67           HB       ILE  67   0.058   3.462 -27.573
  511   HG12  ILE  67          HG12      ILE  67  -1.272   4.657 -25.110
  512   HG13  ILE  67          HG13      ILE  67  -2.238   3.830 -26.329
  513   HG21  ILE  67          HG21      ILE  67   1.473   4.092 -25.613
  514   HG22  ILE  67          HG22      ILE  67   1.837   5.086 -27.011
  515   HG23  ILE  67          HG23      ILE  67   0.841   5.755 -25.695
  516   HD11  ILE  67          HD11      ILE  67   0.086   2.559 -24.821
  517   HD12  ILE  67          HD12      ILE  67  -1.637   2.297 -24.532
  518   HD13  ILE  67          HD13      ILE  67  -0.911   1.774 -26.068
  519    H    LEU  68           H        LEU  68   0.495   7.642 -28.204
  520    HA   LEU  68           HA       LEU  68   1.840   6.805 -30.758
  521    HB2  LEU  68           HB2      LEU  68   0.663   9.382 -29.825
  522    HB3  LEU  68           HB3      LEU  68   2.230   9.533 -30.591
  523    HG   LEU  68           HG       LEU  68   0.270   9.826 -32.103
  524   HD11  LEU  68          HD11      LEU  68   2.521   9.282 -32.994
  525   HD12  LEU  68          HD12      LEU  68   2.145   7.546 -32.891
  526   HD13  LEU  68          HD13      LEU  68   1.236   8.596 -33.994
  527   HD21  LEU  68          HD21      LEU  68  -0.091   6.832 -31.945
  528   HD22  LEU  68          HD22      LEU  68  -1.141   8.035 -31.152
  529   HD23  LEU  68          HD23      LEU  68  -1.003   7.997 -32.926
  530    H    ALA  69           H        ALA  69   2.459   8.069 -27.458
  531    HA   ALA  69           HA       ALA  69   5.289   7.362 -27.710
  532    HB1  ALA  69           HB1      ALA  69   5.234   9.646 -28.727
  533    HB2  ALA  69           HB2      ALA  69   4.425  10.279 -27.284
  534    HB3  ALA  69           HB3      ALA  69   6.086   9.657 -27.177
  535    H    SER  70           H        SER  70   6.401   7.699 -25.541
  536    HA   SER  70           HA       SER  70   4.651   8.275 -23.265
  537    HB2  SER  70           HB2      SER  70   5.311   6.220 -22.079
  538    HB3  SER  70           HB3      SER  70   4.381   5.889 -23.553
  539    HG   SER  70           HG       SER  70   6.060   4.482 -23.657
  540    H    THR  71           H        THR  71   5.989   8.664 -21.232
  541    HA   THR  71           HA       THR  71   8.339  10.169 -21.910
  542    HB   THR  71           HB       THR  71   8.593  10.206 -19.345
  543    HG1  THR  71           HG1      THR  71   7.418   8.514 -18.642
  544   HG21  THR  71          HG21      THR  71   6.616  11.699 -19.070
  545   HG22  THR  71          HG22      THR  71   7.578  12.056 -20.518
  546   HG23  THR  71          HG23      THR  71   6.042  11.188 -20.686
  547    H    ARG  72           H        ARG  72  10.467   9.637 -21.836
  548    HA   ARG  72           HA       ARG  72  11.055   6.941 -22.414
  549    HB2  ARG  72           HB2      ARG  72  12.793   9.349 -21.782
  550    HB3  ARG  72           HB3      ARG  72  13.488   7.795 -22.266
  551    HG2  ARG  72           HG2      ARG  72  12.279   7.820 -24.376
  552    HG3  ARG  72           HG3      ARG  72  11.442   9.315 -23.953
  553    HD2  ARG  72           HD2      ARG  72  14.466   9.065 -24.215
  554    HD3  ARG  72           HD3      ARG  72  13.392   9.589 -25.518
  555    HE   ARG  72           HE       ARG  72  12.620  11.418 -23.869
  556   HH11  ARG  72          HH11      ARG  72  16.017  10.284 -23.993
  557   HH12  ARG  72          HH12      ARG  72  16.642  11.802 -23.455
  558   HH21  ARG  72          HH21      ARG  72  13.387  13.276 -23.243
  559   HH22  ARG  72          HH22      ARG  72  15.097  13.595 -22.957
  560    H    ASN  73           H        ASN  73  11.047   8.495 -19.268
  561    HA   ASN  73           HA       ASN  73  11.311   5.924 -18.051
  562    HB2  ASN  73           HB2      ASN  73  13.101   6.267 -16.563
  563    HB3  ASN  73           HB3      ASN  73  13.751   6.661 -18.142
  564   HD21  ASN  73          HD22      ASN  73  13.778   9.128 -18.696
  565   HD22  ASN  73          HD21      ASN  73  14.080  10.222 -17.370
  566    H    TRP  74           H        TRP  74  10.971   6.272 -15.543
  567    HA   TRP  74           HA       TRP  74   8.490   7.669 -15.319
  568    HB2  TRP  74           HB2      TRP  74  10.274   6.459 -13.162
  569    HB3  TRP  74           HB3      TRP  74   8.622   7.021 -12.941
  570    HD1  TRP  74           HD1      TRP  74  10.608   4.222 -14.678
  571    HE1  TRP  74           HE1      TRP  74   9.057   2.298 -15.277
  572    HE3  TRP  74           HE3      TRP  74   6.169   6.211 -13.084
  573    HZ2  TRP  74           HZ2      TRP  74   6.234   1.767 -15.315
  574    HZ3  TRP  74           HZ3      TRP  74   4.056   4.944 -13.390
  575    HH2  TRP  74           HH2      TRP  74   4.040   2.789 -14.602
  576    H    LEU  75           H        LEU  75   8.119   9.720 -14.835
  577    HA   LEU  75           HA       LEU  75  10.259  11.544 -13.878
  578    HB2  LEU  75           HB2      LEU  75   7.354  11.943 -14.726
  579    HB3  LEU  75           HB3      LEU  75   8.365  13.238 -14.104
  580    HG   LEU  75           HG       LEU  75   8.948  11.661 -16.647
  581   HD11  LEU  75          HD11      LEU  75   8.180  13.682 -17.818
  582   HD12  LEU  75          HD12      LEU  75   6.895  13.017 -16.786
  583   HD13  LEU  75          HD13      LEU  75   7.778  14.457 -16.261
  584   HD21  LEU  75          HD21      LEU  75  11.017  12.595 -15.704
  585   HD22  LEU  75          HD22      LEU  75  10.535  13.541 -17.111
  586   HD23  LEU  75          HD23      LEU  75  10.234  14.177 -15.478
  587    H    ARG  76           H        ARG  76   9.585  12.971 -11.956
  588    HA   ARG  76           HA       ARG  76   7.416  12.027 -10.325
  589    HB2  ARG  76           HB2      ARG  76   8.717  11.571  -8.257
  590    HB3  ARG  76           HB3      ARG  76   8.953  10.399  -9.522
  591    HG2  ARG  76           HG2      ARG  76  11.054  10.607  -8.671
  592    HG3  ARG  76           HG3      ARG  76  11.151  11.627 -10.098
  593    HD2  ARG  76           HD2      ARG  76  10.927  13.648  -8.683
  594    HD3  ARG  76           HD3      ARG  76  10.709  12.650  -7.243
  595    HE   ARG  76           HE       ARG  76  13.168  13.256  -8.714
  596   HH11  ARG  76          HH12      ARG  76  11.748  11.083  -6.267
  597   HH12  ARG  76          HH11      ARG  76  13.276  10.616  -5.607
  598   HH21  ARG  76          HH21      ARG  76  15.186  12.652  -7.804
  599   HH22  ARG  76          HH22      ARG  76  15.262  11.532  -6.494
  600    H    TYR  77           H        TYR  77   6.930  13.544  -8.594
  601    HA   TYR  77           HA       TYR  77   8.584  15.935  -8.387
  602    HB2  TYR  77           HB2      TYR  77   6.652  17.487  -8.519
  603    HB3  TYR  77           HB3      TYR  77   7.091  16.773 -10.044
  604    HD1  TYR  77           HD1      TYR  77   4.683  16.080  -7.190
  605    HD2  TYR  77           HD2      TYR  77   5.331  16.236 -11.459
  606    HE1  TYR  77           HE1      TYR  77   2.364  15.442  -7.559
  607    HE2  TYR  77           HE2      TYR  77   2.988  15.634 -11.851
  608    HH   TYR  77           HH       TYR  77   0.683  14.932  -9.149
  609    H    LYS  78           H        LYS  78   7.764  17.220  -6.476
  610    HA   LYS  78           HA       LYS  78   7.185  15.260  -4.302
  611    HB2  LYS  78           HB2      LYS  78   9.455  16.310  -4.345
  612    HB3  LYS  78           HB3      LYS  78   8.721  17.903  -4.325
  613    HG2  LYS  78           HG2      LYS  78   9.473  17.505  -2.146
  614    HG3  LYS  78           HG3      LYS  78   7.718  17.346  -2.065
  615    HD2  LYS  78           HD2      LYS  78   7.972  14.861  -2.131
  616    HD3  LYS  78           HD3      LYS  78   9.722  15.034  -2.184
  617    HE2  LYS  78           HE2      LYS  78   7.916  16.067   0.068
  618    HE3  LYS  78           HE3      LYS  78   8.762  14.514   0.095
  619    HZ1  LYS  78           HZ1      LYS  78  10.100  17.168   0.032
  620    HZ2  LYS  78           HZ2      LYS  78  10.018  16.155   1.302
  621    HZ3  LYS  78           HZ3      LYS  78  10.879  15.726  -0.013
  622    H    LEU  79           H        LEU  79   5.300  15.544  -3.259
  623    HA   LEU  79           HA       LEU  79   3.465  17.712  -3.898
  624    HB2  LEU  79           HB2      LEU  79   3.473  15.467  -1.850
  625    HB3  LEU  79           HB3      LEU  79   2.160  16.635  -1.944
  626    HG   LEU  79           HG       LEU  79   2.958  14.890  -4.303
  627   HD11  LEU  79          HD11      LEU  79   2.325  13.430  -2.392
  628   HD12  LEU  79          HD12      LEU  79   0.807  14.327  -2.206
  629   HD13  LEU  79          HD13      LEU  79   1.126  13.368  -3.679
  630   HD21  LEU  79          HD21      LEU  79   1.564  16.897  -4.811
  631   HD22  LEU  79          HD22      LEU  79   0.687  15.388  -5.094
  632   HD23  LEU  79          HD23      LEU  79   0.357  16.341  -3.628
  633    HA   PRO  80           HA       PRO  80   5.152  20.372  -0.651
  634    HB2  PRO  80           HB2      PRO  80   3.155  22.204  -0.368
  635    HB3  PRO  80           HB3      PRO  80   4.112  22.099  -1.879
  636    HG2  PRO  80           HG2      PRO  80   1.473  20.716  -1.262
  637    HG3  PRO  80           HG3      PRO  80   1.825  21.831  -2.662
  638    HD2  PRO  80           HD2      PRO  80   1.995  19.161  -2.963
  639    HD3  PRO  80           HD3      PRO  80   3.262  20.213  -3.661
  640    H    LYS  81           H        LYS  81   4.878  20.587   1.697
  641    HA   LYS  81           HA       LYS  81   3.633  18.297   2.659
  642    HB2  LYS  81           HB2      LYS  81   4.281  19.001   4.934
  643    HB3  LYS  81           HB3      LYS  81   5.587  19.171   3.759
  644    HG2  LYS  81           HG2      LYS  81   5.406  21.569   3.750
  645    HG3  LYS  81           HG3      LYS  81   3.819  21.532   4.519
  646    HD2  LYS  81           HD2      LYS  81   5.541  22.250   6.115
  647    HD3  LYS  81           HD3      LYS  81   4.724  20.778   6.614
  648    HE2  LYS  81           HE2      LYS  81   7.002  20.458   7.138
  649    HE3  LYS  81           HE3      LYS  81   6.668  19.425   5.750
  650    HZ1  LYS  81           HZ1      LYS  81   7.752  21.134   4.340
  651    HZ2  LYS  81           HZ2      LYS  81   8.026  22.079   5.655
  652    HZ3  LYS  81           HZ3      LYS  81   8.763  20.635   5.517
  653    H    ARG  82           H        ARG  82   2.124  21.345   2.344
  654    HA   ARG  82           HA       ARG  82  -0.029  20.850   4.183
  655    HB2  ARG  82           HB2      ARG  82  -1.052  22.815   3.240
  656    HB3  ARG  82           HB3      ARG  82   0.664  23.094   3.478
  657    HG2  ARG  82           HG2      ARG  82   0.743  22.328   0.850
  658    HG3  ARG  82           HG3      ARG  82  -0.936  22.847   0.930
  659    HD2  ARG  82           HD2      ARG  82   0.369  24.702   0.190
  660    HD3  ARG  82           HD3      ARG  82  -0.135  25.055   1.857
  661    HE   ARG  82           HE       ARG  82   2.434  23.757   1.863
  662   HH11  ARG  82          HH21      ARG  82   0.965  26.883   1.011
  663   HH12  ARG  82          HH22      ARG  82   2.394  27.808   1.308
  664   HH21  ARG  82          HH12      ARG  82   4.352  25.001   2.280
  665   HH22  ARG  82          HH11      ARG  82   4.352  26.707   2.040
  666    H    LEU  83           H        LEU  83   0.607  19.824   0.883
  667    HA   LEU  83           HA       LEU  83  -2.208  19.005   0.496
  668    HB2  LEU  83           HB2      LEU  83  -0.930  20.261  -1.281
  669    HB3  LEU  83           HB3      LEU  83   0.139  18.854  -1.420
  670    HG   LEU  83           HG       LEU  83  -1.754  17.463  -2.170
  671   HD11  LEU  83          HD11      LEU  83  -3.918  18.577  -2.796
  672   HD12  LEU  83          HD12      LEU  83  -3.675  18.494  -1.056
  673   HD13  LEU  83          HD13      LEU  83  -3.397  20.028  -1.916
  674   HD21  LEU  83          HD21      LEU  83  -0.367  18.716  -3.770
  675   HD22  LEU  83          HD22      LEU  83  -2.027  18.525  -4.360
  676   HD23  LEU  83          HD23      LEU  83  -1.494  20.087  -3.690
  677    H    VAL  84           H        VAL  84   1.001  17.696   1.153
  678    HA   VAL  84           HA       VAL  84   0.424  14.932   0.799
  679    HB   VAL  84           HB       VAL  84   2.205  16.362   2.822
  680   HG11  VAL  84          HG11      VAL  84   3.364  14.205   3.159
  681   HG12  VAL  84          HG12      VAL  84   1.704  14.106   3.712
  682   HG13  VAL  84          HG13      VAL  84   2.154  13.377   2.160
  683   HG21  VAL  84          HG21      VAL  84   2.874  16.622   0.434
  684   HG22  VAL  84          HG22      VAL  84   4.038  15.649   1.333
  685   HG23  VAL  84          HG23      VAL  84   2.856  14.858   0.256
  686    H    ARG  85           H        ARG  85  -0.723  13.528   1.974
  687    HA   ARG  85           HA       ARG  85  -2.829  14.602   3.661
  688    HB2  ARG  85           HB2      ARG  85  -2.114  11.837   2.604
  689    HB3  ARG  85           HB3      ARG  85  -3.293  11.984   3.898
  690    HG2  ARG  85           HG2      ARG  85  -4.393  11.853   1.763
  691    HG3  ARG  85           HG3      ARG  85  -4.744  13.356   2.624
  692    HD2  ARG  85           HD2      ARG  85  -4.514  13.942   0.354
  693    HD3  ARG  85           HD3      ARG  85  -3.058  14.527   1.143
  694    HE   ARG  85           HE       ARG  85  -2.663  11.860   0.092
  695   HH11  ARG  85          HH22      ARG  85  -2.620  15.248  -0.920
  696   HH12  ARG  85          HH21      ARG  85  -2.429  14.896  -2.613
  697   HH21  ARG  85          HH11      ARG  85  -2.266  11.372  -2.130
  698   HH22  ARG  85          HH12      ARG  85  -2.124  12.643  -3.288
  699    H    TRP  86           H        TRP  86  -0.028  12.595   4.301
  700    HA   TRP  86           HA       TRP  86   0.962  11.716   6.090
  701    HB2  TRP  86           HB2      TRP  86  -0.377  13.829   7.770
  702    HB3  TRP  86           HB3      TRP  86   1.037  12.881   8.194
  703    HD1  TRP  86           HD1      TRP  86  -0.052  15.745   5.955
  704    HE1  TRP  86           HE1      TRP  86   1.954  17.046   5.086
  705    HE3  TRP  86           HE3      TRP  86   3.651  12.679   7.695
  706    HZ2  TRP  86           HZ2      TRP  86   4.860  16.704   5.022
  707    HZ3  TRP  86           HZ3      TRP  86   6.026  13.155   7.163
  708    HH2  TRP  86           HH2      TRP  86   6.640  15.160   5.823
  709    H    ASP  87           H        ASP  87  -2.216  11.368   5.596
  710    HA   ASP  87           HA       ASP  87  -2.718   9.517   7.881
  711    HB2  ASP  87           HB2      ASP  87  -4.476  11.149   7.298
  712    HB3  ASP  87           HB3      ASP  87  -4.528  10.513   5.653
  713    H    THR  88           H        THR  88  -1.511   9.520   4.670
  714    HA   THR  88           HA       THR  88  -2.290   6.815   3.920
  715    HB   THR  88           HB       THR  88  -0.618   7.504   2.014
  716    HG1  THR  88           HG1      THR  88  -0.829   9.995   1.938
  717   HG21  THR  88          HG21      THR  88  -3.182   9.118   2.378
  718   HG22  THR  88          HG22      THR  88  -2.351   8.754   0.841
  719   HG23  THR  88          HG23      THR  88  -3.097   7.448   1.773
  720    H    LYS  89           H        LYS  89  -0.771   5.099   3.991
  721    HA   LYS  89           HA       LYS  89   1.791   5.598   5.425
  722    HB2  LYS  89           HB2      LYS  89  -0.366   3.667   6.309
  723    HB3  LYS  89           HB3      LYS  89   1.323   3.600   6.843
  724    HG2  LYS  89           HG2      LYS  89   1.154   5.918   7.721
  725    HG3  LYS  89           HG3      LYS  89  -0.546   5.988   7.220
  726    HD2  LYS  89           HD2      LYS  89  -1.105   4.137   8.691
  727    HD3  LYS  89           HD3      LYS  89   0.605   4.015   9.204
  728    HE2  LYS  89           HE2      LYS  89   0.493   6.337  10.089
  729    HE3  LYS  89           HE3      LYS  89  -1.195   6.459   9.568
  730    HZ1  LYS  89           HZ1      LYS  89  -1.737   4.675  11.132
  731    HZ2  LYS  89           HZ2      LYS  89  -0.178   4.563  11.619
  732    HZ3  LYS  89           HZ3      LYS  89  -1.033   5.920  11.915
  733    HA   PRO  90           HA       PRO  90   3.961   5.145   4.916
  734    HB2  PRO  90           HB2      PRO  90   4.890   5.162   2.053
  735    HB3  PRO  90           HB3      PRO  90   5.857   5.090   3.561
  736    HG2  PRO  90           HG2      PRO  90   5.448   2.853   2.073
  737    HG3  PRO  90           HG3      PRO  90   5.354   2.774   3.867
  738    HD2  PRO  90           HD2      PRO  90   3.072   2.943   1.877
  739    HD3  PRO  90           HD3      PRO  90   3.233   1.921   3.333
  740    H    VAL  91           H        VAL  91   4.181   7.454   4.715
  741    HA   VAL  91           HA       VAL  91   1.946   8.848   3.739
  742    HB   VAL  91           HB       VAL  91   3.242  10.900   4.192
  743   HG11  VAL  91          HG11      VAL  91   3.318  10.641   6.595
  744   HG12  VAL  91          HG12      VAL  91   1.945   9.731   5.951
  745   HG13  VAL  91          HG13      VAL  91   3.406   8.871   6.459
  746   HG21  VAL  91          HG21      VAL  91   5.530   9.105   5.123
  747   HG22  VAL  91          HG22      VAL  91   5.559  10.134   3.671
  748   HG23  VAL  91          HG23      VAL  91   5.410  10.869   5.270
  749    H    CYS  92           H        CYS  92   1.426   9.706   1.893
  750    HA   CYS  92           HA       CYS  92   3.105   8.956  -0.410
  751    HB2  CYS  92           HB2      CYS  92   0.752   8.354  -0.256
  752    HB3  CYS  92           HB3      CYS  92   0.292  10.080  -0.203
  753    HG   CYS  92           HG       CYS  92  -0.200   9.103  -2.609
  754    H    ILE  93           H        ILE  93   4.671  10.349  -0.859
  755    HA   ILE  93           HA       ILE  93   4.236  13.261  -0.437
  756    HB   ILE  93           HB       ILE  93   6.701  13.368  -0.118
  757   HG12  ILE  93          HG12      ILE  93   7.850  11.279   0.642
  758   HG13  ILE  93          HG13      ILE  93   6.513  10.333  -0.007
  759   HG21  ILE  93          HG21      ILE  93   5.163  11.588   1.816
  760   HG22  ILE  93          HG22      ILE  93   6.594  12.562   2.196
  761   HG23  ILE  93          HG23      ILE  93   5.088  13.362   1.742
  762   HD11  ILE  93          HD11      ILE  93   8.273  12.153  -1.697
  763   HD12  ILE  93          HD12      ILE  93   8.570  10.427  -1.433
  764   HD13  ILE  93          HD13      ILE  93   7.109  10.934  -2.278
  765    H    GLY  94           H        GLY  94   4.490  11.048  -2.997
  766    HA2  GLY  94           HA2      GLY  94   4.403  13.267  -4.830
  767    HA3  GLY  94           HA3      GLY  94   5.978  12.481  -4.885
  768    H    GLN  95           H        GLN  95   4.486  12.520  -7.121
  769    HA   GLN  95           HA       GLN  95   3.163   9.851  -7.390
  770    HB2  GLN  95           HB2      GLN  95   3.064  12.463  -8.966
  771    HB3  GLN  95           HB3      GLN  95   2.611  10.936  -9.688
  772    HG2  GLN  95           HG2      GLN  95   0.643  12.182  -9.029
  773    HG3  GLN  95           HG3      GLN  95   0.736  10.654  -8.227
  774   HE21  GLN  95          HE22      GLN  95  -0.616  11.197  -6.415
  775   HE22  GLN  95          HE21      GLN  95  -0.095  12.342  -5.211
  776    H    LYS  96           H        LYS  96   4.706   8.312  -7.971
  777    HA   LYS  96           HA       LYS  96   7.011   9.013  -9.751
  778    HB2  LYS  96           HB2      LYS  96   7.556   7.183  -8.296
  779    HB3  LYS  96           HB3      LYS  96   5.967   6.443  -8.447
  780    HG2  LYS  96           HG2      LYS  96   6.446   5.777 -10.774
  781    HG3  LYS  96           HG3      LYS  96   8.015   6.597 -10.714
  782    HD2  LYS  96           HD2      LYS  96   8.821   5.020  -9.045
  783    HD3  LYS  96           HD3      LYS  96   7.200   4.302  -8.897
  784    HE2  LYS  96           HE2      LYS  96   7.280   3.516 -11.235
  785    HE3  LYS  96           HE3      LYS  96   8.847   4.304 -11.479
  786    HZ1  LYS  96           HZ1      LYS  96   9.025   1.897 -11.003
  787    HZ2  LYS  96           HZ2      LYS  96   9.837   2.787  -9.899
  788    HZ3  LYS  96           HZ3      LYS  96   8.397   2.129  -9.495
  789    H    GLN  97           H        GLN  97   6.475   9.265 -11.968
  790    HA   GLN  97           HA       GLN  97   3.837   8.150 -12.820
  791    HB2  GLN  97           HB2      GLN  97   3.173  10.352 -13.631
  792    HB3  GLN  97           HB3      GLN  97   3.556  10.390 -11.908
  793    HG2  GLN  97           HG2      GLN  97   5.932  11.195 -12.701
  794    HG3  GLN  97           HG3      GLN  97   5.138  11.535 -14.221
  795   HE21  GLN  97          HE22      GLN  97   4.944  12.215 -10.655
  796   HE22  GLN  97          HE21      GLN  97   4.368  13.863 -10.885
  797    H    LYS  98           H        LYS  98   3.742   7.283 -14.823
  798    HA   LYS  98           HA       LYS  98   5.834   8.151 -16.779
  799    HB2  LYS  98           HB2      LYS  98   5.982   5.737 -16.171
  800    HB3  LYS  98           HB3      LYS  98   4.311   5.497 -16.690
  801    HG2  LYS  98           HG2      LYS  98   5.002   6.171 -19.010
  802    HG3  LYS  98           HG3      LYS  98   6.659   6.406 -18.427
  803    HD2  LYS  98           HD2      LYS  98   6.796   4.008 -17.778
  804    HD3  LYS  98           HD3      LYS  98   5.127   3.764 -18.279
  805    HE2  LYS  98           HE2      LYS  98   6.463   2.918 -20.043
  806    HE3  LYS  98           HE3      LYS  98   5.759   4.425 -20.631
  807    HZ1  LYS  98           HZ1      LYS  98   8.544   4.131 -19.609
  808    HZ2  LYS  98           HZ2      LYS  98   8.131   4.170 -21.184
  809    HZ3  LYS  98           HZ3      LYS  98   7.926   5.511 -20.281
  810    H    TRP  99           H        TRP  99   4.982   9.232 -18.537
  811    HA   TRP  99           HA       TRP  99   2.009   9.513 -18.577
  812    HB2  TRP  99           HB2      TRP  99   4.196  11.420 -19.409
  813    HB3  TRP  99           HB3      TRP  99   2.511  11.622 -19.836
  814    HD1  TRP  99           HD1      TRP  99   4.721  11.552 -16.670
  815    HE1  TRP  99           HE1      TRP  99   3.718  13.219 -14.980
  816    HE3  TRP  99           HE3      TRP  99   0.315  12.634 -19.039
  817    HZ2  TRP  99           HZ2      TRP  99   1.418  14.910 -14.763
  818    HZ3  TRP  99           HZ3      TRP  99  -1.200  14.373 -18.144
  819    HH2  TRP  99           HH2      TRP  99  -0.671  15.496 -15.980
  820    H    PHE 100           H        PHE 100   0.945   9.313 -20.537
  821    HA   PHE 100           HA       PHE 100   2.543   8.256 -22.820
  822    HB2  PHE 100           HB2      PHE 100  -0.071   7.200 -21.682
  823    HB3  PHE 100           HB3      PHE 100   0.576   6.750 -23.251
  824    HD1  PHE 100           HD1      PHE 100   1.392   6.661 -19.573
  825    HD2  PHE 100           HD2      PHE 100   2.139   5.014 -23.489
  826    HE1  PHE 100           HE1      PHE 100   2.680   4.802 -18.554
  827    HE2  PHE 100           HE2      PHE 100   3.417   3.157 -22.462
  828    HZ   PHE 100           HZ       PHE 100   3.658   3.023 -19.997
  829    H    LEU 101           H        LEU 101   2.133   9.217 -24.693
  830    HA   LEU 101           HA       LEU 101   0.125  11.360 -24.884
  831    HB2  LEU 101           HB2      LEU 101   2.266  11.770 -25.943
  832    HB3  LEU 101           HB3      LEU 101   2.195  10.217 -26.781
  833    HG   LEU 101           HG       LEU 101   0.265  10.989 -28.122
  834   HD11  LEU 101          HD11      LEU 101  -0.385  13.337 -28.130
  835   HD12  LEU 101          HD12      LEU 101  -0.766  12.610 -26.575
  836   HD13  LEU 101          HD13      LEU 101   0.661  13.670 -26.720
  837   HD21  LEU 101          HD21      LEU 101   2.585  11.304 -28.934
  838   HD22  LEU 101          HD22      LEU 101   1.505  12.578 -29.531
  839   HD23  LEU 101          HD23      LEU 101   2.635  12.910 -28.196
  840    H    LEU 102           H        LEU 102  -1.902  10.675 -25.139
  841    HA   LEU 102           HA       LEU 102  -2.453   8.309 -26.863
  842    HB2  LEU 102           HB2      LEU 102  -3.863   9.563 -24.482
  843    HB3  LEU 102           HB3      LEU 102  -4.841   8.816 -25.724
  844    HG   LEU 102           HG       LEU 102  -4.482   7.247 -23.955
  845   HD11  LEU 102          HD11      LEU 102  -2.681   6.235 -26.147
  846   HD12  LEU 102          HD12      LEU 102  -3.988   5.384 -25.305
  847   HD13  LEU 102          HD13      LEU 102  -4.317   6.633 -26.549
  848   HD21  LEU 102          HD21      LEU 102  -2.349   6.375 -23.288
  849   HD22  LEU 102          HD22      LEU 102  -1.480   7.297 -24.531
  850   HD23  LEU 102          HD23      LEU 102  -2.224   8.142 -23.167
  851    H    GLN 103           H        GLN 103  -3.360   8.672 -28.793
  852    HA   GLN 103           HA       GLN 103  -4.286  11.442 -29.389
  853    HB2  GLN 103           HB2      GLN 103  -3.909   8.963 -31.118
  854    HB3  GLN 103           HB3      GLN 103  -4.704  10.429 -31.701
  855    HG2  GLN 103           HG2      GLN 103  -1.864  10.305 -30.593
  856    HG3  GLN 103           HG3      GLN 103  -2.284  10.342 -32.305
  857   HE21  GLN 103          HE22      GLN 103  -0.548  12.291 -31.138
  858   HE22  GLN 103          HE21      GLN 103  -1.411  13.822 -31.175
  859    H    LEU 104           H        LEU 104  -6.424  11.976 -29.365
  860    HA   LEU 104           HA       LEU 104  -8.327  10.076 -28.321
  861    HB2  LEU 104           HB2      LEU 104  -8.350  12.511 -27.883
  862    HB3  LEU 104           HB3      LEU 104  -8.661  12.829 -29.585
  863    HG   LEU 104           HG       LEU 104 -10.871  11.810 -29.438
  864   HD11  LEU 104          HD11      LEU 104 -10.541   9.978 -27.834
  865   HD12  LEU 104          HD12      LEU 104 -10.141  11.143 -26.542
  866   HD13  LEU 104          HD13      LEU 104 -11.782  11.054 -27.221
  867   HD21  LEU 104          HD21      LEU 104 -10.635  14.170 -28.812
  868   HD22  LEU 104          HD22      LEU 104 -11.860  13.426 -27.763
  869   HD23  LEU 104          HD23      LEU 104 -10.233  13.715 -27.141
  870    H    VAL 105           H        VAL 105  -8.990   8.369 -29.588
  871    HA   VAL 105           HA       VAL 105  -9.019   8.639 -32.527
  872    HB   VAL 105           HB       VAL 105  -9.507   6.312 -30.638
  873   HG11  VAL 105          HG11      VAL 105 -10.964   5.900 -32.512
  874   HG12  VAL 105          HG12      VAL 105  -9.649   6.257 -33.662
  875   HG13  VAL 105          HG13      VAL 105  -9.566   4.836 -32.593
  876   HG21  VAL 105          HG21      VAL 105  -7.450   5.434 -31.532
  877   HG22  VAL 105          HG22      VAL 105  -7.319   6.771 -32.699
  878   HG23  VAL 105          HG23      VAL 105  -7.136   7.084 -30.966
  879    H    SER 106           H        SER 106 -11.254   8.464 -29.706
  880    HA   SER 106           HA       SER 106 -13.584   8.693 -31.467
  881    HB2  SER 106           HB2      SER 106 -14.816   8.643 -29.391
  882    HB3  SER 106           HB3      SER 106 -13.652   7.313 -29.473
  883    HG   SER 106           HG       SER 106 -13.594   8.378 -27.428
  884    H    GLY 107           H        GLY 107 -13.967  10.714 -28.773
  885    HA2  GLY 107           HA2      GLY 107 -13.108  13.246 -29.644
  886    HA3  GLY 107           HA3      GLY 107 -14.659  12.933 -30.425
  887    H    ASP 108           H        ASP 108 -14.584  15.021 -28.695
  888    HA   ASP 108           HA       ASP 108 -15.265  14.694 -26.051
  889    HB2  ASP 108           HB2      ASP 108 -16.143  16.803 -26.124
  890    HB3  ASP 108           HB3      ASP 108 -15.048  16.839 -27.490
  891    H    ALA 109           H        ALA 109 -17.305  13.904 -28.871
  892    HA   ALA 109           HA       ALA 109 -19.785  13.755 -27.487
  893    HB1  ALA 109           HB1      ALA 109 -18.848  12.257 -29.978
  894    HB2  ALA 109           HB2      ALA 109 -20.526  12.447 -29.445
  895    HB3  ALA 109           HB3      ALA 109 -19.601  13.874 -29.951
  896    H    GLU 110           H        GLU 110 -17.063  11.495 -27.597
  897    HA   GLU 110           HA       GLU 110 -18.707   9.342 -26.439
  898    HB2  GLU 110           HB2      GLU 110 -15.943   9.247 -27.649
  899    HB3  GLU 110           HB3      GLU 110 -16.835   7.863 -27.031
  900    HG2  GLU 110           HG2      GLU 110 -17.518   9.551 -29.470
  901    HG3  GLU 110           HG3      GLU 110 -16.986   7.875 -29.449
  902    H    ILE 111           H        ILE 111 -16.181  11.641 -25.704
  903    HA   ILE 111           HA       ILE 111 -15.184  10.440 -23.274
  904    HB   ILE 111           HB       ILE 111 -15.256  13.172 -24.516
  905   HG12  ILE 111          HG12      ILE 111 -12.987  11.396 -23.640
  906   HG13  ILE 111          HG13      ILE 111 -13.618  11.540 -25.297
  907   HG21  ILE 111          HG21      ILE 111 -15.552  13.639 -22.084
  908   HG22  ILE 111          HG22      ILE 111 -14.111  12.657 -21.733
  909   HG23  ILE 111          HG23      ILE 111 -13.994  14.173 -22.659
  910   HD11  ILE 111          HD11      ILE 111 -12.089  13.629 -23.726
  911   HD12  ILE 111          HD12      ILE 111 -11.607  12.794 -25.196
  912   HD13  ILE 111          HD13      ILE 111 -12.942  13.966 -25.264
  913    H    ASN 112           H        ASN 112 -16.691   9.653 -21.942
  914    HA   ASN 112           HA       ASN 112 -19.265  11.031 -21.644
  915    HB2  ASN 112           HB2      ASN 112 -19.154   8.598 -22.003
  916    HB3  ASN 112           HB3      ASN 112 -18.222   8.406 -20.519
  917   HD21  ASN 112          HD22      ASN 112 -19.547   7.577 -18.919
  918   HD22  ASN 112          HD21      ASN 112 -21.218   8.058 -18.650
  919    H    MET 113           H        MET 113 -16.371  10.501 -19.786
  920    HA   MET 113           HA       MET 113 -15.521  11.068 -17.840
  921    HB2  MET 113           HB2      MET 113 -17.558  13.304 -17.723
  922    HB3  MET 113           HB3      MET 113 -16.052  13.140 -16.805
  923    HG2  MET 113           HG2      MET 113 -14.761  13.189 -18.909
  924    HG3  MET 113           HG3      MET 113 -16.261  13.465 -19.810
  925    HE1  MET 113           HE1      MET 113 -14.801  15.615 -20.844
  926    HE2  MET 113           HE2      MET 113 -14.093  16.849 -19.783
  927    HE3  MET 113           HE3      MET 113 -13.484  15.181 -19.721
  928    H    GLN 114           H        GLN 114 -19.059  10.923 -17.570
  929    HA   GLN 114           HA       GLN 114 -18.873  10.295 -14.711
  930    HB2  GLN 114           HB2      GLN 114 -21.153  11.110 -16.542
  931    HB3  GLN 114           HB3      GLN 114 -21.365  10.690 -14.829
  932    HG2  GLN 114           HG2      GLN 114 -19.678  12.540 -14.283
  933    HG3  GLN 114           HG3      GLN 114 -19.817  13.043 -15.971
  934   HE21  GLN 114          HE22      GLN 114 -21.816  12.390 -12.999
  935   HE22  GLN 114          HE21      GLN 114 -23.047  13.567 -13.384
  936    H    THR 115           H        THR 115 -17.939   8.379 -16.562
  937    HA   THR 115           HA       THR 115 -19.927   6.296 -16.843
  938    HB   THR 115           HB       THR 115 -16.905   5.980 -16.912
  939    HG1  THR 115           HG1      THR 115 -17.347   6.269 -19.240
  940   HG21  THR 115          HG21      THR 115 -18.359   3.906 -16.786
  941   HG22  THR 115          HG22      THR 115 -19.170   4.442 -18.270
  942   HG23  THR 115          HG23      THR 115 -17.437   4.033 -18.299
  943    H    SER 116           H        SER 116 -17.175   6.940 -14.584
  944    HA   SER 116           HA       SER 116 -17.939   4.859 -12.740
  945    HB2  SER 116           HB2      SER 116 -16.321   6.395 -11.301
  946    HB3  SER 116           HB3      SER 116 -15.698   5.346 -12.585
  947    HG   SER 116           HG       SER 116 -14.846   7.464 -12.755
  948    H    SER 117           H        SER 117 -19.089   5.165 -10.906
  949    HA   SER 117           HA       SER 117 -21.204   7.055 -10.837
  950    HB2  SER 117           HB2      SER 117 -20.256   5.219  -8.601
  951    HB3  SER 117           HB3      SER 117 -21.895   5.853  -8.844
  952    HG   SER 117           HG       SER 117 -21.713   3.684  -9.600
  953    H    THR 118           H        THR 118 -18.066   6.983  -9.195
  954    HA   THR 118           HA       THR 118 -18.550   9.713  -8.133
  955    HB   THR 118           HB       THR 118 -16.666   9.009  -6.496
  956    HG1  THR 118           HG1      THR 118 -16.522   6.831  -6.060
  957   HG21  THR 118          HG21      THR 118 -19.465   7.822  -6.200
  958   HG22  THR 118          HG22      THR 118 -18.321   8.162  -4.884
  959   HG23  THR 118          HG23      THR 118 -18.997   9.495  -5.830
  960    HA   PRO 119           HA       PRO 119 -15.477   9.400 -11.619
  961    HB2  PRO 119           HB2      PRO 119 -16.525  11.271 -13.306
  962    HB3  PRO 119           HB3      PRO 119 -17.192   9.621 -13.156
  963    HG2  PRO 119           HG2      PRO 119 -18.202  12.167 -11.859
  964    HG3  PRO 119           HG3      PRO 119 -19.138  10.845 -12.660
  965    HD2  PRO 119           HD2      PRO 119 -18.858  10.990  -9.972
  966    HD3  PRO 119           HD3      PRO 119 -19.042   9.494 -10.918
  967    H    GLU 120           H        GLU 120 -14.305  11.443 -12.792
  968    HA   GLU 120           HA       GLU 120 -13.674  13.378 -10.610
  969    HB2  GLU 120           HB2      GLU 120 -11.837  12.233 -12.731
  970    HB3  GLU 120           HB3      GLU 120 -11.436  13.512 -11.571
  971    HG2  GLU 120           HG2      GLU 120 -12.355  11.696  -9.810
  972    HG3  GLU 120           HG3      GLU 120 -11.886  10.574 -11.080
  973    H    PHE 121           H        PHE 121 -14.937  13.282 -13.913
  974    HA   PHE 121           HA       PHE 121 -14.399  16.211 -13.990
  975    HB2  PHE 121           HB2      PHE 121 -13.802  14.250 -16.208
  976    HB3  PHE 121           HB3      PHE 121 -13.830  16.011 -16.379
  977    HD1  PHE 121           HD2      PHE 121 -12.325  17.443 -14.933
  978    HD2  PHE 121           HD1      PHE 121 -11.870  13.184 -15.169
  979    HE1  PHE 121           HE2      PHE 121 -10.299  17.586 -13.538
  980    HE2  PHE 121           HE1      PHE 121  -9.759  13.328 -13.874
  981    HZ   PHE 121           HZ       PHE 121  -9.017  15.512 -12.973
  982    H    ASP 122           H        ASP 122 -15.723  17.509 -15.117
  983    HA   ASP 122           HA       ASP 122 -18.513  16.456 -15.348
  984    HB2  ASP 122           HB2      ASP 122 -18.120  17.782 -13.349
  985    HB3  ASP 122           HB3      ASP 122 -17.408  19.084 -14.303
  986    H    GLY 123           H        GLY 123 -16.041  18.527 -16.900
  987    HA2  GLY 123           HA2      GLY 123 -17.557  18.540 -19.371
  988    HA3  GLY 123           HA3      GLY 123 -17.432  20.144 -18.618
  989    H    TRP 124           H        TRP 124 -16.315  19.222 -21.131
  990    HA   TRP 124           HA       TRP 124 -13.385  19.219 -20.673
  991    HB2  TRP 124           HB2      TRP 124 -13.309  18.708 -23.094
  992    HB3  TRP 124           HB3      TRP 124 -14.159  17.485 -22.164
  993    HD1  TRP 124           HD1      TRP 124 -16.785  17.201 -22.604
  994    HE1  TRP 124           HE1      TRP 124 -18.362  18.006 -24.436
  995    HE3  TRP 124           HE3      TRP 124 -13.702  20.596 -24.879
  996    HZ2  TRP 124           HZ2      TRP 124 -18.324  19.942 -26.604
  997    HZ3  TRP 124           HZ3      TRP 124 -14.497  21.909 -26.834
  998    HH2  TRP 124           HH2      TRP 124 -16.805  21.588 -27.701
  999    H    ARG 125           H        ARG 125 -12.094  20.716 -21.794
 1000    HA   ARG 125           HA       ARG 125 -13.262  22.855 -23.430
 1001    HB2  ARG 125           HB2      ARG 125 -13.397  23.828 -21.133
 1002    HB3  ARG 125           HB3      ARG 125 -11.702  23.432 -20.864
 1003    HG2  ARG 125           HG2      ARG 125 -11.174  24.971 -22.875
 1004    HG3  ARG 125           HG3      ARG 125 -12.852  25.499 -22.793
 1005    HD2  ARG 125           HD2      ARG 125 -12.527  26.379 -20.551
 1006    HD3  ARG 125           HD3      ARG 125 -10.957  25.559 -20.412
 1007    HE   ARG 125           HE       ARG 125 -11.259  27.546 -22.574
 1008   HH11  ARG 125          HH11      ARG 125 -10.095  27.009 -19.249
 1009   HH12  ARG 125          HH12      ARG 125  -8.831  28.201 -19.364
 1010   HH21  ARG 125          HH21      ARG 125  -9.668  29.213 -22.647
 1011   HH22  ARG 125          HH22      ARG 125  -8.655  29.519 -21.281
 1012    H    TRP 126           H        TRP 126 -11.900  22.153 -25.269
 1013    HA   TRP 126           HA       TRP 126  -9.205  21.299 -24.719
 1014    HB2  TRP 126           HB2      TRP 126 -10.327  22.133 -27.393
 1015    HB3  TRP 126           HB3      TRP 126  -8.992  21.033 -27.064
 1016    HD1  TRP 126           HD1      TRP 126 -12.125  20.705 -28.462
 1017    HE1  TRP 126           HE1      TRP 126 -13.453  18.614 -27.866
 1018    HE3  TRP 126           HE3      TRP 126  -9.484  19.213 -24.313
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.408  16.552 -25.817
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.221  17.255 -23.020
 1021    HH2  TRP 126           HH2      TRP 126 -12.203  15.944 -23.721
 1022    H    VAL 127           H        VAL 127  -7.330  22.429 -24.730
 1023    HA   VAL 127           HA       VAL 127  -7.370  25.339 -25.295
 1024    HB   VAL 127           HB       VAL 127  -6.115  25.680 -23.163
 1025   HG11  VAL 127          HG11      VAL 127  -8.928  24.623 -22.720
 1026   HG12  VAL 127          HG12      VAL 127  -8.050  25.777 -21.705
 1027   HG13  VAL 127          HG13      VAL 127  -8.529  26.238 -23.349
 1028   HG21  VAL 127          HG21      VAL 127  -5.408  23.372 -22.659
 1029   HG22  VAL 127          HG22      VAL 127  -6.404  23.995 -21.325
 1030   HG23  VAL 127          HG23      VAL 127  -7.097  22.869 -22.494
 1031    H    SER 128           H        SER 128  -5.225  26.190 -25.668
 1032    HA   SER 128           HA       SER 128  -3.847  24.631 -27.442
 1033    HB2  SER 128           HB2      SER 128  -2.656  26.973 -25.921
 1034    HB3  SER 128           HB3      SER 128  -2.248  26.436 -27.557
 1035    HG   SER 128           HG       SER 128  -3.718  28.238 -27.574
 1036    H    TYR 129           H        TYR 129  -1.613  23.915 -27.527
 1037    HA   TYR 129           HA       TYR 129  -0.682  22.365 -25.339
 1038    HB2  TYR 129           HB2      TYR 129  -0.097  22.601 -28.009
 1039    HB3  TYR 129           HB3      TYR 129   1.285  23.438 -27.325
 1040    HD1  TYR 129           HD1      TYR 129   2.862  22.124 -25.777
 1041    HD2  TYR 129           HD2      TYR 129  -0.383  20.268 -27.932
 1042    HE1  TYR 129           HE1      TYR 129   3.882  19.887 -25.429
 1043    HE2  TYR 129           HE2      TYR 129   0.618  18.050 -27.512
 1044    HH   TYR 129           HH       TYR 129   2.273  16.847 -26.424
 1045    H    TRP 130           H        TRP 130   1.142  22.831 -23.928
 1046    HA   TRP 130           HA       TRP 130   2.216  23.984 -22.357
 1047    HB2  TRP 130           HB2      TRP 130   2.262  26.490 -23.986
 1048    HB3  TRP 130           HB3      TRP 130   3.415  25.907 -22.798
 1049    HD1  TRP 130           HD1      TRP 130   2.553  25.805 -26.424
 1050    HE1  TRP 130           HE1      TRP 130   4.080  24.298 -27.765
 1051    HE3  TRP 130           HE3      TRP 130   5.115  23.686 -22.536
 1052    HZ2  TRP 130           HZ2      TRP 130   6.323  22.474 -27.212
 1053    HZ3  TRP 130           HZ3      TRP 130   6.933  22.050 -22.967
 1054    HH2  TRP 130           HH2      TRP 130   7.517  21.411 -25.294
 1055    H    TYR 131           H        TYR 131  -0.848  25.473 -23.385
 1056    HA   TYR 131           HA       TYR 131  -0.995  27.336 -21.255
 1057    HB2  TYR 131           HB2      TYR 131  -2.478  27.532 -23.093
 1058    HB3  TYR 131           HB3      TYR 131  -3.182  25.962 -22.827
 1059    HD1  TYR 131           HD1      TYR 131  -4.756  25.528 -20.972
 1060    HD2  TYR 131           HD2      TYR 131  -3.167  29.468 -21.722
 1061    HE1  TYR 131           HE1      TYR 131  -6.642  26.515 -19.716
 1062    HE2  TYR 131           HE2      TYR 131  -5.015  30.465 -20.418
 1063    HH   TYR 131           HH       TYR 131  -6.947  30.063 -19.149
 1064    HA   PRO 132           HA       PRO 132  -2.952  23.852 -18.477
 1065    HB2  PRO 132           HB2      PRO 132  -1.456  21.529 -19.735
 1066    HB3  PRO 132           HB3      PRO 132  -2.957  21.492 -18.803
 1067    HG2  PRO 132           HG2      PRO 132  -3.098  21.395 -21.480
 1068    HG3  PRO 132           HG3      PRO 132  -4.192  22.510 -20.601
 1069    HD2  PRO 132           HD2      PRO 132  -1.588  23.159 -22.008
 1070    HD3  PRO 132           HD3      PRO 132  -3.156  24.017 -22.053
 1071    H    VAL 133           H        VAL 133   0.361  23.795 -19.825
 1072    HA   VAL 133           HA       VAL 133   1.656  22.987 -17.383
 1073    HB   VAL 133           HB       VAL 133   2.346  23.485 -20.125
 1074   HG11  VAL 133          HG11      VAL 133   4.540  24.508 -20.001
 1075   HG12  VAL 133          HG12      VAL 133   3.304  25.667 -19.532
 1076   HG13  VAL 133          HG13      VAL 133   4.312  24.892 -18.282
 1077   HG21  VAL 133          HG21      VAL 133   2.832  21.471 -18.762
 1078   HG22  VAL 133          HG22      VAL 133   4.230  22.097 -19.635
 1079   HG23  VAL 133          HG23      VAL 133   4.075  22.408 -17.884
 1080    H    ARG 134           H        ARG 134   0.562  26.136 -18.676
 1081    HA   ARG 134           HA       ARG 134   1.926  27.497 -16.432
 1082    HB2  ARG 134           HB2      ARG 134   0.091  28.584 -18.613
 1083    HB3  ARG 134           HB3      ARG 134   0.924  29.553 -17.402
 1084    HG2  ARG 134           HG2      ARG 134   2.158  27.992 -19.694
 1085    HG3  ARG 134           HG3      ARG 134   2.167  29.725 -19.429
 1086    HD2  ARG 134           HD2      ARG 134   3.747  27.587 -17.955
 1087    HD3  ARG 134           HD3      ARG 134   4.382  28.906 -18.923
 1088    HE   ARG 134           HE       ARG 134   3.638  28.936 -16.123
 1089   HH11  ARG 134          HH11      ARG 134   4.083  31.057 -18.953
 1090   HH12  ARG 134          HH12      ARG 134   4.128  32.516 -18.028
 1091   HH21  ARG 134          HH21      ARG 134   3.585  30.928 -14.906
 1092   HH22  ARG 134          HH22      ARG 134   3.885  32.429 -15.694
 1093    H    GLN 135           H        GLN 135  -1.277  26.217 -17.187
 1094    HA   GLN 135           HA       GLN 135  -2.500  27.748 -15.025
 1095    HB2  GLN 135           HB2      GLN 135  -3.509  25.398 -16.670
 1096    HB3  GLN 135           HB3      GLN 135  -4.452  26.258 -15.451
 1097    HG2  GLN 135           HG2      GLN 135  -3.356  27.473 -18.016
 1098    HG3  GLN 135           HG3      GLN 135  -5.022  27.030 -17.665
 1099   HE21  GLN 135          HE22      GLN 135  -6.184  28.275 -15.919
 1100   HE22  GLN 135          HE21      GLN 135  -5.668  29.907 -15.578
 1101    H    VAL 136           H        VAL 136  -0.930  24.545 -15.228
 1102    HA   VAL 136           HA       VAL 136  -2.098  23.549 -12.846
 1103    HB   VAL 136           HB       VAL 136  -0.866  22.302 -14.719
 1104   HG11  VAL 136          HG11      VAL 136   1.273  23.473 -14.675
 1105   HG12  VAL 136          HG12      VAL 136   1.551  22.964 -13.006
 1106   HG13  VAL 136          HG13      VAL 136   1.504  21.755 -14.290
 1107   HG21  VAL 136          HG21      VAL 136  -0.306  20.435 -13.281
 1108   HG22  VAL 136          HG22      VAL 136  -0.317  21.491 -11.855
 1109   HG23  VAL 136          HG23      VAL 136  -1.816  21.197 -12.764
 1110    H    VAL 137           H        VAL 137  -1.002  23.198 -10.743
 1111    HA   VAL 137           HA       VAL 137   0.101  25.546  -9.580
 1112    HB   VAL 137           HB       VAL 137   0.673  23.904  -7.690
 1113   HG11  VAL 137          HG11      VAL 137  -2.226  24.136  -8.636
 1114   HG12  VAL 137          HG12      VAL 137  -1.698  23.766  -6.983
 1115   HG13  VAL 137          HG13      VAL 137  -1.329  25.346  -7.689
 1116   HG21  VAL 137          HG21      VAL 137  -0.394  21.736  -7.664
 1117   HG22  VAL 137          HG22      VAL 137  -1.067  21.961  -9.283
 1118   HG23  VAL 137          HG23      VAL 137   0.698  21.820  -9.054
 1119    H    SER 138           H        SER 138   2.147  26.054  -8.818
 1120    HA   SER 138           HA       SER 138   4.115  25.839 -10.651
 1121    HB2  SER 138           HB2      SER 138   4.546  26.383  -7.689
 1122    HB3  SER 138           HB3      SER 138   5.467  27.042  -9.054
 1123    HG   SER 138           HG       SER 138   3.880  28.525  -8.251
 1124    H    PHE 139           H        PHE 139   3.799  23.662  -7.751
 1125    HA   PHE 139           HA       PHE 139   6.448  22.621  -8.142
 1126    HB2  PHE 139           HB2      PHE 139   5.971  21.056  -6.454
 1127    HB3  PHE 139           HB3      PHE 139   5.255  22.579  -5.988
 1128    HD1  PHE 139           HD1      PHE 139   4.599  19.117  -7.114
 1129    HD2  PHE 139           HD2      PHE 139   2.814  22.792  -5.722
 1130    HE1  PHE 139           HE1      PHE 139   2.479  17.931  -6.716
 1131    HE2  PHE 139           HE2      PHE 139   0.686  21.600  -5.313
 1132    HZ   PHE 139           HZ       PHE 139   0.504  19.168  -5.804
 1133    H    LYS 140           H        LYS 140   3.375  21.862  -9.667
 1134    HA   LYS 140           HA       LYS 140   4.452  19.370 -10.871
 1135    HB2  LYS 140           HB2      LYS 140   1.794  20.778 -11.322
 1136    HB3  LYS 140           HB3      LYS 140   2.275  19.216 -12.003
 1137    HG2  LYS 140           HG2      LYS 140   2.550  18.339  -9.654
 1138    HG3  LYS 140           HG3      LYS 140   1.922  19.875  -9.051
 1139    HD2  LYS 140           HD2      LYS 140  -0.191  19.456 -10.414
 1140    HD3  LYS 140           HD3      LYS 140   0.447  17.835 -10.779
 1141    HE2  LYS 140           HE2      LYS 140   0.586  17.370  -8.320
 1142    HE3  LYS 140           HE3      LYS 140  -0.046  18.986  -7.983
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.556  16.855  -9.420
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.784  17.275  -7.856
 1145    HZ3  LYS 140           HZ3      LYS 140  -2.141  18.353  -9.030
 1146    H    ARG 141           H        ARG 141   3.560  22.708 -11.867
 1147    HA   ARG 141           HA       ARG 141   3.790  22.744 -14.546
 1148    HB2  ARG 141           HB2      ARG 141   3.417  24.765 -13.343
 1149    HB3  ARG 141           HB3      ARG 141   4.975  24.665 -12.528
 1150    HG2  ARG 141           HG2      ARG 141   6.168  25.202 -14.598
 1151    HG3  ARG 141           HG3      ARG 141   4.647  25.257 -15.503
 1152    HD2  ARG 141           HD2      ARG 141   3.880  27.159 -14.215
 1153    HD3  ARG 141           HD3      ARG 141   5.244  26.986 -13.090
 1154    HE   ARG 141           HE       ARG 141   6.001  27.384 -15.898
 1155   HH11  ARG 141          HH11      ARG 141   5.426  28.999 -12.769
 1156   HH12  ARG 141          HH12      ARG 141   6.428  30.355 -13.136
 1157   HH21  ARG 141          HH21      ARG 141   7.323  29.217 -16.376
 1158   HH22  ARG 141          HH22      ARG 141   7.510  30.485 -15.226
 1159    H    ASP 142           H        ASP 142   6.800  22.791 -12.534
 1160    HA   ASP 142           HA       ASP 142   8.511  22.989 -14.803
 1161    HB2  ASP 142           HB2      ASP 142   9.223  23.600 -12.536
 1162    HB3  ASP 142           HB3      ASP 142   9.107  21.914 -12.020
 1163    H    VAL 143           H        VAL 143   7.170  20.106 -13.196
 1164    HA   VAL 143           HA       VAL 143   8.801  18.283 -14.851
 1165    HB   VAL 143           HB       VAL 143   6.696  17.856 -12.714
 1166   HG11  VAL 143          HG11      VAL 143   8.148  15.738 -14.349
 1167   HG12  VAL 143          HG12      VAL 143   7.208  15.426 -12.870
 1168   HG13  VAL 143          HG13      VAL 143   6.389  16.019 -14.319
 1169   HG21  VAL 143          HG21      VAL 143   9.705  17.326 -12.919
 1170   HG22  VAL 143          HG22      VAL 143   8.904  18.541 -11.899
 1171   HG23  VAL 143          HG23      VAL 143   8.694  16.821 -11.561
 1172    H    TYR 144           H        TYR 144   5.453  19.617 -14.802
 1173    HA   TYR 144           HA       TYR 144   4.530  17.904 -16.853
 1174    HB2  TYR 144           HB2      TYR 144   3.206  19.386 -15.241
 1175    HB3  TYR 144           HB3      TYR 144   3.544  20.730 -16.307
 1176    HD1  TYR 144           HD1      TYR 144   2.875  17.451 -17.978
 1177    HD2  TYR 144           HD2      TYR 144   1.032  20.984 -16.296
 1178    HE1  TYR 144           HE1      TYR 144   0.757  16.780 -18.916
 1179    HE2  TYR 144           HE2      TYR 144  -1.108  20.336 -17.280
 1180    HH   TYR 144           HH       TYR 144  -2.270  18.729 -18.590
 1181    H    ARG 145           H        ARG 145   6.348  20.998 -17.026
 1182    HA   ARG 145           HA       ARG 145   6.327  21.367 -19.856
 1183    HB2  ARG 145           HB2      ARG 145   8.467  21.850 -17.733
 1184    HB3  ARG 145           HB3      ARG 145   8.759  22.162 -19.436
 1185    HG2  ARG 145           HG2      ARG 145   6.832  23.758 -19.480
 1186    HG3  ARG 145           HG3      ARG 145   6.583  23.474 -17.749
 1187    HD2  ARG 145           HD2      ARG 145   7.867  25.524 -18.056
 1188    HD3  ARG 145           HD3      ARG 145   8.891  24.294 -17.290
 1189    HE   ARG 145           HE       ARG 145   9.183  24.215 -20.154
 1190   HH11  ARG 145          HH11      ARG 145  10.175  26.177 -17.349
 1191   HH12  ARG 145          HH12      ARG 145  11.579  26.815 -18.123
 1192   HH21  ARG 145          HH21      ARG 145  11.061  25.073 -21.173
 1193   HH22  ARG 145          HH22      ARG 145  12.093  26.162 -20.329
 1194    H    ARG 146           H        ARG 146   8.252  19.041 -17.879
 1195    HA   ARG 146           HA       ARG 146   9.920  18.232 -20.077
 1196    HB2  ARG 146           HB2      ARG 146   9.193  16.557 -17.631
 1197    HB3  ARG 146           HB3      ARG 146  10.578  16.344 -18.692
 1198    HG2  ARG 146           HG2      ARG 146  11.478  18.561 -17.983
 1199    HG3  ARG 146           HG3      ARG 146  10.065  18.788 -16.949
 1200    HD2  ARG 146           HD2      ARG 146  10.764  16.618 -15.755
 1201    HD3  ARG 146           HD3      ARG 146  12.307  16.806 -16.611
 1202    HE   ARG 146           HE       ARG 146  11.347  19.187 -15.156
 1203   HH11  ARG 146          HH11      ARG 146  13.447  16.310 -14.959
 1204   HH12  ARG 146          HH12      ARG 146  14.326  16.888 -13.590
 1205   HH21  ARG 146          HH21      ARG 146  12.425  19.897 -13.292
 1206   HH22  ARG 146          HH22      ARG 146  13.765  18.997 -12.647
 1207    H    VAL 147           H        VAL 147   6.838  16.894 -18.763
 1208    HA   VAL 147           HA       VAL 147   6.535  14.763 -20.615
 1209    HB   VAL 147           HB       VAL 147   4.352  16.528 -19.426
 1210   HG11  VAL 147          HG11      VAL 147   2.911  14.527 -19.657
 1211   HG12  VAL 147          HG12      VAL 147   3.489  15.108 -21.219
 1212   HG13  VAL 147          HG13      VAL 147   4.242  13.676 -20.481
 1213   HG21  VAL 147          HG21      VAL 147   5.799  15.551 -17.622
 1214   HG22  VAL 147          HG22      VAL 147   4.159  14.915 -17.615
 1215   HG23  VAL 147          HG23      VAL 147   5.468  13.940 -18.300
 1216    H    MET 148           H        MET 148   5.487  18.230 -20.846
 1217    HA   MET 148           HA       MET 148   4.336  17.872 -23.417
 1218    HB2  MET 148           HB2      MET 148   5.295  20.316 -21.891
 1219    HB3  MET 148           HB3      MET 148   4.582  20.426 -23.497
 1220    HG2  MET 148           HG2      MET 148   2.622  19.041 -22.586
 1221    HG3  MET 148           HG3      MET 148   3.279  19.383 -20.975
 1222    HE1  MET 148           HE1      MET 148   1.072  20.580 -20.125
 1223    HE2  MET 148           HE2      MET 148   0.192  21.761 -21.117
 1224    HE3  MET 148           HE3      MET 148   0.337  20.072 -21.664
 1225    H    LYS 149           H        LYS 149   7.672  18.787 -22.444
 1226    HA   LYS 149           HA       LYS 149   8.626  19.379 -25.052
 1227    HB2  LYS 149           HB2      LYS 149   9.676  19.949 -22.855
 1228    HB3  LYS 149           HB3      LYS 149  10.161  18.273 -22.647
 1229    HG2  LYS 149           HG2      LYS 149  11.008  19.847 -25.099
 1230    HG3  LYS 149           HG3      LYS 149  11.803  20.107 -23.549
 1231    HD2  LYS 149           HD2      LYS 149  12.449  17.720 -23.425
 1232    HD3  LYS 149           HD3      LYS 149  11.681  17.406 -24.991
 1233    HE2  LYS 149           HE2      LYS 149  13.153  19.102 -26.060
 1234    HE3  LYS 149           HE3      LYS 149  13.936  19.410 -24.506
 1235    HZ1  LYS 149           HZ1      LYS 149  15.227  17.890 -25.864
 1236    HZ2  LYS 149           HZ2      LYS 149  14.729  17.110 -24.521
 1237    HZ3  LYS 149           HZ3      LYS 149  13.999  16.818 -25.963
 1238    H    GLU 150           H        GLU 150   8.321  16.291 -23.282
 1239    HA   GLU 150           HA       GLU 150   9.746  14.671 -25.162
 1240    HB2  GLU 150           HB2      GLU 150   7.520  14.021 -23.188
 1241    HB3  GLU 150           HB3      GLU 150   8.353  12.798 -24.118
 1242    HG2  GLU 150           HG2      GLU 150  10.020  14.664 -22.439
 1243    HG3  GLU 150           HG3      GLU 150   9.061  13.435 -21.633
 1244    H    PHE 151           H        PHE 151   6.394  15.918 -25.175
 1245    HA   PHE 151           HA       PHE 151   5.745  14.119 -27.466
 1246    HB2  PHE 151           HB2      PHE 151   3.984  15.473 -25.412
 1247    HB3  PHE 151           HB3      PHE 151   3.402  14.439 -26.709
 1248    HD1  PHE 151           HD2      PHE 151   5.839  12.334 -26.267
 1249    HD2  PHE 151           HD1      PHE 151   2.880  14.193 -23.735
 1250    HE1  PHE 151           HE2      PHE 151   6.039  10.485 -24.681
 1251    HE2  PHE 151           HE1      PHE 151   3.022  12.254 -22.177
 1252    HZ   PHE 151           HZ       PHE 151   4.620  10.428 -22.620
 1253    H    ALA 152           H        ALA 152   6.130  17.538 -26.844
 1254    HA   ALA 152           HA       ALA 152   4.100  18.614 -28.286
 1255    HB1  ALA 152           HB1      ALA 152   5.702  19.975 -27.035
 1256    HB2  ALA 152           HB2      ALA 152   6.987  19.599 -28.205
 1257    HB3  ALA 152           HB3      ALA 152   5.581  20.568 -28.699
 1258    H    SER 153           H        SER 153   7.319  17.887 -29.825
 1259    HA   SER 153           HA       SER 153   6.428  18.489 -32.415
 1260    HB2  SER 153           HB2      SER 153   8.563  16.440 -31.735
 1261    HB3  SER 153           HB3      SER 153   8.446  17.477 -33.173
 1262    HG   SER 153           HG       SER 153   9.957  18.307 -31.645
 1263    H    VAL 154           H        VAL 154   5.653  15.663 -30.482
 1264    HA   VAL 154           HA       VAL 154   5.313  13.880 -32.808
 1265    HB   VAL 154           HB       VAL 154   4.408  13.436 -29.940
 1266   HG11  VAL 154          HG11      VAL 154   3.380  11.920 -31.603
 1267   HG12  VAL 154          HG12      VAL 154   4.985  11.493 -32.227
 1268   HG13  VAL 154          HG13      VAL 154   4.522  11.044 -30.575
 1269   HG21  VAL 154          HG21      VAL 154   6.840  13.795 -29.867
 1270   HG22  VAL 154          HG22      VAL 154   6.488  12.082 -29.666
 1271   HG23  VAL 154          HG23      VAL 154   7.066  12.683 -31.237
 1272    H    VAL 155           H        VAL 155   3.370  15.855 -30.541
 1273    HA   VAL 155           HA       VAL 155   0.838  15.297 -31.830
 1274    HB   VAL 155           HB       VAL 155   1.864  17.381 -29.848
 1275   HG11  VAL 155          HG11      VAL 155   0.176  18.582 -31.002
 1276   HG12  VAL 155          HG12      VAL 155  -0.878  17.151 -31.114
 1277   HG13  VAL 155          HG13      VAL 155  -0.604  17.954 -29.547
 1278   HG21  VAL 155          HG21      VAL 155   0.007  14.965 -29.698
 1279   HG22  VAL 155          HG22      VAL 155   1.613  15.131 -28.944
 1280   HG23  VAL 155          HG23      VAL 155   0.251  16.085 -28.355
 1281    H    MET 156           H        MET 156   3.262  17.972 -32.162
 1282    HA   MET 156           HA       MET 156   1.541  19.363 -33.974
 1283    HB2  MET 156           HB2      MET 156   4.522  19.647 -33.451
 1284    HB3  MET 156           HB3      MET 156   3.571  20.752 -34.456
 1285    HG2  MET 156           HG2      MET 156   3.099  20.195 -31.504
 1286    HG3  MET 156           HG3      MET 156   3.846  21.634 -32.177
 1287    HE1  MET 156           HE1      MET 156   1.332  21.308 -30.076
 1288    HE2  MET 156           HE2      MET 156   2.098  22.866 -30.468
 1289    HE3  MET 156           HE3      MET 156   0.333  22.678 -30.594
 1290    H    SER 157           H        SER 157   3.688  16.666 -34.554
 1291    HA   SER 157           HA       SER 157   4.169  17.026 -37.319
 1292    HB2  SER 157           HB2      SER 157   3.704  14.518 -35.654
 1293    HB3  SER 157           HB3      SER 157   4.248  14.491 -37.336
 1294    HG   SER 157           HG       SER 157   5.621  15.681 -35.123
 1295    H    LEU 158           H        LEU 158   1.238  16.028 -35.602
 1296    HA   LEU 158           HA       LEU 158  -0.153  14.930 -37.892
 1297    HB2  LEU 158           HB2      LEU 158  -1.034  16.036 -35.204
 1298    HB3  LEU 158           HB3      LEU 158  -2.202  15.594 -36.453
 1299    HG   LEU 158           HG       LEU 158  -1.442  13.271 -36.418
 1300   HD11  LEU 158          HD11      LEU 158  -0.039  12.458 -34.531
 1301   HD12  LEU 158          HD12      LEU 158   0.880  13.472 -35.642
 1302   HD13  LEU 158          HD13      LEU 158   0.322  14.143 -34.085
 1303   HD21  LEU 158          HD21      LEU 158  -3.336  14.030 -35.029
 1304   HD22  LEU 158          HD22      LEU 158  -2.443  12.744 -34.207
 1305   HD23  LEU 158          HD23      LEU 158  -2.232  14.437 -33.697
 1306    H    GLN 159           H        GLN 159   0.151  18.211 -36.473
 1307    HA   GLN 159           HA       GLN 159  -1.913  19.269 -38.294
 1308    HB2  GLN 159           HB2      GLN 159  -0.232  20.812 -36.278
 1309    HB3  GLN 159           HB3      GLN 159  -1.739  21.312 -37.031
 1310    HG2  GLN 159           HG2      GLN 159  -1.315  19.206 -34.896
 1311    HG3  GLN 159           HG3      GLN 159  -2.224  20.706 -34.814
 1312   HE21  GLN 159          HE22      GLN 159  -2.679  17.389 -34.965
 1313   HE22  GLN 159          HE21      GLN 159  -4.327  17.420 -35.571
 1314    H    GLU 160           H        GLU 160   1.612  19.259 -37.966
 1315    HA   GLU 160           HA       GLU 160   2.150  21.254 -39.935
 1316    HB2  GLU 160           HB2      GLU 160   3.629  20.517 -38.064
 1317    HB3  GLU 160           HB3      GLU 160   3.888  18.972 -38.879
 1318    HG2  GLU 160           HG2      GLU 160   5.004  20.128 -40.746
 1319    HG3  GLU 160           HG3      GLU 160   4.574  21.705 -40.069
 1320    H    ASN 161           H        ASN 161   0.813  18.125 -40.343
 1321    HA   ASN 161           HA       ASN 161   1.796  17.847 -43.131
 1322    HB2  ASN 161           HB2      ASN 161   2.020  15.786 -41.764
 1323    HB3  ASN 161           HB3      ASN 161   0.332  15.921 -41.262
 1324   HD21  ASN 161          HD22      ASN 161   0.518  13.601 -42.235
 1325   HD22  ASN 161          HD21      ASN 161   0.119  13.458 -43.931
 1326    H    THR 162           H        THR 162   0.620  19.944 -43.367
 1327    HA   THR 162           HA       THR 162  -1.812  20.506 -42.427
 1328    HB   THR 162           HB       THR 162  -1.211  21.527 -45.173
 1329    HG1  THR 162           HG1      THR 162   0.556  22.683 -44.454
 1330   HG21  THR 162          HG21      THR 162  -1.698  23.695 -44.096
 1331   HG22  THR 162          HG22      THR 162  -3.002  22.539 -43.781
 1332   HG23  THR 162          HG23      THR 162  -1.812  22.896 -42.511
 1333    HA   PRO 163           HA       PRO 163  -4.127  18.572 -46.162
 1334    HB2  PRO 163           HB2      PRO 163  -2.256  16.278 -46.743
 1335    HB3  PRO 163           HB3      PRO 163  -3.338  17.161 -47.867
 1336    HG2  PRO 163           HG2      PRO 163  -0.690  17.711 -47.839
 1337    HG3  PRO 163           HG3      PRO 163  -1.870  19.068 -47.887
 1338    HD2  PRO 163           HD2      PRO 163  -0.433  17.922 -45.469
 1339    HD3  PRO 163           HD3      PRO 163  -0.623  19.625 -45.935
 1340    H    LYS 164           H        LYS 164  -2.709  17.015 -43.335
 1341    HA   LYS 164           HA       LYS 164  -4.273  14.590 -43.498
 1342    HB2  LYS 164           HB2      LYS 164  -2.193  14.855 -42.121
 1343    HB3  LYS 164           HB3      LYS 164  -3.098  15.916 -41.022
 1344    HG2  LYS 164           HG2      LYS 164  -4.674  14.081 -40.520
 1345    HG3  LYS 164           HG3      LYS 164  -3.860  13.043 -41.708
 1346    HD2  LYS 164           HD2      LYS 164  -1.776  13.123 -40.338
 1347    HD3  LYS 164           HD3      LYS 164  -2.589  14.184 -39.182
 1348    HE2  LYS 164           HE2      LYS 164  -2.610  11.962 -38.268
 1349    HE3  LYS 164           HE3      LYS 164  -4.264  12.394 -38.714
 1350    HZ1  LYS 164           HZ1      LYS 164  -4.017  11.008 -40.707
 1351    HZ2  LYS 164           HZ2      LYS 164  -2.459  10.654 -40.326
 1352    HZ3  LYS 164           HZ3      LYS 164  -3.677  10.127 -39.381
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  -1.284   0.324   0.223
    2    H2   MET   1           H2       MET   1  -0.118   1.346   0.736
    3    H3   MET   1           H3       MET   1  -1.546   1.938   0.204
    4    HA   MET   1           HA       MET   1   0.441   0.497  -1.445
    5    HB2  MET   1           HB2      MET   1  -1.894   0.047  -2.143
    6    HB3  MET   1           HB3      MET   1  -2.194   1.772  -2.325
    7    HG2  MET   1           HG2      MET   1  -1.787   0.674  -4.466
    8    HG3  MET   1           HG3      MET   1  -0.557   1.892  -4.153
    9    HE1  MET   1           HE1      MET   1   0.686   0.792  -6.258
   10    HE2  MET   1           HE2      MET   1   1.227  -0.900  -6.315
   11    HE3  MET   1           HE3      MET   1  -0.510  -0.516  -6.382
   12    H    ILE   2           H        ILE   2   2.211   1.883  -1.040
   13    HA   ILE   2           HA       ILE   2   2.128   4.460  -2.428
   14    HB   ILE   2           HB       ILE   2   2.848   4.065   0.500
   15   HG12  ILE   2          HG12      ILE   2   0.640   5.029   0.158
   16   HG13  ILE   2          HG13      ILE   2   1.720   6.211   0.874
   17   HG21  ILE   2          HG21      ILE   2   4.864   5.014  -0.248
   18   HG22  ILE   2          HG22      ILE   2   4.036   6.161  -1.321
   19   HG23  ILE   2          HG23      ILE   2   3.950   6.353   0.440
   20   HD11  ILE   2          HD11      ILE   2   1.991   7.314  -1.346
   21   HD12  ILE   2          HD12      ILE   2   0.843   6.147  -2.046
   22   HD13  ILE   2          HD13      ILE   2   0.302   7.264  -0.794
   23    H    ASP   3           H        ASP   3   4.101   4.851  -3.430
   24    HA   ASP   3           HA       ASP   3   5.943   2.614  -3.849
   25    HB2  ASP   3           HB2      ASP   3   5.432   3.905  -5.759
   26    HB3  ASP   3           HB3      ASP   3   5.712   5.426  -4.938
   27    H    ASP   4           H        ASP   4   7.966   2.533  -3.098
   28    HA   ASP   4           HA       ASP   4   8.506   2.725  -0.574
   29    HB2  ASP   4           HB2      ASP   4   9.981   1.652  -2.185
   30    HB3  ASP   4           HB3      ASP   4  10.593   3.226  -2.706
   31    H    ASP   5           H        ASP   5   9.484   5.528  -2.601
   32    HA   ASP   5           HA       ASP   5  10.623   6.750  -0.250
   33    HB2  ASP   5           HB2      ASP   5  11.710   6.793  -2.494
   34    HB3  ASP   5           HB3      ASP   5  10.507   7.984  -2.993
   35    H    GLY   6           H        GLY   6   7.505   6.555  -0.912
   36    HA2  GLY   6           HA2      GLY   6   5.940   7.593   0.521
   37    HA3  GLY   6           HA3      GLY   6   6.875   9.087   0.512
   38    H    TYR   7           H        TYR   7   5.894   7.095  -2.344
   39    HA   TYR   7           HA       TYR   7   4.600   9.566  -3.411
   40    HB2  TYR   7           HB2      TYR   7   6.366   7.483  -4.712
   41    HB3  TYR   7           HB3      TYR   7   5.298   8.516  -5.649
   42    HD1  TYR   7           HD2      TYR   7   8.256   8.514  -3.383
   43    HD2  TYR   7           HD1      TYR   7   5.745  10.819  -5.996
   44    HE1  TYR   7           HE2      TYR   7   9.890  10.378  -3.322
   45    HE2  TYR   7           HE1      TYR   7   7.297  12.693  -5.898
   46    HH   TYR   7           HH       TYR   7   9.380  13.481  -5.075
   47    H    ARG   8           H        ARG   8   2.646   9.425  -4.460
   48    HA   ARG   8           HA       ARG   8   1.187   6.867  -4.216
   49    HB2  ARG   8           HB2      ARG   8   0.114   9.125  -3.827
   50    HB3  ARG   8           HB3      ARG   8   0.285   9.480  -5.531
   51    HG2  ARG   8           HG2      ARG   8  -1.966   8.798  -5.044
   52    HG3  ARG   8           HG3      ARG   8  -1.232   7.538  -6.041
   53    HD2  ARG   8           HD2      ARG   8  -0.933   6.094  -4.081
   54    HD3  ARG   8           HD3      ARG   8  -1.444   7.417  -2.995
   55    HE   ARG   8           HE       ARG   8  -3.533   7.041  -4.805
   56   HH11  ARG   8          HH11      ARG   8  -1.925   4.927  -2.381
   57   HH12  ARG   8          HH12      ARG   8  -3.414   4.221  -1.864
   58   HH21  ARG   8          HH21      ARG   8  -5.456   5.977  -4.171
   59   HH22  ARG   8          HH22      ARG   8  -5.429   4.751  -2.963
   60    HA   PRO   9           HA       PRO   9   2.835   5.982  -8.360
   61    HB2  PRO   9           HB2      PRO   9   2.294   3.336  -8.590
   62    HB3  PRO   9           HB3      PRO   9   3.514   3.952  -7.448
   63    HG2  PRO   9           HG2      PRO   9   0.635   3.204  -6.833
   64    HG3  PRO   9           HG3      PRO   9   2.129   2.718  -5.963
   65    HD2  PRO   9           HD2      PRO   9   0.557   4.811  -5.170
   66    HD3  PRO   9           HD3      PRO   9   2.329   4.795  -4.936
   67    H    ASN  10           H        ASN  10   1.846   6.672 -10.207
   68    HA   ASN  10           HA       ASN  10  -0.587   5.393 -11.117
   69    HB2  ASN  10           HB2      ASN  10  -1.913   7.371 -11.458
   70    HB3  ASN  10           HB3      ASN  10  -1.539   7.303  -9.739
   71   HD21  ASN  10          HD22      ASN  10   0.308   8.663  -9.038
   72   HD22  ASN  10          HD21      ASN  10   0.511  10.221  -9.838
   73    H    VAL  11           H        VAL  11  -1.198   6.505 -13.309
   74    HA   VAL  11           HA       VAL  11   1.186   7.491 -14.739
   75    HB   VAL  11           HB       VAL  11   0.353   6.349 -16.760
   76   HG11  VAL  11          HG11      VAL  11   1.212   4.122 -16.225
   77   HG12  VAL  11          HG12      VAL  11   2.188   5.361 -15.424
   78   HG13  VAL  11          HG13      VAL  11   1.003   4.414 -14.489
   79   HG21  VAL  11          HG21      VAL  11  -1.950   5.871 -16.332
   80   HG22  VAL  11          HG22      VAL  11  -1.080   4.323 -16.403
   81   HG23  VAL  11          HG23      VAL  11  -1.588   4.947 -14.854
   82    H    GLY  12           H        GLY  12   0.629   9.362 -16.009
   83    HA2  GLY  12           HA2      GLY  12  -2.126  10.461 -15.601
   84    HA3  GLY  12           HA3      GLY  12  -0.697  11.383 -16.062
   85    H    ILE  13           H        ILE  13  -3.555  10.340 -17.308
   86    HA   ILE  13           HA       ILE  13  -2.630   9.444 -19.934
   87    HB   ILE  13           HB       ILE  13  -5.343  10.362 -18.898
   88   HG12  ILE  13          HG12      ILE  13  -4.533   8.168 -17.991
   89   HG13  ILE  13          HG13      ILE  13  -6.026   8.082 -18.898
   90   HG21  ILE  13          HG21      ILE  13  -5.380  10.835 -21.222
   91   HG22  ILE  13          HG22      ILE  13  -4.587   9.309 -21.650
   92   HG23  ILE  13          HG23      ILE  13  -6.245   9.305 -21.020
   93   HD11  ILE  13          HD11      ILE  13  -4.866   7.108 -20.831
   94   HD12  ILE  13          HD12      ILE  13  -3.290   7.356 -20.043
   95   HD13  ILE  13          HD13      ILE  13  -4.455   6.206 -19.368
   96    H    VAL  14           H        VAL  14  -1.912  10.769 -21.535
   97    HA   VAL  14           HA       VAL  14  -2.849  13.604 -21.557
   98    HB   VAL  14           HB       VAL  14  -0.423  12.443 -22.991
   99   HG11  VAL  14          HG11      VAL  14  -1.269  15.323 -22.442
  100   HG12  VAL  14          HG12      VAL  14   0.184  14.793 -23.321
  101   HG13  VAL  14          HG13      VAL  14  -1.417  14.482 -23.999
  102   HG21  VAL  14          HG21      VAL  14  -0.542  13.958 -20.368
  103   HG22  VAL  14          HG22      VAL  14   0.097  12.304 -20.645
  104   HG23  VAL  14          HG23      VAL  14   0.938  13.701 -21.319
  105    H    ILE  15           H        ILE  15  -4.923  13.043 -22.530
  106    HA   ILE  15           HA       ILE  15  -4.909  11.595 -25.085
  107    HB   ILE  15           HB       ILE  15  -7.047  13.479 -23.972
  108   HG12  ILE  15          HG12      ILE  15  -6.993  11.549 -22.563
  109   HG13  ILE  15          HG13      ILE  15  -8.387  11.451 -23.611
  110   HG21  ILE  15          HG21      ILE  15  -8.525  12.391 -25.697
  111   HG22  ILE  15          HG22      ILE  15  -7.319  13.487 -26.339
  112   HG23  ILE  15          HG23      ILE  15  -7.060  11.730 -26.466
  113   HD11  ILE  15          HD11      ILE  15  -5.800   9.868 -23.863
  114   HD12  ILE  15          HD12      ILE  15  -7.429   9.239 -23.570
  115   HD13  ILE  15          HD13      ILE  15  -6.999   9.910 -25.160
  116    H    CYS  16           H        CYS  16  -4.557  12.443 -27.041
  117    HA   CYS  16           HA       CYS  16  -4.409  15.418 -27.320
  118    HB2  CYS  16           HB2      CYS  16  -2.492  13.336 -28.426
  119    HB3  CYS  16           HB3      CYS  16  -2.659  14.978 -29.115
  120    HG   CYS  16           HG       CYS  16  -2.110  14.165 -25.952
  121    H    ASN  17           H        ASN  17  -5.952  16.025 -28.608
  122    HA   ASN  17           HA       ASN  17  -7.378  14.103 -30.321
  123    HB2  ASN  17           HB2      ASN  17  -8.641  15.872 -29.057
  124    HB3  ASN  17           HB3      ASN  17  -7.765  17.121 -29.955
  125   HD21  ASN  17          HD22      ASN  17 -10.400  14.800 -30.115
  126   HD22  ASN  17          HD21      ASN  17 -10.812  15.080 -31.791
  127    H    ARG  18           H        ARG  18  -7.074  14.061 -32.528
  128    HA   ARG  18           HA       ARG  18  -4.533  14.737 -33.533
  129    HB2  ARG  18           HB2      ARG  18  -7.012  14.075 -35.181
  130    HB3  ARG  18           HB3      ARG  18  -5.311  13.809 -35.614
  131    HG2  ARG  18           HG2      ARG  18  -5.130  12.215 -33.647
  132    HG3  ARG  18           HG3      ARG  18  -6.882  12.414 -33.387
  133    HD2  ARG  18           HD2      ARG  18  -7.306  11.733 -35.720
  134    HD3  ARG  18           HD3      ARG  18  -5.552  11.467 -35.934
  135    HE   ARG  18           HE       ARG  18  -6.840  10.041 -33.675
  136   HH11  ARG  18          HH11      ARG  18  -6.046   9.726 -37.138
  137   HH12  ARG  18          HH12      ARG  18  -5.953   8.004 -37.093
  138   HH21  ARG  18          HH21      ARG  18  -6.654   7.831 -33.598
  139   HH22  ARG  18          HH22      ARG  18  -6.337   6.879 -35.029
  140    H    GLN  19           H        GLN  19  -7.218  16.894 -33.297
  141    HA   GLN  19           HA       GLN  19  -6.402  18.575 -35.539
  142    HB2  GLN  19           HB2      GLN  19  -8.025  19.095 -33.029
  143    HB3  GLN  19           HB3      GLN  19  -7.783  20.287 -34.320
  144    HG2  GLN  19           HG2      GLN  19  -8.996  19.036 -35.915
  145    HG3  GLN  19           HG3      GLN  19  -8.941  17.557 -34.958
  146   HE21  GLN  19          HE22      GLN  19 -10.169  17.420 -32.983
  147   HE22  GLN  19          HE21      GLN  19 -11.614  18.401 -32.737
  148    H    GLY  20           H        GLY  20  -4.893  17.809 -32.540
  149    HA2  GLY  20           HA2      GLY  20  -2.647  18.391 -32.115
  150    HA3  GLY  20           HA3      GLY  20  -2.868  19.960 -32.907
  151    H    GLN  21           H        GLN  21  -4.870  18.363 -30.409
  152    HA   GLN  21           HA       GLN  21  -4.413  20.696 -28.626
  153    HB2  GLN  21           HB2      GLN  21  -7.082  19.950 -29.888
  154    HB3  GLN  21           HB3      GLN  21  -6.980  20.778 -28.347
  155    HG2  GLN  21           HG2      GLN  21  -7.152  22.595 -29.734
  156    HG3  GLN  21           HG3      GLN  21  -5.409  22.493 -29.597
  157   HE21  GLN  21          HE22      GLN  21  -4.215  22.342 -31.637
  158   HE22  GLN  21          HE21      GLN  21  -4.970  21.946 -33.154
  159    H    VAL  22           H        VAL  22  -4.951  20.257 -26.420
  160    HA   VAL  22           HA       VAL  22  -4.447  17.367 -25.895
  161    HB   VAL  22           HB       VAL  22  -3.321  18.207 -23.837
  162   HG11  VAL  22          HG11      VAL  22  -2.006  17.663 -25.812
  163   HG12  VAL  22          HG12      VAL  22  -2.276  19.279 -26.491
  164   HG13  VAL  22          HG13      VAL  22  -1.317  19.077 -25.012
  165   HG21  VAL  22          HG21      VAL  22  -3.665  20.977 -25.082
  166   HG22  VAL  22          HG22      VAL  22  -4.479  20.378 -23.621
  167   HG23  VAL  22          HG23      VAL  22  -2.713  20.552 -23.652
  168    H    MET  23           H        MET  23  -5.055  16.456 -23.921
  169    HA   MET  23           HA       MET  23  -7.714  16.589 -23.090
  170    HB2  MET  23           HB2      MET  23  -5.973  14.776 -22.643
  171    HB3  MET  23           HB3      MET  23  -5.303  15.791 -21.386
  172    HG2  MET  23           HG2      MET  23  -6.780  14.170 -20.379
  173    HG3  MET  23           HG3      MET  23  -7.518  15.758 -20.218
  174    HE1  MET  23           HE1      MET  23 -10.675  13.461 -20.579
  175    HE2  MET  23           HE2      MET  23  -9.170  13.108 -19.694
  176    HE3  MET  23           HE3      MET  23  -9.889  14.736 -19.624
  177    H    TRP  24           H        TRP  24  -8.794  18.001 -21.791
  178    HA   TRP  24           HA       TRP  24  -7.669  18.975 -19.371
  179    HB2  TRP  24           HB2      TRP  24  -6.962  20.729 -21.141
  180    HB3  TRP  24           HB3      TRP  24  -8.660  21.136 -21.276
  181    HD1  TRP  24           HD1      TRP  24  -9.010  23.330 -20.054
  182    HE1  TRP  24           HE1      TRP  24  -8.205  24.455 -17.913
  183    HE3  TRP  24           HE3      TRP  24  -5.951  19.613 -18.229
  184    HZ2  TRP  24           HZ2      TRP  24  -6.192  23.997 -15.891
  185    HZ3  TRP  24           HZ3      TRP  24  -4.631  19.997 -16.182
  186    HH2  TRP  24           HH2      TRP  24  -4.706  22.189 -15.020
  187    H    ALA  25           H        ALA  25  -9.410  18.866 -17.945
  188    HA   ALA  25           HA       ALA  25 -12.137  19.035 -19.012
  189    HB1  ALA  25           HB1      ALA  25 -12.749  16.837 -18.008
  190    HB2  ALA  25           HB2      ALA  25 -11.644  16.673 -19.382
  191    HB3  ALA  25           HB3      ALA  25 -11.028  16.506 -17.721
  192    H    ARG  26           H        ARG  26 -13.620  19.564 -17.493
  193    HA   ARG  26           HA       ARG  26 -12.606  21.040 -15.219
  194    HB2  ARG  26           HB2      ARG  26 -14.419  21.783 -16.691
  195    HB3  ARG  26           HB3      ARG  26 -15.374  20.358 -16.271
  196    HG2  ARG  26           HG2      ARG  26 -15.723  21.192 -14.009
  197    HG3  ARG  26           HG3      ARG  26 -14.606  22.550 -14.291
  198    HD2  ARG  26           HD2      ARG  26 -17.144  23.078 -14.496
  199    HD3  ARG  26           HD3      ARG  26 -16.075  23.641 -15.774
  200    HE   ARG  26           HE       ARG  26 -16.949  22.190 -17.301
  201   HH11  ARG  26          HH11      ARG  26 -18.779  21.719 -14.306
  202   HH12  ARG  26          HH12      ARG  26 -19.582  20.291 -14.865
  203   HH21  ARG  26          HH21      ARG  26 -17.858  20.159 -17.957
  204   HH22  ARG  26          HH22      ARG  26 -19.060  19.406 -16.953
  205    H    ARG  27           H        ARG  27 -12.675  20.402 -12.992
  206    HA   ARG  27           HA       ARG  27 -12.708  17.544 -12.706
  207    HB2  ARG  27           HB2      ARG  27 -11.096  19.197 -11.671
  208    HB3  ARG  27           HB3      ARG  27 -12.325  19.564 -10.486
  209    HG2  ARG  27           HG2      ARG  27 -10.964  16.870 -10.920
  210    HG3  ARG  27           HG3      ARG  27 -10.578  18.037  -9.666
  211    HD2  ARG  27           HD2      ARG  27 -12.813  17.745  -8.654
  212    HD3  ARG  27           HD3      ARG  27 -13.159  16.477  -9.851
  213    HE   ARG  27           HE       ARG  27 -10.748  15.738  -8.673
  214   HH11  ARG  27          HH21      ARG  27 -14.166  16.086  -7.648
  215   HH12  ARG  27          HH22      ARG  27 -13.987  14.962  -6.338
  216   HH21  ARG  27          HH12      ARG  27 -10.554  14.283  -7.120
  217   HH22  ARG  27          HH11      ARG  27 -11.848  13.868  -6.010
  218    H    PHE  28           H        PHE  28 -14.271  16.296 -11.933
  219    HA   PHE  28           HA       PHE  28 -16.989  16.900 -11.582
  220    HB2  PHE  28           HB2      PHE  28 -16.223  14.675 -12.023
  221    HB3  PHE  28           HB3      PHE  28 -15.089  14.709 -10.683
  222    HD1  PHE  28           HD2      PHE  28 -18.792  14.715 -11.362
  223    HD2  PHE  28           HD1      PHE  28 -15.564  13.634  -8.697
  224    HE1  PHE  28           HE2      PHE  28 -20.369  13.396  -9.976
  225    HE2  PHE  28           HE1      PHE  28 -17.149  12.264  -7.350
  226    HZ   PHE  28           HZ       PHE  28 -19.554  12.167  -7.975
  227    H    GLY  29           H        GLY  29 -18.112  17.882  -9.929
  228    HA2  GLY  29           HA2      GLY  29 -18.818  18.366  -7.825
  229    HA3  GLY  29           HA3      GLY  29 -17.467  17.445  -7.156
  230    H    GLN  30           H        GLN  30 -15.371  19.028  -8.541
  231    HA   GLN  30           HA       GLN  30 -15.227  21.241  -6.626
  232    HB2  GLN  30           HB2      GLN  30 -13.312  19.774  -6.993
  233    HB3  GLN  30           HB3      GLN  30 -13.335  20.118  -8.720
  234    HG2  GLN  30           HG2      GLN  30 -12.758  22.495  -8.241
  235    HG3  GLN  30           HG3      GLN  30 -12.715  22.119  -6.520
  236   HE21  GLN  30          HE22      GLN  30 -11.101  21.354  -9.716
  237   HE22  GLN  30          HE21      GLN  30  -9.581  20.946  -8.979
  238    H    HIS  31           H        HIS  31 -15.606  20.750 -10.129
  239    HA   HIS  31           HA       HIS  31 -16.015  22.056 -11.852
  240    HB2  HIS  31           HB2      HIS  31 -17.449  23.916  -9.958
  241    HB3  HIS  31           HB3      HIS  31 -17.736  23.713 -11.685
  242    HD1  HIS  31           HD1      HIS  31 -19.631  22.895  -8.890
  243    HD2  HIS  31           HD2      HIS  31 -17.847  20.491 -11.856
  244    HE1  HIS  31           HE1      HIS  31 -20.878  20.681  -8.866
  245    H    SER  32           H        SER  32 -13.520  22.324 -10.724
  246    HA   SER  32           HA       SER  32 -12.599  24.696 -12.158
  247    HB2  SER  32           HB2      SER  32 -11.431  23.950  -9.440
  248    HB3  SER  32           HB3      SER  32 -10.940  25.283 -10.488
  249    HG   SER  32           HG       SER  32 -12.286  26.007  -8.776
  250    H    TRP  33           H        TRP  33 -10.215  24.212 -12.778
  251    HA   TRP  33           HA       TRP  33 -10.261  21.593 -13.887
  252    HB2  TRP  33           HB2      TRP  33  -7.987  23.596 -13.971
  253    HB3  TRP  33           HB3      TRP  33  -8.376  22.319 -15.133
  254    HD1  TRP  33           HD1      TRP  33  -9.281  25.877 -14.188
  255    HE1  TRP  33           HE1      TRP  33 -11.105  26.810 -15.712
  256    HE3  TRP  33           HE3      TRP  33 -10.293  21.666 -16.902
  257    HZ2  TRP  33           HZ2      TRP  33 -12.752  25.878 -17.903
  258    HZ3  TRP  33           HZ3      TRP  33 -11.980  21.724 -18.721
  259    HH2  TRP  33           HH2      TRP  33 -13.225  23.817 -19.214
  260    H    GLN  34           H        GLN  34  -8.272  20.150 -13.995
  261    HA   GLN  34           HA       GLN  34  -6.779  19.810 -11.494
  262    HB2  GLN  34           HB2      GLN  34  -8.808  18.787 -10.847
  263    HB3  GLN  34           HB3      GLN  34  -9.073  18.051 -12.426
  264    HG2  GLN  34           HG2      GLN  34  -8.538  16.363 -10.769
  265    HG3  GLN  34           HG3      GLN  34  -7.325  16.422 -12.030
  266   HE21  GLN  34          HE22      GLN  34  -5.403  15.883 -11.087
  267   HE22  GLN  34          HE21      GLN  34  -4.761  16.578  -9.614
  268    H    PHE  35           H        PHE  35  -4.940  18.524 -11.839
  269    HA   PHE  35           HA       PHE  35  -4.067  18.234 -14.588
  270    HB2  PHE  35           HB2      PHE  35  -1.992  17.340 -13.523
  271    HB3  PHE  35           HB3      PHE  35  -2.444  18.956 -13.012
  272    HD1  PHE  35           HD1      PHE  35  -2.193  15.404 -11.947
  273    HD2  PHE  35           HD2      PHE  35  -3.091  19.438 -10.696
  274    HE1  PHE  35           HE1      PHE  35  -2.207  14.673  -9.580
  275    HE2  PHE  35           HE2      PHE  35  -3.133  18.692  -8.330
  276    HZ   PHE  35           HZ       PHE  35  -2.717  16.306  -7.765
  277    HA   PRO  36           HA       PRO  36  -5.450  14.046 -15.042
  278    HB2  PRO  36           HB2      PRO  36  -2.982  13.547 -16.668
  279    HB3  PRO  36           HB3      PRO  36  -4.662  13.154 -17.068
  280    HG2  PRO  36           HG2      PRO  36  -3.500  15.330 -18.202
  281    HG3  PRO  36           HG3      PRO  36  -5.189  15.413 -17.615
  282    HD2  PRO  36           HD2      PRO  36  -2.681  16.424 -16.243
  283    HD3  PRO  36           HD3      PRO  36  -4.286  17.196 -16.405
  284    H    GLN  37           H        GLN  37  -5.054  12.011 -14.269
  285    HA   GLN  37           HA       GLN  37  -2.705  10.847 -13.393
  286    HB2  GLN  37           HB2      GLN  37  -3.080  10.772 -10.937
  287    HB3  GLN  37           HB3      GLN  37  -2.426  12.288 -11.534
  288    HG2  GLN  37           HG2      GLN  37  -4.586  13.403 -11.258
  289    HG3  GLN  37           HG3      GLN  37  -5.383  11.881 -10.882
  290   HE21  GLN  37          HE22      GLN  37  -6.122  13.240  -9.020
  291   HE22  GLN  37          HE21      GLN  37  -5.101  13.255  -7.584
  292    H    GLY  38           H        GLY  38  -3.175   8.704 -13.266
  293    HA2  GLY  38           HA2      GLY  38  -5.968   7.793 -12.789
  294    HA3  GLY  38           HA3      GLY  38  -4.643   6.872 -13.490
  295    H    GLY  39           H        GLY  39  -3.708   5.424 -12.232
  296    HA2  GLY  39           HA2      GLY  39  -2.966   5.568  -9.503
  297    HA3  GLY  39           HA3      GLY  39  -4.491   4.676  -9.684
  298    H    ILE  40           H        ILE  40  -2.003   3.375  -8.926
  299    HA   ILE  40           HA       ILE  40  -1.861   1.434 -11.193
  300    HB   ILE  40           HB       ILE  40   0.278   2.610  -9.425
  301   HG12  ILE  40          HG12      ILE  40   0.428   1.631 -12.294
  302   HG13  ILE  40          HG13      ILE  40  -0.170   3.238 -11.889
  303   HG21  ILE  40          HG21      ILE  40   0.482   0.263  -8.863
  304   HG22  ILE  40          HG22      ILE  40   0.479  -0.191 -10.582
  305   HG23  ILE  40          HG23      ILE  40   1.824   0.737  -9.889
  306   HD11  ILE  40          HD11      ILE  40   2.044   3.764 -10.852
  307   HD12  ILE  40          HD12      ILE  40   2.638   2.177 -11.401
  308   HD13  ILE  40          HD13      ILE  40   2.107   3.385 -12.574
  309    H    ASN  41           H        ASN  41  -2.441  -0.631 -10.652
  310    HA   ASN  41           HA       ASN  41  -3.316  -1.146  -7.877
  311    HB2  ASN  41           HB2      ASN  41  -3.564  -2.812 -10.418
  312    HB3  ASN  41           HB3      ASN  41  -4.063  -3.361  -8.831
  313   HD21  ASN  41          HD22      ASN  41  -4.864  -1.241 -11.519
  314   HD22  ASN  41          HD21      ASN  41  -6.437  -0.737 -10.894
  315    HA   PRO  42           HA       PRO  42   0.286  -3.066  -6.583
  316    HB2  PRO  42           HB2      PRO  42  -1.267  -5.502  -5.673
  317    HB3  PRO  42           HB3      PRO  42  -0.056  -4.535  -4.775
  318    HG2  PRO  42           HG2      PRO  42  -2.693  -4.164  -4.309
  319    HG3  PRO  42           HG3      PRO  42  -1.613  -2.735  -4.473
  320    HD2  PRO  42           HD2      PRO  42  -3.427  -3.975  -6.569
  321    HD3  PRO  42           HD3      PRO  42  -3.236  -2.253  -6.116
  322    H    GLY  43           H        GLY  43   1.721  -3.653  -7.970
  323    HA2  GLY  43           HA2      GLY  43   3.088  -5.060  -9.195
  324    HA3  GLY  43           HA3      GLY  43   1.932  -6.381  -8.982
  325    H    GLU  44           H        GLU  44   0.401  -3.531 -10.154
  326    HA   GLU  44           HA       GLU  44   0.043  -4.707 -12.842
  327    HB2  GLU  44           HB2      GLU  44  -1.804  -3.757 -11.506
  328    HB3  GLU  44           HB3      GLU  44  -1.059  -2.148 -11.627
  329    HG2  GLU  44           HG2      GLU  44  -1.324  -2.145 -14.026
  330    HG3  GLU  44           HG3      GLU  44  -1.810  -3.846 -14.029
  331    H    SER  45           H        SER  45   1.312  -4.235 -14.522
  332    HA   SER  45           HA       SER  45   3.443  -2.341 -14.334
  333    HB2  SER  45           HB2      SER  45   3.625  -3.176 -16.854
  334    HB3  SER  45           HB3      SER  45   4.111  -4.154 -15.468
  335    HG   SER  45           HG       SER  45   2.839  -5.529 -16.523
  336    H    ALA  46           H        ALA  46   3.891  -0.701 -15.933
  337    HA   ALA  46           HA       ALA  46   2.193   1.401 -15.537
  338    HB1  ALA  46           HB1      ALA  46   3.615   2.577 -17.155
  339    HB2  ALA  46           HB2      ALA  46   4.609   1.474 -16.185
  340    HB3  ALA  46           HB3      ALA  46   4.153   1.011 -17.843
  341    H    GLU  47           H        GLU  47   2.273  -0.680 -18.496
  342    HA   GLU  47           HA       GLU  47   0.473   1.099 -19.921
  343    HB2  GLU  47           HB2      GLU  47   1.386  -1.751 -20.456
  344    HB3  GLU  47           HB3      GLU  47   0.294  -0.858 -21.518
  345    HG2  GLU  47           HG2      GLU  47   1.975   0.868 -21.899
  346    HG3  GLU  47           HG3      GLU  47   3.088   0.091 -20.765
  347    H    GLN  48           H        GLN  48   0.145  -1.928 -18.067
  348    HA   GLN  48           HA       GLN  48  -2.620  -2.383 -18.566
  349    HB2  GLN  48           HB2      GLN  48  -0.742  -3.241 -16.301
  350    HB3  GLN  48           HB3      GLN  48  -2.411  -3.755 -16.405
  351    HG2  GLN  48           HG2      GLN  48  -0.744  -5.405 -17.326
  352    HG3  GLN  48           HG3      GLN  48  -2.074  -4.987 -18.395
  353   HE21  GLN  48          HE22      GLN  48   1.400  -4.063 -17.753
  354   HE22  GLN  48          HE21      GLN  48   1.766  -3.701 -19.425
  355    H    ALA  49           H        ALA  49  -0.926  -0.596 -15.954
  356    HA   ALA  49           HA       ALA  49  -3.265   0.406 -14.639
  357    HB1  ALA  49           HB1      ALA  49  -1.039   0.346 -13.611
  358    HB2  ALA  49           HB2      ALA  49  -0.435   1.523 -14.808
  359    HB3  ALA  49           HB3      ALA  49  -1.692   1.996 -13.653
  360    H    MET  50           H        MET  50  -1.458   1.552 -17.531
  361    HA   MET  50           HA       MET  50  -2.751   4.105 -17.585
  362    HB2  MET  50           HB2      MET  50  -0.603   3.739 -18.636
  363    HB3  MET  50           HB3      MET  50  -1.297   2.579 -19.764
  364    HG2  MET  50           HG2      MET  50  -2.133   5.484 -19.560
  365    HG3  MET  50           HG3      MET  50  -0.925   4.879 -20.678
  366    HE1  MET  50           HE1      MET  50  -1.954   2.255 -22.004
  367    HE2  MET  50           HE2      MET  50  -2.771   2.992 -23.402
  368    HE3  MET  50           HE3      MET  50  -1.254   3.689 -22.797
  369    H    TYR  51           H        TYR  51  -3.657   0.988 -19.181
  370    HA   TYR  51           HA       TYR  51  -5.988   2.200 -20.224
  371    HB2  TYR  51           HB2      TYR  51  -5.606  -0.703 -19.487
  372    HB3  TYR  51           HB3      TYR  51  -6.906  -0.041 -20.478
  373    HD1  TYR  51           HD2      TYR  51  -6.349   0.997 -22.783
  374    HD2  TYR  51           HD1      TYR  51  -3.422  -0.997 -20.345
  375    HE1  TYR  51           HE2      TYR  51  -4.891   0.734 -24.760
  376    HE2  TYR  51           HE1      TYR  51  -1.909  -1.220 -22.281
  377    HH   TYR  51           HH       TYR  51  -1.713  -0.956 -24.639
  378    H    ARG  52           H        ARG  52  -5.313   1.123 -16.890
  379    HA   ARG  52           HA       ARG  52  -8.102   1.314 -16.041
  380    HB2  ARG  52           HB2      ARG  52  -5.699   1.991 -14.297
  381    HB3  ARG  52           HB3      ARG  52  -7.325   1.613 -13.786
  382    HG2  ARG  52           HG2      ARG  52  -5.371  -0.324 -15.071
  383    HG3  ARG  52           HG3      ARG  52  -5.771  -0.197 -13.361
  384    HD2  ARG  52           HD2      ARG  52  -8.112  -0.858 -13.864
  385    HD3  ARG  52           HD3      ARG  52  -7.657  -1.059 -15.583
  386    HE   ARG  52           HE       ARG  52  -5.759  -2.464 -14.071
  387   HH11  ARG  52          HH11      ARG  52  -9.273  -2.869 -14.604
  388   HH12  ARG  52          HH12      ARG  52  -9.212  -4.574 -14.310
  389   HH21  ARG  52          HH21      ARG  52  -5.677  -4.514 -13.705
  390   HH22  ARG  52          HH22      ARG  52  -7.065  -5.589 -13.771
  391    H    ALA  53           H        ALA  53  -5.319   3.632 -16.076
  392    HA   ALA  53           HA       ALA  53  -6.736   5.804 -14.982
  393    HB1  ALA  53           HB1      ALA  53  -4.939   7.168 -15.888
  394    HB2  ALA  53           HB2      ALA  53  -4.241   5.644 -15.286
  395    HB3  ALA  53           HB3      ALA  53  -4.480   5.889 -17.027
  396    H    LEU  54           H        LEU  54  -6.462   4.639 -18.292
  397    HA   LEU  54           HA       LEU  54  -7.584   6.806 -19.726
  398    HB2  LEU  54           HB2      LEU  54  -6.289   4.903 -20.618
  399    HB3  LEU  54           HB3      LEU  54  -7.539   3.803 -20.054
  400    HG   LEU  54           HG       LEU  54  -9.133   4.748 -21.685
  401   HD11  LEU  54          HD11      LEU  54  -6.700   6.342 -22.598
  402   HD12  LEU  54          HD12      LEU  54  -8.222   6.160 -23.513
  403   HD13  LEU  54          HD13      LEU  54  -8.231   6.990 -21.954
  404   HD21  LEU  54          HD21      LEU  54  -8.098   3.612 -23.557
  405   HD22  LEU  54          HD22      LEU  54  -6.511   3.647 -22.719
  406   HD23  LEU  54          HD23      LEU  54  -7.879   2.743 -22.028
  407    H    PHE  55           H        PHE  55  -8.965   3.936 -18.207
  408    HA   PHE  55           HA       PHE  55 -11.706   4.629 -18.707
  409    HB2  PHE  55           HB2      PHE  55 -11.433   2.374 -18.447
  410    HB3  PHE  55           HB3      PHE  55 -10.216   2.527 -17.202
  411    HD1  PHE  55           HD2      PHE  55 -10.765   2.926 -14.885
  412    HD2  PHE  55           HD1      PHE  55 -13.810   2.199 -17.841
  413    HE1  PHE  55           HE2      PHE  55 -12.423   2.473 -13.066
  414    HE2  PHE  55           HE1      PHE  55 -15.451   1.697 -16.036
  415    HZ   PHE  55           HZ       PHE  55 -14.763   1.852 -13.649
  416    H    GLU  56           H        GLU  56  -9.625   5.046 -15.746
  417    HA   GLU  56           HA       GLU  56 -11.694   6.080 -14.141
  418    HB2  GLU  56           HB2      GLU  56  -8.675   6.530 -14.083
  419    HB3  GLU  56           HB3      GLU  56  -9.761   7.092 -12.816
  420    HG2  GLU  56           HG2      GLU  56 -10.438   4.815 -12.282
  421    HG3  GLU  56           HG3      GLU  56  -9.409   4.171 -13.557
  422    H    GLU  57           H        GLU  57  -9.460   7.720 -16.366
  423    HA   GLU  57           HA       GLU  57 -10.283  10.370 -15.417
  424    HB2  GLU  57           HB2      GLU  57  -8.217   9.546 -17.512
  425    HB3  GLU  57           HB3      GLU  57  -8.500  11.156 -16.866
  426    HG2  GLU  57           HG2      GLU  57  -7.978  10.142 -14.540
  427    HG3  GLU  57           HG3      GLU  57  -7.336   8.748 -15.397
  428    H    VAL  58           H        VAL  58 -10.464   8.358 -18.376
  429    HA   VAL  58           HA       VAL  58 -11.980  10.542 -19.697
  430    HB   VAL  58           HB       VAL  58 -10.672   8.392 -21.290
  431   HG11  VAL  58          HG11      VAL  58 -10.652  11.424 -21.606
  432   HG12  VAL  58          HG12      VAL  58 -10.365  10.190 -22.847
  433   HG13  VAL  58          HG13      VAL  58 -11.978  10.396 -22.140
  434   HG21  VAL  58          HG21      VAL  58  -9.008  10.587 -19.959
  435   HG22  VAL  58          HG22      VAL  58  -8.785   8.841 -19.766
  436   HG23  VAL  58          HG23      VAL  58  -8.496   9.590 -21.338
  437    H    GLY  59           H        GLY  59 -12.253   7.298 -18.504
  438    HA2  GLY  59           HA2      GLY  59 -13.855   5.712 -18.707
  439    HA3  GLY  59           HA3      GLY  59 -14.979   6.944 -19.304
  440    H    LEU  60           H        LEU  60 -11.836   5.734 -20.501
  441    HA   LEU  60           HA       LEU  60 -13.119   4.727 -22.996
  442    HB2  LEU  60           HB2      LEU  60 -10.524   6.243 -22.549
  443    HB3  LEU  60           HB3      LEU  60 -10.841   5.307 -24.000
  444    HG   LEU  60           HG       LEU  60 -12.260   7.797 -23.003
  445   HD11  LEU  60          HD11      LEU  60 -10.669   7.176 -25.545
  446   HD12  LEU  60          HD12      LEU  60 -11.423   8.726 -25.174
  447   HD13  LEU  60          HD13      LEU  60 -10.103   8.123 -24.159
  448   HD21  LEU  60          HD21      LEU  60 -13.631   7.713 -25.117
  449   HD22  LEU  60          HD22      LEU  60 -13.109   6.015 -25.324
  450   HD23  LEU  60          HD23      LEU  60 -14.067   6.511 -23.922
  451    H    SER  61           H        SER  61 -11.959   2.886 -23.924
  452    HA   SER  61           HA       SER  61 -10.783   1.155 -21.786
  453    HB2  SER  61           HB2      SER  61 -12.733   0.489 -24.032
  454    HB3  SER  61           HB3      SER  61 -12.125  -0.641 -22.808
  455    HG   SER  61           HG       SER  61 -14.202   0.200 -22.244
  456    H    ARG  62           H        ARG  62  -9.987  -0.981 -23.117
  457    HA   ARG  62           HA       ARG  62  -7.471  -0.201 -24.138
  458    HB2  ARG  62           HB2      ARG  62  -8.772  -2.968 -24.107
  459    HB3  ARG  62           HB3      ARG  62  -7.046  -2.626 -24.276
  460    HG2  ARG  62           HG2      ARG  62  -7.008  -1.660 -22.017
  461    HG3  ARG  62           HG3      ARG  62  -8.709  -2.114 -21.786
  462    HD2  ARG  62           HD2      ARG  62  -8.091  -4.488 -22.161
  463    HD3  ARG  62           HD3      ARG  62  -6.395  -4.001 -22.398
  464    HE   ARG  62           HE       ARG  62  -7.377  -3.042 -19.871
  465   HH11  ARG  62          HH11      ARG  62  -6.338  -6.058 -21.446
  466   HH12  ARG  62          HH12      ARG  62  -5.846  -6.822 -19.979
  467   HH21  ARG  62          HH21      ARG  62  -6.735  -4.068 -17.908
  468   HH22  ARG  62          HH22      ARG  62  -6.097  -5.673 -17.927
  469    H    LYS  63           H        LYS  63  -9.110   0.952 -25.948
  470    HA   LYS  63           HA       LYS  63  -8.422  -0.247 -28.527
  471    HB2  LYS  63           HB2      LYS  63 -10.691  -0.804 -29.204
  472    HB3  LYS  63           HB3      LYS  63 -10.277  -1.682 -27.724
  473    HG2  LYS  63           HG2      LYS  63 -11.574  -0.024 -26.379
  474    HG3  LYS  63           HG3      LYS  63 -12.043   0.799 -27.875
  475    HD2  LYS  63           HD2      LYS  63 -13.195  -1.207 -28.675
  476    HD3  LYS  63           HD3      LYS  63 -12.677  -2.110 -27.230
  477    HE2  LYS  63           HE2      LYS  63 -13.894  -0.522 -25.779
  478    HE3  LYS  63           HE3      LYS  63 -14.374   0.431 -27.187
  479    HZ1  LYS  63           HZ1      LYS  63 -15.212  -2.380 -26.677
  480    HZ2  LYS  63           HZ2      LYS  63 -16.151  -1.055 -26.487
  481    HZ3  LYS  63           HZ3      LYS  63 -15.657  -1.488 -27.975
  482    H    ASP  64           H        ASP  64  -9.898   2.263 -26.566
  483    HA   ASP  64           HA       ASP  64 -10.959   3.788 -28.797
  484    HB2  ASP  64           HB2      ASP  64 -10.654   4.225 -25.822
  485    HB3  ASP  64           HB3      ASP  64 -11.434   5.392 -26.876
  486    H    VAL  65           H        VAL  65  -7.810   3.446 -27.738
  487    HA   VAL  65           HA       VAL  65  -6.989   6.068 -28.755
  488    HB   VAL  65           HB       VAL  65  -5.557   6.496 -26.809
  489   HG11  VAL  65          HG11      VAL  65  -7.795   7.581 -27.016
  490   HG12  VAL  65          HG12      VAL  65  -8.472   6.324 -25.969
  491   HG13  VAL  65          HG13      VAL  65  -7.220   7.422 -25.350
  492   HG21  VAL  65          HG21      VAL  65  -5.373   4.201 -25.872
  493   HG22  VAL  65          HG22      VAL  65  -5.932   5.361 -24.659
  494   HG23  VAL  65          HG23      VAL  65  -7.086   4.253 -25.425
  495    H    ARG  66           H        ARG  66  -4.547   6.144 -28.813
  496    HA   ARG  66           HA       ARG  66  -3.316   3.551 -29.654
  497    HB2  ARG  66           HB2      ARG  66  -4.203   4.522 -31.661
  498    HB3  ARG  66           HB3      ARG  66  -3.893   6.160 -31.112
  499    HG2  ARG  66           HG2      ARG  66  -2.447   5.749 -32.878
  500    HG3  ARG  66           HG3      ARG  66  -1.469   5.851 -31.422
  501    HD2  ARG  66           HD2      ARG  66  -2.406   3.129 -32.407
  502    HD3  ARG  66           HD3      ARG  66  -1.147   3.956 -33.331
  503    HE   ARG  66           HE       ARG  66  -0.067   4.121 -30.869
  504   HH11  ARG  66          HH11      ARG  66  -1.360   1.324 -32.666
  505   HH12  ARG  66          HH12      ARG  66  -0.197   0.222 -32.027
  506   HH21  ARG  66          HH21      ARG  66   1.461   2.714 -30.082
  507   HH22  ARG  66          HH22      ARG  66   1.447   1.026 -30.491
  508    H    ILE  67           H        ILE  67  -1.399   3.456 -28.341
  509    HA   ILE  67           HA       ILE  67  -0.422   5.872 -27.051
  510    HB   ILE  67           HB       ILE  67   0.782   3.091 -27.327
  511   HG12  ILE  67          HG12      ILE  67  -0.610   4.154 -24.847
  512   HG13  ILE  67          HG13      ILE  67  -1.575   3.424 -26.116
  513   HG21  ILE  67          HG21      ILE  67   2.513   4.683 -26.697
  514   HG22  ILE  67          HG22      ILE  67   1.476   5.388 -25.432
  515   HG23  ILE  67          HG23      ILE  67   2.098   3.732 -25.278
  516   HD11  ILE  67          HD11      ILE  67  -0.223   1.358 -26.023
  517   HD12  ILE  67          HD12      ILE  67   0.731   2.033 -24.678
  518   HD13  ILE  67          HD13      ILE  67  -0.997   1.724 -24.471
  519    H    LEU  68           H        LEU  68   1.059   7.300 -27.822
  520    HA   LEU  68           HA       LEU  68   2.686   6.455 -30.217
  521    HB2  LEU  68           HB2      LEU  68   1.613   9.094 -29.337
  522    HB3  LEU  68           HB3      LEU  68   3.219   9.112 -30.003
  523    HG   LEU  68           HG       LEU  68   1.349   9.574 -31.635
  524   HD11  LEU  68          HD11      LEU  68   3.264   7.300 -32.313
  525   HD12  LEU  68          HD12      LEU  68   2.448   8.367 -33.473
  526   HD13  LEU  68          HD13      LEU  68   3.638   9.035 -32.356
  527   HD21  LEU  68          HD21      LEU  68  -0.156   7.712 -30.875
  528   HD22  LEU  68          HD22      LEU  68   0.123   7.766 -32.632
  529   HD23  LEU  68          HD23      LEU  68   0.950   6.553 -31.650
  530    H    ALA  69           H        ALA  69   2.868   8.184 -27.099
  531    HA   ALA  69           HA       ALA  69   5.738   7.404 -26.821
  532    HB1  ALA  69           HB1      ALA  69   4.683  10.277 -26.659
  533    HB2  ALA  69           HB2      ALA  69   6.352   9.746 -26.387
  534    HB3  ALA  69           HB3      ALA  69   5.633   9.610 -27.998
  535    H    SER  70           H        SER  70   6.574   8.014 -24.610
  536    HA   SER  70           HA       SER  70   4.653   8.673 -22.561
  537    HB2  SER  70           HB2      SER  70   5.436   6.699 -21.122
  538    HB3  SER  70           HB3      SER  70   4.280   6.348 -22.415
  539    HG   SER  70           HG       SER  70   5.979   4.813 -22.418
  540    H    THR  71           H        THR  71   5.908   9.230 -20.449
  541    HA   THR  71           HA       THR  71   8.301  10.634 -21.147
  542    HB   THR  71           HB       THR  71   8.508  10.823 -18.567
  543    HG1  THR  71           HG1      THR  71   7.242   9.278 -17.774
  544   HG21  THR  71          HG21      THR  71   6.094  11.844 -20.114
  545   HG22  THR  71          HG22      THR  71   6.570  12.419 -18.496
  546   HG23  THR  71          HG23      THR  71   7.657  12.652 -19.878
  547    H    ARG  72           H        ARG  72  10.474  10.241 -20.624
  548    HA   ARG  72           HA       ARG  72  11.247   7.621 -21.340
  549    HB2  ARG  72           HB2      ARG  72  12.959   9.836 -20.122
  550    HB3  ARG  72           HB3      ARG  72  13.567   8.422 -20.994
  551    HG2  ARG  72           HG2      ARG  72  12.405   9.196 -23.063
  552    HG3  ARG  72           HG3      ARG  72  11.792  10.597 -22.179
  553    HD2  ARG  72           HD2      ARG  72  14.366  11.007 -21.643
  554    HD3  ARG  72           HD3      ARG  72  14.611  10.024 -23.088
  555    HE   ARG  72           HE       ARG  72  13.004  12.559 -22.860
  556   HH11  ARG  72          HH11      ARG  72  14.962  10.466 -24.987
  557   HH12  ARG  72          HH12      ARG  72  14.888  11.559 -26.324
  558   HH21  ARG  72          HH21      ARG  72  12.925  13.978 -24.551
  559   HH22  ARG  72          HH22      ARG  72  13.689  13.618 -26.079
  560    H    ASN  73           H        ASN  73  10.859   9.063 -18.159
  561    HA   ASN  73           HA       ASN  73  10.971   6.464 -16.969
  562    HB2  ASN  73           HB2      ASN  73  12.563   6.798 -15.276
  563    HB3  ASN  73           HB3      ASN  73  13.386   7.318 -16.732
  564   HD21  ASN  73          HD22      ASN  73  13.213   9.851 -17.158
  565   HD22  ASN  73          HD21      ASN  73  13.369  10.848 -15.729
  566    H    TRP  74           H        TRP  74  10.239   6.847 -14.496
  567    HA   TRP  74           HA       TRP  74   7.719   8.188 -14.617
  568    HB2  TRP  74           HB2      TRP  74   9.359   7.287 -12.199
  569    HB3  TRP  74           HB3      TRP  74   7.653   7.707 -12.192
  570    HD1  TRP  74           HD1      TRP  74  10.051   4.912 -13.247
  571    HE1  TRP  74           HE1      TRP  74   8.741   2.798 -13.841
  572    HE3  TRP  74           HE3      TRP  74   5.292   6.710 -12.712
  573    HZ2  TRP  74           HZ2      TRP  74   6.019   2.072 -14.366
  574    HZ3  TRP  74           HZ3      TRP  74   3.355   5.295 -13.340
  575    HH2  TRP  74           HH2      TRP  74   3.681   3.029 -14.258
  576    H    LEU  75           H        LEU  75   7.224  10.356 -14.227
  577    HA   LEU  75           HA       LEU  75   9.389  12.182 -13.350
  578    HB2  LEU  75           HB2      LEU  75   6.514  12.641 -14.259
  579    HB3  LEU  75           HB3      LEU  75   7.436  13.866 -13.393
  580    HG   LEU  75           HG       LEU  75   7.996  12.795 -16.177
  581   HD11  LEU  75          HD11      LEU  75   7.505  15.606 -15.082
  582   HD12  LEU  75          HD12      LEU  75   7.604  15.123 -16.785
  583   HD13  LEU  75          HD13      LEU  75   6.247  14.577 -15.772
  584   HD21  LEU  75          HD21      LEU  75   9.894  14.445 -16.209
  585   HD22  LEU  75          HD22      LEU  75   9.741  14.625 -14.451
  586   HD23  LEU  75          HD23      LEU  75  10.207  13.056 -15.174
  587    H    ARG  76           H        ARG  76   9.221  13.257 -11.334
  588    HA   ARG  76           HA       ARG  76   7.368  11.915  -9.368
  589    HB2  ARG  76           HB2      ARG  76  10.243  12.870  -8.938
  590    HB3  ARG  76           HB3      ARG  76   9.165  12.271  -7.675
  591    HG2  ARG  76           HG2      ARG  76  10.339  10.677  -9.989
  592    HG3  ARG  76           HG3      ARG  76  10.768  10.570  -8.281
  593    HD2  ARG  76           HD2      ARG  76   8.336   9.876  -7.844
  594    HD3  ARG  76           HD3      ARG  76   8.160   9.740  -9.598
  595    HE   ARG  76           HE       ARG  76  10.011   8.101  -9.606
  596   HH11  ARG  76          HH11      ARG  76   8.555   8.587  -6.367
  597   HH12  ARG  76          HH12      ARG  76   8.719   6.900  -5.935
  598   HH21  ARG  76          HH21      ARG  76  10.506   5.988  -8.818
  599   HH22  ARG  76          HH22      ARG  76   9.972   5.513  -7.236
  600    H    TYR  77           H        TYR  77   5.964  13.351  -8.529
  601    HA   TYR  77           HA       TYR  77   6.746  16.236  -8.587
  602    HB2  TYR  77           HB2      TYR  77   4.501  15.420  -9.698
  603    HB3  TYR  77           HB3      TYR  77   3.907  15.319  -8.026
  604    HD1  TYR  77           HD1      TYR  77   3.790  17.341  -6.611
  605    HD2  TYR  77           HD2      TYR  77   5.346  17.493 -10.638
  606    HE1  TYR  77           HE1      TYR  77   4.376  19.718  -6.296
  607    HE2  TYR  77           HE2      TYR  77   5.943  19.850 -10.330
  608    HH   TYR  77           HH       TYR  77   5.688  21.477  -7.127
  609    H    LYS  78           H        LYS  78   7.272  17.161  -6.645
  610    HA   LYS  78           HA       LYS  78   6.720  15.585  -4.166
  611    HB2  LYS  78           HB2      LYS  78   9.105  16.128  -4.901
  612    HB3  LYS  78           HB3      LYS  78   8.758  17.819  -4.598
  613    HG2  LYS  78           HG2      LYS  78   8.639  15.565  -2.543
  614    HG3  LYS  78           HG3      LYS  78   9.985  16.680  -2.781
  615    HD2  LYS  78           HD2      LYS  78   8.367  18.586  -2.249
  616    HD3  LYS  78           HD3      LYS  78   7.214  17.334  -1.727
  617    HE2  LYS  78           HE2      LYS  78   8.805  16.495  -0.061
  618    HE3  LYS  78           HE3      LYS  78  10.034  17.643  -0.616
  619    HZ1  LYS  78           HZ1      LYS  78   8.889  18.433   1.375
  620    HZ2  LYS  78           HZ2      LYS  78   8.635  19.463   0.138
  621    HZ3  LYS  78           HZ3      LYS  78   7.442  18.436   0.608
  622    H    LEU  79           H        LEU  79   4.974  16.314  -3.113
  623    HA   LEU  79           HA       LEU  79   3.530  18.612  -4.040
  624    HB2  LEU  79           HB2      LEU  79   3.181  16.711  -1.696
  625    HB3  LEU  79           HB3      LEU  79   2.038  18.005  -2.006
  626    HG   LEU  79           HG       LEU  79   2.666  15.824  -4.033
  627   HD11  LEU  79          HD11      LEU  79   0.353  15.996  -2.046
  628   HD12  LEU  79          HD12      LEU  79   0.558  14.768  -3.314
  629   HD13  LEU  79          HD13      LEU  79   1.704  14.836  -1.973
  630   HD21  LEU  79          HD21      LEU  79   0.395  17.847  -3.821
  631   HD22  LEU  79          HD22      LEU  79   1.696  17.859  -5.038
  632   HD23  LEU  79          HD23      LEU  79   0.500  16.560  -5.030
  633    HA   PRO  80           HA       PRO  80   5.014  21.644  -1.033
  634    HB2  PRO  80           HB2      PRO  80   2.887  23.360  -0.906
  635    HB3  PRO  80           HB3      PRO  80   3.910  23.240  -2.367
  636    HG2  PRO  80           HG2      PRO  80   1.309  21.763  -1.817
  637    HG3  PRO  80           HG3      PRO  80   1.703  22.803  -3.257
  638    HD2  PRO  80           HD2      PRO  80   1.991  20.125  -3.356
  639    HD3  PRO  80           HD3      PRO  80   3.243  21.183  -4.074
  640    H    LYS  81           H        LYS  81   4.660  21.973   1.300
  641    HA   LYS  81           HA       LYS  81   3.661  19.667   2.467
  642    HB2  LYS  81           HB2      LYS  81   4.296  20.546   4.592
  643    HB3  LYS  81           HB3      LYS  81   5.447  21.044   3.376
  644    HG2  LYS  81           HG2      LYS  81   5.271  23.011   4.498
  645    HG3  LYS  81           HG3      LYS  81   4.023  23.279   3.297
  646    HD2  LYS  81           HD2      LYS  81   3.209  24.028   5.422
  647    HD3  LYS  81           HD3      LYS  81   2.293  22.577   5.026
  648    HE2  LYS  81           HE2      LYS  81   3.733  21.233   6.550
  649    HE3  LYS  81           HE3      LYS  81   4.748  22.652   6.852
  650    HZ1  LYS  81           HZ1      LYS  81   1.883  22.413   7.616
  651    HZ2  LYS  81           HZ2      LYS  81   3.155  22.305   8.632
  652    HZ3  LYS  81           HZ3      LYS  81   2.827  23.722   7.896
  653    H    ARG  82           H        ARG  82   1.829  22.514   1.844
  654    HA   ARG  82           HA       ARG  82  -0.351  21.897   3.630
  655    HB2  ARG  82           HB2      ARG  82  -1.477  23.757   2.599
  656    HB3  ARG  82           HB3      ARG  82   0.203  24.173   2.883
  657    HG2  ARG  82           HG2      ARG  82   0.428  23.344   0.280
  658    HG3  ARG  82           HG3      ARG  82  -1.289  23.735   0.298
  659    HD2  ARG  82           HD2      ARG  82  -0.104  25.670  -0.457
  660    HD3  ARG  82           HD3      ARG  82  -0.688  26.019   1.182
  661    HE   ARG  82           HE       ARG  82   1.981  24.929   1.275
  662   HH11  ARG  82          HH11      ARG  82   0.270  27.909   0.373
  663   HH12  ARG  82          HH12      ARG  82   1.606  28.953   0.699
  664   HH21  ARG  82          HH21      ARG  82   3.786  26.335   1.718
  665   HH22  ARG  82          HH22      ARG  82   3.637  28.034   1.478
  666    H    LEU  83           H        LEU  83   0.517  20.808   0.408
  667    HA   LEU  83           HA       LEU  83  -2.196  19.693   0.020
  668    HB2  LEU  83           HB2      LEU  83  -1.116  21.112  -1.773
  669    HB3  LEU  83           HB3      LEU  83   0.061  19.809  -1.991
  670    HG   LEU  83           HG       LEU  83  -1.703  18.272  -2.719
  671   HD11  LEU  83          HD11      LEU  83  -3.644  18.956  -1.405
  672   HD12  LEU  83          HD12      LEU  83  -3.621  20.577  -2.136
  673   HD13  LEU  83          HD13      LEU  83  -4.042  19.152  -3.110
  674   HD21  LEU  83          HD21      LEU  83  -0.657  19.852  -4.355
  675   HD22  LEU  83          HD22      LEU  83  -2.303  19.381  -4.805
  676   HD23  LEU  83          HD23      LEU  83  -1.998  20.977  -4.083
  677    H    VAL  84           H        VAL  84   1.106  18.754   0.764
  678    HA   VAL  84           HA       VAL  84   1.095  15.996   0.373
  679    HB   VAL  84           HB       VAL  84   2.039  17.613   2.774
  680   HG11  VAL  84          HG11      VAL  84   3.403  15.714   3.493
  681   HG12  VAL  84          HG12      VAL  84   1.704  15.271   3.570
  682   HG13  VAL  84          HG13      VAL  84   2.704  14.688   2.234
  683   HG21  VAL  84          HG21      VAL  84   3.235  18.002   0.608
  684   HG22  VAL  84          HG22      VAL  84   4.276  17.271   1.834
  685   HG23  VAL  84          HG23      VAL  84   3.604  16.282   0.527
  686    H    ARG  85           H        ARG  85   0.127  14.285   1.332
  687    HA   ARG  85           HA       ARG  85  -2.573  14.895   2.129
  688    HB2  ARG  85           HB2      ARG  85  -1.321  12.111   2.087
  689    HB3  ARG  85           HB3      ARG  85  -3.028  12.521   1.978
  690    HG2  ARG  85           HG2      ARG  85  -0.874  12.873  -0.129
  691    HG3  ARG  85           HG3      ARG  85  -2.329  11.895  -0.203
  692    HD2  ARG  85           HD2      ARG  85  -2.131  14.922  -0.326
  693    HD3  ARG  85           HD3      ARG  85  -2.571  13.833  -1.635
  694    HE   ARG  85           HE       ARG  85  -4.563  13.178  -0.238
  695   HH11  ARG  85          HH11      ARG  85  -3.199  16.488  -0.063
  696   HH12  ARG  85          HH12      ARG  85  -4.702  17.198   0.427
  697   HH21  ARG  85          HH21      ARG  85  -6.534  14.163   0.391
  698   HH22  ARG  85          HH22      ARG  85  -6.631  15.864   0.651
  699    H    TRP  86           H        TRP  86   0.082  13.515   3.970
  700    HA   TRP  86           HA       TRP  86   0.395  12.869   6.086
  701    HB2  TRP  86           HB2      TRP  86  -1.642  14.933   6.848
  702    HB3  TRP  86           HB3      TRP  86  -0.386  14.248   7.879
  703    HD1  TRP  86           HD1      TRP  86  -0.938  16.724   5.107
  704    HE1  TRP  86           HE1      TRP  86   1.125  18.167   4.708
  705    HE3  TRP  86           HE3      TRP  86   2.322  14.289   8.207
  706    HZ2  TRP  86           HZ2      TRP  86   3.881  18.265   5.633
  707    HZ3  TRP  86           HZ3      TRP  86   4.673  15.066   8.403
  708    HH2  TRP  86           HH2      TRP  86   5.462  17.042   7.128
  709    H    ASP  87           H        ASP  87  -2.208  11.912   4.580
  710    HA   ASP  87           HA       ASP  87  -3.553  10.595   6.912
  711    HB2  ASP  87           HB2      ASP  87  -4.838  12.299   5.693
  712    HB3  ASP  87           HB3      ASP  87  -4.611  11.409   4.186
  713    H    THR  88           H        THR  88  -1.690   9.867   4.034
  714    HA   THR  88           HA       THR  88  -3.129   7.516   3.286
  715    HB   THR  88           HB       THR  88  -0.922   7.259   1.905
  716    HG1  THR  88           HG1      THR  88   0.514   8.530   2.767
  717   HG21  THR  88          HG21      THR  88  -3.025   8.229   0.973
  718   HG22  THR  88          HG22      THR  88  -2.583   9.807   1.662
  719   HG23  THR  88          HG23      THR  88  -1.587   9.078   0.381
  720    H    LYS  89           H        LYS  89  -0.297   8.089   5.277
  721    HA   LYS  89           HA       LYS  89   1.089   6.832   6.570
  722    HB2  LYS  89           HB2      LYS  89  -1.439   5.269   7.098
  723    HB3  LYS  89           HB3      LYS  89   0.068   5.164   8.021
  724    HG2  LYS  89           HG2      LYS  89  -0.098   7.675   8.422
  725    HG3  LYS  89           HG3      LYS  89  -1.715   7.618   7.694
  726    HD2  LYS  89           HD2      LYS  89  -2.392   5.935   9.412
  727    HD3  LYS  89           HD3      LYS  89  -0.773   6.080  10.145
  728    HE2  LYS  89           HE2      LYS  89  -1.180   8.503  10.539
  729    HE3  LYS  89           HE3      LYS  89  -2.785   8.361   9.811
  730    HZ1  LYS  89           HZ1      LYS  89  -1.908   6.969  12.284
  731    HZ2  LYS  89           HZ2      LYS  89  -2.901   8.264  12.220
  732    HZ3  LYS  89           HZ3      LYS  89  -3.394   6.835  11.609
  733    HA   PRO  90           HA       PRO  90   3.237   6.414   6.143
  734    HB2  PRO  90           HB2      PRO  90   4.993   6.560   4.025
  735    HB3  PRO  90           HB3      PRO  90   4.999   5.248   5.243
  736    HG2  PRO  90           HG2      PRO  90   3.651   5.255   2.528
  737    HG3  PRO  90           HG3      PRO  90   4.741   4.001   3.210
  738    HD2  PRO  90           HD2      PRO  90   2.059   3.716   3.339
  739    HD3  PRO  90           HD3      PRO  90   3.069   3.273   4.745
  740    H    VAL  91           H        VAL  91   3.538   8.663   5.778
  741    HA   VAL  91           HA       VAL  91   1.367   9.908   4.438
  742    HB   VAL  91           HB       VAL  91   2.293  12.009   5.102
  743   HG11  VAL  91          HG11      VAL  91   2.567  10.027   7.391
  744   HG12  VAL  91          HG12      VAL  91   2.125  11.744   7.486
  745   HG13  VAL  91          HG13      VAL  91   1.020  10.590   6.715
  746   HG21  VAL  91          HG21      VAL  91   4.701  11.742   4.819
  747   HG22  VAL  91          HG22      VAL  91   4.300  12.295   6.440
  748   HG23  VAL  91          HG23      VAL  91   4.753  10.589   6.178
  749    H    CYS  92           H        CYS  92   1.157  10.693   2.495
  750    HA   CYS  92           HA       CYS  92   3.203   9.906   0.545
  751    HB2  CYS  92           HB2      CYS  92   0.903   9.164   0.352
  752    HB3  CYS  92           HB3      CYS  92   0.318  10.845   0.304
  753    HG   CYS  92           HG       CYS  92   0.180  10.029  -2.105
  754    H    ILE  93           H        ILE  93   4.691  11.322  -0.011
  755    HA   ILE  93           HA       ILE  93   4.190  14.220   0.335
  756    HB   ILE  93           HB       ILE  93   6.655  14.446   0.249
  757   HG12  ILE  93          HG12      ILE  93   8.038  12.411   0.745
  758   HG13  ILE  93          HG13      ILE  93   6.677  11.396   0.273
  759   HG21  ILE  93          HG21      ILE  93   5.642  12.521   2.384
  760   HG22  ILE  93          HG22      ILE  93   7.012  13.636   2.513
  761   HG23  ILE  93          HG23      ILE  93   5.376  14.281   2.366
  762   HD11  ILE  93          HD11      ILE  93   8.503  11.734  -1.444
  763   HD12  ILE  93          HD12      ILE  93   6.873  12.067  -2.024
  764   HD13  ILE  93          HD13      ILE  93   7.970  13.412  -1.607
  765    H    GLY  94           H        GLY  94   4.054  11.948  -2.212
  766    HA2  GLY  94           HA2      GLY  94   4.064  14.151  -4.154
  767    HA3  GLY  94           HA3      GLY  94   5.451  13.064  -4.231
  768    H    GLN  95           H        GLN  95   4.069  13.293  -6.443
  769    HA   GLN  95           HA       GLN  95   2.381  10.822  -6.669
  770    HB2  GLN  95           HB2      GLN  95   2.422  13.454  -8.194
  771    HB3  GLN  95           HB3      GLN  95   2.061  11.977  -9.061
  772    HG2  GLN  95           HG2      GLN  95  -0.028  12.884  -8.488
  773    HG3  GLN  95           HG3      GLN  95   0.198  11.463  -7.480
  774   HE21  GLN  95          HE22      GLN  95  -1.632  12.558  -6.237
  775   HE22  GLN  95          HE21      GLN  95  -1.180  13.739  -5.029
  776    H    LYS  96           H        LYS  96   3.334   9.131  -7.719
  777    HA   LYS  96           HA       LYS  96   5.893   9.588  -9.225
  778    HB2  LYS  96           HB2      LYS  96   6.205   7.812  -7.649
  779    HB3  LYS  96           HB3      LYS  96   4.608   7.146  -7.918
  780    HG2  LYS  96           HG2      LYS  96   5.318   6.419 -10.231
  781    HG3  LYS  96           HG3      LYS  96   6.941   7.066  -9.894
  782    HD2  LYS  96           HD2      LYS  96   7.117   5.513  -7.963
  783    HD3  LYS  96           HD3      LYS  96   5.515   4.857  -8.342
  784    HE2  LYS  96           HE2      LYS  96   6.377   4.106 -10.585
  785    HE3  LYS  96           HE3      LYS  96   7.972   4.735 -10.150
  786    HZ1  LYS  96           HZ1      LYS  96   8.019   2.445  -9.629
  787    HZ2  LYS  96           HZ2      LYS  96   7.828   3.152  -8.147
  788    HZ3  LYS  96           HZ3      LYS  96   6.560   2.446  -8.902
  789    H    GLN  97           H        GLN  97   5.433  10.003 -11.374
  790    HA   GLN  97           HA       GLN  97   2.870   8.962 -12.502
  791    HB2  GLN  97           HB2      GLN  97   2.560  11.344 -13.391
  792    HB3  GLN  97           HB3      GLN  97   2.183  11.026 -11.701
  793    HG2  GLN  97           HG2      GLN  97   4.280  12.049 -10.948
  794    HG3  GLN  97           HG3      GLN  97   4.834  12.202 -12.610
  795   HE21  GLN  97          HE22      GLN  97   5.220  14.415 -12.260
  796   HE22  GLN  97          HE21      GLN  97   3.880  15.553 -12.330
  797    H    LYS  98           H        LYS  98   3.507   7.746 -14.202
  798    HA   LYS  98           HA       LYS  98   5.578   8.881 -16.056
  799    HB2  LYS  98           HB2      LYS  98   5.966   6.544 -15.569
  800    HB3  LYS  98           HB3      LYS  98   4.291   6.121 -15.942
  801    HG2  LYS  98           HG2      LYS  98   4.617   6.737 -18.294
  802    HG3  LYS  98           HG3      LYS  98   6.270   7.265 -17.966
  803    HD2  LYS  98           HD2      LYS  98   5.277   4.421 -17.510
  804    HD3  LYS  98           HD3      LYS  98   6.001   4.986 -19.024
  805    HE2  LYS  98           HE2      LYS  98   8.067   5.665 -17.758
  806    HE3  LYS  98           HE3      LYS  98   7.382   4.954 -16.289
  807    HZ1  LYS  98           HZ1      LYS  98   8.007   3.463 -18.791
  808    HZ2  LYS  98           HZ2      LYS  98   8.871   3.405 -17.412
  809    HZ3  LYS  98           HZ3      LYS  98   7.362   2.791 -17.435
  810    H    TRP  99           H        TRP  99   4.786   9.893 -17.887
  811    HA   TRP  99           HA       TRP  99   1.817  10.125 -18.043
  812    HB2  TRP  99           HB2      TRP  99   4.079  11.840 -19.103
  813    HB3  TRP  99           HB3      TRP  99   2.376  12.107 -19.440
  814    HD1  TRP  99           HD1      TRP  99   4.828  12.183 -16.422
  815    HE1  TRP  99           HE1      TRP  99   3.892  13.806 -14.674
  816    HE3  TRP  99           HE3      TRP  99   0.267  13.053 -18.505
  817    HZ2  TRP  99           HZ2      TRP  99   1.401  15.265 -14.215
  818    HZ3  TRP  99           HZ3      TRP  99  -1.329  14.622 -17.468
  819    HH2  TRP  99           HH2      TRP  99  -0.843  15.606 -15.238
  820    H    PHE 100           H        PHE 100   0.725   9.363 -19.852
  821    HA   PHE 100           HA       PHE 100   2.381   8.100 -22.011
  822    HB2  PHE 100           HB2      PHE 100  -0.233   7.196 -20.775
  823    HB3  PHE 100           HB3      PHE 100   0.251   6.726 -22.395
  824    HD1  PHE 100           HD2      PHE 100   1.394   6.562 -18.830
  825    HD2  PHE 100           HD1      PHE 100   1.744   4.964 -22.823
  826    HE1  PHE 100           HE2      PHE 100   2.760   4.686 -17.967
  827    HE2  PHE 100           HE1      PHE 100   3.110   3.094 -21.957
  828    HZ   PHE 100           HZ       PHE 100   3.630   2.941 -19.536
  829    H    LEU 101           H        LEU 101   2.119   8.877 -23.965
  830    HA   LEU 101           HA       LEU 101   0.212  11.064 -24.447
  831    HB2  LEU 101           HB2      LEU 101   2.619  11.314 -25.085
  832    HB3  LEU 101           HB3      LEU 101   2.456   9.908 -26.138
  833    HG   LEU 101           HG       LEU 101   0.649  11.142 -27.414
  834   HD11  LEU 101          HD11      LEU 101   0.678  13.639 -27.156
  835   HD12  LEU 101          HD12      LEU 101  -0.060  12.790 -25.802
  836   HD13  LEU 101          HD13      LEU 101   1.584  13.445 -25.651
  837   HD21  LEU 101          HD21      LEU 101   2.907  10.963 -28.293
  838   HD22  LEU 101          HD22      LEU 101   2.256  12.565 -28.657
  839   HD23  LEU 101          HD23      LEU 101   3.437  12.361 -27.340
  840    H    LEU 102           H        LEU 102  -1.754  10.370 -24.992
  841    HA   LEU 102           HA       LEU 102  -2.030   7.959 -26.692
  842    HB2  LEU 102           HB2      LEU 102  -3.794   9.306 -24.617
  843    HB3  LEU 102           HB3      LEU 102  -4.520   8.330 -25.882
  844    HG   LEU 102           HG       LEU 102  -4.343   6.933 -24.028
  845   HD11  LEU 102          HD11      LEU 102  -3.228   5.088 -24.943
  846   HD12  LEU 102          HD12      LEU 102  -3.365   6.144 -26.392
  847   HD13  LEU 102          HD13      LEU 102  -1.855   6.066 -25.491
  848   HD21  LEU 102          HD21      LEU 102  -2.301   6.496 -22.767
  849   HD22  LEU 102          HD22      LEU 102  -1.393   7.631 -23.778
  850   HD23  LEU 102          HD23      LEU 102  -2.686   8.221 -22.712
  851    H    GLN 103           H        GLN 103  -2.588   8.149 -28.677
  852    HA   GLN 103           HA       GLN 103  -3.703  10.725 -29.680
  853    HB2  GLN 103           HB2      GLN 103  -2.508   8.239 -30.890
  854    HB3  GLN 103           HB3      GLN 103  -3.699   9.111 -31.845
  855    HG2  GLN 103           HG2      GLN 103  -1.190   9.715 -32.147
  856    HG3  GLN 103           HG3      GLN 103  -2.390  10.998 -32.089
  857   HE21  GLN 103          HE22      GLN 103  -1.639  12.779 -30.951
  858   HE22  GLN 103          HE21      GLN 103  -0.506  12.633 -29.599
  859    H    LEU 104           H        LEU 104  -5.868  10.989 -29.917
  860    HA   LEU 104           HA       LEU 104  -7.626   9.020 -28.798
  861    HB2  LEU 104           HB2      LEU 104  -7.910  11.524 -28.831
  862    HB3  LEU 104           HB3      LEU 104  -8.280  11.425 -30.555
  863    HG   LEU 104           HG       LEU 104 -10.320  10.122 -30.047
  864   HD11  LEU 104          HD11      LEU 104 -11.114   9.948 -27.678
  865   HD12  LEU 104          HD12      LEU 104  -9.727   8.921 -27.981
  866   HD13  LEU 104          HD13      LEU 104  -9.513  10.465 -27.109
  867   HD21  LEU 104          HD21      LEU 104 -11.503  11.999 -28.833
  868   HD22  LEU 104          HD22      LEU 104  -9.934  12.721 -28.468
  869   HD23  LEU 104          HD23      LEU 104 -10.457  12.538 -30.166
  870    H    VAL 105           H        VAL 105  -8.788   7.372 -29.767
  871    HA   VAL 105           HA       VAL 105  -8.834   7.245 -32.753
  872    HB   VAL 105           HB       VAL 105  -8.954   4.973 -30.743
  873   HG11  VAL 105          HG11      VAL 105  -8.921   4.879 -33.774
  874   HG12  VAL 105          HG12      VAL 105  -8.743   3.480 -32.691
  875   HG13  VAL 105          HG13      VAL 105 -10.253   4.390 -32.701
  876   HG21  VAL 105          HG21      VAL 105  -6.624   5.954 -30.979
  877   HG22  VAL 105          HG22      VAL 105  -6.772   4.282 -31.522
  878   HG23  VAL 105          HG23      VAL 105  -6.717   5.590 -32.713
  879    H    SER 106           H        SER 106 -10.661   7.204 -29.671
  880    HA   SER 106           HA       SER 106 -13.211   6.861 -31.048
  881    HB2  SER 106           HB2      SER 106 -14.053   6.866 -28.779
  882    HB3  SER 106           HB3      SER 106 -12.668   5.778 -28.933
  883    HG   SER 106           HG       SER 106 -12.534   7.197 -27.057
  884    H    GLY 107           H        GLY 107 -13.828   9.054 -28.626
  885    HA2  GLY 107           HA2      GLY 107 -13.391  11.598 -29.771
  886    HA3  GLY 107           HA3      GLY 107 -14.919  10.969 -30.389
  887    H    ASP 108           H        ASP 108 -14.824  13.242 -28.686
  888    HA   ASP 108           HA       ASP 108 -15.379  12.938 -26.004
  889    HB2  ASP 108           HB2      ASP 108 -15.305  15.074 -27.120
  890    HB3  ASP 108           HB3      ASP 108 -16.737  14.675 -28.071
  891    H    ALA 109           H        ALA 109 -17.480  12.012 -28.736
  892    HA   ALA 109           HA       ALA 109 -19.888  11.669 -27.230
  893    HB1  ALA 109           HB1      ALA 109 -19.842  11.929 -29.681
  894    HB2  ALA 109           HB2      ALA 109 -19.000  10.361 -29.842
  895    HB3  ALA 109           HB3      ALA 109 -20.654  10.426 -29.211
  896    H    GLU 110           H        GLU 110 -17.044   9.605 -27.624
  897    HA   GLU 110           HA       GLU 110 -18.445   7.229 -26.596
  898    HB2  GLU 110           HB2      GLU 110 -15.631   7.612 -27.647
  899    HB3  GLU 110           HB3      GLU 110 -16.337   6.068 -27.170
  900    HG2  GLU 110           HG2      GLU 110 -17.158   7.815 -29.527
  901    HG3  GLU 110           HG3      GLU 110 -16.353   6.258 -29.602
  902    H    ILE 111           H        ILE 111 -16.033   9.647 -25.808
  903    HA   ILE 111           HA       ILE 111 -14.974   8.650 -23.365
  904    HB   ILE 111           HB       ILE 111 -15.425  11.291 -24.698
  905   HG12  ILE 111          HG12      ILE 111 -12.975   9.769 -23.904
  906   HG13  ILE 111          HG13      ILE 111 -13.627   9.974 -25.521
  907   HG21  ILE 111          HG21      ILE 111 -15.808  11.836 -22.317
  908   HG22  ILE 111          HG22      ILE 111 -14.226  11.119 -21.911
  909   HG23  ILE 111          HG23      ILE 111 -14.349  12.567 -22.938
  910   HD11  ILE 111          HD11      ILE 111 -13.150  12.420 -25.378
  911   HD12  ILE 111          HD12      ILE 111 -12.316  12.140 -23.825
  912   HD13  ILE 111          HD13      ILE 111 -11.708  11.396 -25.305
  913    H    ASN 112           H        ASN 112 -15.692   8.835 -21.286
  914    HA   ASN 112           HA       ASN 112 -18.575   9.584 -20.869
  915    HB2  ASN 112           HB2      ASN 112 -18.438   7.165 -20.959
  916    HB3  ASN 112           HB3      ASN 112 -17.105   7.137 -19.810
  917   HD21  ASN 112          HD22      ASN 112 -19.088   5.519 -19.047
  918   HD22  ASN 112          HD21      ASN 112 -20.029   6.261 -17.771
  919    H    MET 113           H        MET 113 -15.416   8.991 -19.287
  920    HA   MET 113           HA       MET 113 -14.394   9.786 -17.508
  921    HB2  MET 113           HB2      MET 113 -16.083  12.293 -17.493
  922    HB3  MET 113           HB3      MET 113 -14.457  12.036 -16.881
  923    HG2  MET 113           HG2      MET 113 -13.731  11.617 -19.275
  924    HG3  MET 113           HG3      MET 113 -15.332  12.168 -19.777
  925    HE1  MET 113           HE1      MET 113 -13.116  15.207 -20.821
  926    HE2  MET 113           HE2      MET 113 -12.931  13.453 -21.048
  927    HE3  MET 113           HE3      MET 113 -14.524  14.226 -21.284
  928    H    GLN 114           H        GLN 114 -17.904   9.338 -17.153
  929    HA   GLN 114           HA       GLN 114 -17.581   9.495 -14.215
  930    HB2  GLN 114           HB2      GLN 114 -20.096   9.366 -15.908
  931    HB3  GLN 114           HB3      GLN 114 -20.047   9.425 -14.142
  932    HG2  GLN 114           HG2      GLN 114 -18.838  11.624 -14.280
  933    HG3  GLN 114           HG3      GLN 114 -19.058  11.594 -16.034
  934   HE21  GLN 114          HE22      GLN 114 -20.860  11.618 -12.896
  935   HE22  GLN 114          HE21      GLN 114 -22.318  12.318 -13.555
  936    H    THR 115           H        THR 115 -16.408   7.407 -15.813
  937    HA   THR 115           HA       THR 115 -17.816   4.958 -15.642
  938    HB   THR 115           HB       THR 115 -15.026   4.486 -15.801
  939    HG1  THR 115           HG1      THR 115 -14.111   6.241 -16.524
  940   HG21  THR 115          HG21      THR 115 -16.866   3.635 -17.332
  941   HG22  THR 115          HG22      THR 115 -16.865   5.238 -18.112
  942   HG23  THR 115          HG23      THR 115 -15.423   4.201 -18.187
  943    H    SER 116           H        SER 116 -15.464   6.603 -13.509
  944    HA   SER 116           HA       SER 116 -14.943   4.343 -11.909
  945    HB2  SER 116           HB2      SER 116 -14.298   7.007 -10.819
  946    HB3  SER 116           HB3      SER 116 -13.228   5.638 -11.190
  947    HG   SER 116           HG       SER 116 -12.887   7.539 -12.541
  948    H    SER 117           H        SER 117 -17.731   6.136 -11.852
  949    HA   SER 117           HA       SER 117 -19.438   6.539 -10.505
  950    HB2  SER 117           HB2      SER 117 -18.215   4.659  -8.468
  951    HB3  SER 117           HB3      SER 117 -19.895   5.195  -8.561
  952    HG   SER 117           HG       SER 117 -19.601   3.121  -9.523
  953    H    THR 118           H        THR 118 -16.333   6.807  -8.753
  954    HA   THR 118           HA       THR 118 -17.154   9.530  -7.872
  955    HB   THR 118           HB       THR 118 -15.509   9.109  -5.956
  956    HG1  THR 118           HG1      THR 118 -14.574   7.157  -6.572
  957   HG21  THR 118          HG21      THR 118 -17.218   8.051  -4.555
  958   HG22  THR 118          HG22      THR 118 -17.969   9.215  -5.658
  959   HG23  THR 118          HG23      THR 118 -18.087   7.472  -5.994
  960    HA   PRO 119           HA       PRO 119 -13.644   9.258 -10.956
  961    HB2  PRO 119           HB2      PRO 119 -14.601  10.843 -12.925
  962    HB3  PRO 119           HB3      PRO 119 -15.317   9.231 -12.634
  963    HG2  PRO 119           HG2      PRO 119 -16.295  11.900 -11.517
  964    HG3  PRO 119           HG3      PRO 119 -17.232  10.742 -12.505
  965    HD2  PRO 119           HD2      PRO 119 -17.344  10.635  -9.814
  966    HD3  PRO 119           HD3      PRO 119 -17.261   9.133 -10.778
  967    H    GLU 120           H        GLU 120 -12.530  11.321 -12.165
  968    HA   GLU 120           HA       GLU 120 -12.515  13.621 -10.240
  969    HB2  GLU 120           HB2      GLU 120 -10.315  12.560 -12.044
  970    HB3  GLU 120           HB3      GLU 120 -10.307  14.183 -11.361
  971    HG2  GLU 120           HG2      GLU 120 -10.944  12.593  -9.140
  972    HG3  GLU 120           HG3      GLU 120  -9.780  11.605 -10.015
  973    H    PHE 121           H        PHE 121 -13.536  12.779 -13.501
  974    HA   PHE 121           HA       PHE 121 -13.530  15.706 -14.102
  975    HB2  PHE 121           HB2      PHE 121 -12.805  13.426 -15.954
  976    HB3  PHE 121           HB3      PHE 121 -12.995  15.111 -16.418
  977    HD1  PHE 121           HD2      PHE 121 -11.544  16.880 -15.140
  978    HD2  PHE 121           HD1      PHE 121 -10.665  12.663 -15.215
  979    HE1  PHE 121           HE2      PHE 121  -9.169  17.368 -14.639
  980    HE2  PHE 121           HE1      PHE 121  -8.300  13.153 -14.635
  981    HZ   PHE 121           HZ       PHE 121  -7.544  15.501 -14.361
  982    H    ASP 122           H        ASP 122 -15.198  16.552 -15.264
  983    HA   ASP 122           HA       ASP 122 -17.636  14.828 -15.466
  984    HB2  ASP 122           HB2      ASP 122 -17.848  16.724 -13.968
  985    HB3  ASP 122           HB3      ASP 122 -17.358  17.837 -15.253
  986    H    GLY 123           H        GLY 123 -15.926  17.482 -17.256
  987    HA2  GLY 123           HA2      GLY 123 -15.517  16.338 -19.643
  988    HA3  GLY 123           HA3      GLY 123 -17.241  16.713 -19.774
  989    H    TRP 124           H        TRP 124 -15.114  17.807 -21.384
  990    HA   TRP 124           HA       TRP 124 -15.979  20.518 -21.325
  991    HB2  TRP 124           HB2      TRP 124 -14.193  20.762 -19.656
  992    HB3  TRP 124           HB3      TRP 124 -13.044  20.024 -20.768
  993    HD1  TRP 124           HD1      TRP 124 -11.427  21.800 -21.449
  994    HE1  TRP 124           HE1      TRP 124 -11.504  24.180 -22.351
  995    HE3  TRP 124           HE3      TRP 124 -16.478  22.661 -21.039
  996    HZ2  TRP 124           HZ2      TRP 124 -13.518  26.178 -22.950
  997    HZ3  TRP 124           HZ3      TRP 124 -17.437  24.801 -21.814
  998    HH2  TRP 124           HH2      TRP 124 -15.975  26.568 -22.776
  999    H    ARG 125           H        ARG 125 -13.127  20.741 -22.865
 1000    HA   ARG 125           HA       ARG 125 -13.783  19.565 -25.469
 1001    HB2  ARG 125           HB2      ARG 125 -15.177  21.351 -25.807
 1002    HB3  ARG 125           HB3      ARG 125 -14.443  22.358 -24.587
 1003    HG2  ARG 125           HG2      ARG 125 -13.036  21.944 -27.238
 1004    HG3  ARG 125           HG3      ARG 125 -14.367  23.082 -27.062
 1005    HD2  ARG 125           HD2      ARG 125 -13.212  24.335 -25.320
 1006    HD3  ARG 125           HD3      ARG 125 -11.909  23.168 -25.272
 1007    HE   ARG 125           HE       ARG 125 -11.073  23.853 -27.317
 1008   HH11  ARG 125          HH11      ARG 125 -13.933  25.820 -26.481
 1009   HH12  ARG 125          HH12      ARG 125 -13.587  27.061 -27.629
 1010   HH21  ARG 125          HH21      ARG 125 -10.623  25.515 -28.846
 1011   HH22  ARG 125          HH22      ARG 125 -11.660  26.888 -28.996
 1012    H    TRP 126           H        TRP 126 -11.855  19.875 -26.955
 1013    HA   TRP 126           HA       TRP 126  -9.465  19.711 -25.332
 1014    HB2  TRP 126           HB2      TRP 126  -9.572  19.636 -28.346
 1015    HB3  TRP 126           HB3      TRP 126  -8.418  18.857 -27.259
 1016    HD1  TRP 126           HD1      TRP 126 -11.060  17.905 -29.427
 1017    HE1  TRP 126           HE1      TRP 126 -12.503  15.952 -28.663
 1018    HE3  TRP 126           HE3      TRP 126  -9.575  17.671 -24.521
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.102  14.584 -26.192
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.730  16.148 -22.948
 1021    HH2  TRP 126           HH2      TRP 126 -12.519  14.629 -23.760
 1022    H    VAL 127           H        VAL 127  -7.615  21.035 -25.376
 1023    HA   VAL 127           HA       VAL 127  -8.173  23.842 -26.256
 1024    HB   VAL 127           HB       VAL 127  -6.982  24.509 -24.190
 1025   HG11  VAL 127          HG11      VAL 127  -9.460  24.392 -24.281
 1026   HG12  VAL 127          HG12      VAL 127  -9.394  22.744 -23.613
 1027   HG13  VAL 127          HG13      VAL 127  -8.808  24.116 -22.657
 1028   HG21  VAL 127          HG21      VAL 127  -6.646  22.887 -22.366
 1029   HG22  VAL 127          HG22      VAL 127  -7.151  21.557 -23.410
 1030   HG23  VAL 127          HG23      VAL 127  -5.664  22.454 -23.775
 1031    H    SER 128           H        SER 128  -6.184  25.221 -26.467
 1032    HA   SER 128           HA       SER 128  -4.352  24.233 -28.290
 1033    HB2  SER 128           HB2      SER 128  -3.795  26.446 -26.273
 1034    HB3  SER 128           HB3      SER 128  -3.084  26.249 -27.884
 1035    HG   SER 128           HG       SER 128  -4.813  27.781 -27.898
 1036    H    TYR 129           H        TYR 129  -2.150  23.575 -28.148
 1037    HA   TYR 129           HA       TYR 129  -1.817  21.484 -26.399
 1038    HB2  TYR 129           HB2      TYR 129  -0.727  21.817 -28.591
 1039    HB3  TYR 129           HB3      TYR 129   0.352  23.023 -27.880
 1040    HD1  TYR 129           HD1      TYR 129  -0.531  19.412 -28.036
 1041    HD2  TYR 129           HD2      TYR 129   2.209  22.354 -26.482
 1042    HE1  TYR 129           HE1      TYR 129   0.963  17.605 -27.209
 1043    HE2  TYR 129           HE2      TYR 129   3.765  20.563 -25.793
 1044    HH   TYR 129           HH       TYR 129   4.081  18.272 -25.614
 1045    H    TRP 130           H        TRP 130  -0.456  24.782 -25.950
 1046    HA   TRP 130           HA       TRP 130   0.820  23.911 -23.452
 1047    HB2  TRP 130           HB2      TRP 130   0.857  26.639 -24.762
 1048    HB3  TRP 130           HB3      TRP 130   1.913  26.059 -23.480
 1049    HD1  TRP 130           HD1      TRP 130   1.506  26.071 -27.212
 1050    HE1  TRP 130           HE1      TRP 130   3.366  24.813 -28.374
 1051    HE3  TRP 130           HE3      TRP 130   3.728  24.008 -23.093
 1052    HZ2  TRP 130           HZ2      TRP 130   5.645  23.121 -27.597
 1053    HZ3  TRP 130           HZ3      TRP 130   5.741  22.579 -23.327
 1054    HH2  TRP 130           HH2      TRP 130   6.682  22.092 -25.565
 1055    H    TYR 131           H        TYR 131  -2.335  24.666 -24.016
 1056    HA   TYR 131           HA       TYR 131  -2.751  26.853 -22.209
 1057    HB2  TYR 131           HB2      TYR 131  -4.290  26.297 -24.002
 1058    HB3  TYR 131           HB3      TYR 131  -4.704  24.780 -23.256
 1059    HD1  TYR 131           HD1      TYR 131  -6.084  24.696 -21.174
 1060    HD2  TYR 131           HD2      TYR 131  -5.203  28.404 -23.195
 1061    HE1  TYR 131           HE1      TYR 131  -8.033  25.761 -20.074
 1062    HE2  TYR 131           HE2      TYR 131  -7.102  29.489 -22.053
 1063    HH   TYR 131           HH       TYR 131  -8.904  29.218 -20.579
 1064    HA   PRO 132           HA       PRO 132  -3.937  23.652 -18.916
 1065    HB2  PRO 132           HB2      PRO 132  -2.285  21.231 -19.577
 1066    HB3  PRO 132           HB3      PRO 132  -3.895  21.330 -18.853
 1067    HG2  PRO 132           HG2      PRO 132  -3.631  20.643 -21.439
 1068    HG3  PRO 132           HG3      PRO 132  -4.925  21.783 -20.945
 1069    HD2  PRO 132           HD2      PRO 132  -2.212  22.462 -22.136
 1070    HD3  PRO 132           HD3      PRO 132  -3.817  23.064 -22.590
 1071    H    VAL 133           H        VAL 133  -0.556  23.598 -20.217
 1072    HA   VAL 133           HA       VAL 133   0.557  23.399 -17.548
 1073    HB   VAL 133           HB       VAL 133   1.879  22.634 -19.363
 1074   HG11  VAL 133          HG11      VAL 133   1.975  25.506 -20.410
 1075   HG12  VAL 133          HG12      VAL 133   3.011  24.171 -20.954
 1076   HG13  VAL 133          HG13      VAL 133   1.274  24.088 -21.219
 1077   HG21  VAL 133          HG21      VAL 133   3.983  23.587 -18.789
 1078   HG22  VAL 133          HG22      VAL 133   3.254  25.115 -18.286
 1079   HG23  VAL 133          HG23      VAL 133   2.962  23.643 -17.339
 1080    H    ARG 134           H        ARG 134  -0.556  26.146 -19.569
 1081    HA   ARG 134           HA       ARG 134   0.522  28.111 -17.677
 1082    HB2  ARG 134           HB2      ARG 134  -1.731  28.261 -19.735
 1083    HB3  ARG 134           HB3      ARG 134  -1.148  29.633 -18.805
 1084    HG2  ARG 134           HG2      ARG 134   0.587  28.030 -20.756
 1085    HG3  ARG 134           HG3      ARG 134  -0.289  29.500 -21.139
 1086    HD2  ARG 134           HD2      ARG 134   1.778  30.351 -20.737
 1087    HD3  ARG 134           HD3      ARG 134   1.016  30.580 -19.154
 1088    HE   ARG 134           HE       ARG 134   2.365  28.059 -19.160
 1089   HH11  ARG 134          HH11      ARG 134   3.127  31.532 -19.253
 1090   HH12  ARG 134          HH12      ARG 134   4.755  31.342 -18.718
 1091   HH21  ARG 134          HH21      ARG 134   4.606  27.797 -18.531
 1092   HH22  ARG 134          HH22      ARG 134   5.582  29.185 -18.248
 1093    H    GLN 135           H        GLN 135  -2.601  26.367 -18.066
 1094    HA   GLN 135           HA       GLN 135  -3.774  27.969 -15.957
 1095    HB2  GLN 135           HB2      GLN 135  -4.840  25.598 -17.531
 1096    HB3  GLN 135           HB3      GLN 135  -5.788  26.542 -16.377
 1097    HG2  GLN 135           HG2      GLN 135  -4.555  27.599 -18.961
 1098    HG3  GLN 135           HG3      GLN 135  -6.243  27.262 -18.637
 1099   HE21  GLN 135          HE22      GLN 135  -7.418  28.657 -17.052
 1100   HE22  GLN 135          HE21      GLN 135  -6.823  30.272 -16.751
 1101    H    VAL 136           H        VAL 136  -2.084  24.893 -15.850
 1102    HA   VAL 136           HA       VAL 136  -3.326  23.941 -13.474
 1103    HB   VAL 136           HB       VAL 136  -1.889  22.666 -15.130
 1104   HG11  VAL 136          HG11      VAL 136   0.077  24.092 -15.202
 1105   HG12  VAL 136          HG12      VAL 136   0.390  23.799 -13.482
 1106   HG13  VAL 136          HG13      VAL 136   0.525  22.467 -14.636
 1107   HG21  VAL 136          HG21      VAL 136  -1.156  22.152 -12.240
 1108   HG22  VAL 136          HG22      VAL 136  -2.694  21.672 -13.010
 1109   HG23  VAL 136          HG23      VAL 136  -1.167  21.008 -13.596
 1110    H    VAL 137           H        VAL 137  -2.302  23.834 -11.307
 1111    HA   VAL 137           HA       VAL 137  -1.747  26.305 -10.138
 1112    HB   VAL 137           HB       VAL 137  -0.707  24.786  -8.285
 1113   HG11  VAL 137          HG11      VAL 137  -3.631  24.467  -9.140
 1114   HG12  VAL 137          HG12      VAL 137  -2.981  24.160  -7.515
 1115   HG13  VAL 137          HG13      VAL 137  -2.962  25.798  -8.176
 1116   HG21  VAL 137          HG21      VAL 137  -0.315  22.759  -9.668
 1117   HG22  VAL 137          HG22      VAL 137  -1.376  22.448  -8.290
 1118   HG23  VAL 137          HG23      VAL 137  -2.074  22.574  -9.901
 1119    H    SER 138           H        SER 138   0.051  27.402  -9.470
 1120    HA   SER 138           HA       SER 138   2.066  27.566 -11.298
 1121    HB2  SER 138           HB2      SER 138   2.029  28.552  -8.414
 1122    HB3  SER 138           HB3      SER 138   3.022  29.221  -9.722
 1123    HG   SER 138           HG       SER 138   0.896  30.286  -9.264
 1124    H    PHE 139           H        PHE 139   2.235  25.609  -8.262
 1125    HA   PHE 139           HA       PHE 139   5.084  25.268  -8.523
 1126    HB2  PHE 139           HB2      PHE 139   4.779  23.443  -6.897
 1127    HB3  PHE 139           HB3      PHE 139   4.123  24.980  -6.405
 1128    HD1  PHE 139           HD1      PHE 139   3.177  21.570  -7.599
 1129    HD2  PHE 139           HD2      PHE 139   1.809  25.256  -5.825
 1130    HE1  PHE 139           HE1      PHE 139   1.048  20.475  -7.000
 1131    HE2  PHE 139           HE2      PHE 139  -0.351  24.177  -5.281
 1132    HZ   PHE 139           HZ       PHE 139  -0.746  21.801  -5.874
 1133    H    LYS 140           H        LYS 140   2.261  23.313  -9.642
 1134    HA   LYS 140           HA       LYS 140   4.017  21.289 -10.740
 1135    HB2  LYS 140           HB2      LYS 140   1.770  20.829  -9.800
 1136    HB3  LYS 140           HB3      LYS 140   1.024  21.651 -11.179
 1137    HG2  LYS 140           HG2      LYS 140   1.713  20.001 -12.718
 1138    HG3  LYS 140           HG3      LYS 140   2.968  19.361 -11.649
 1139    HD2  LYS 140           HD2      LYS 140  -0.004  19.152 -10.999
 1140    HD3  LYS 140           HD3      LYS 140   0.866  17.927 -11.938
 1141    HE2  LYS 140           HE2      LYS 140   2.449  17.543 -10.105
 1142    HE3  LYS 140           HE3      LYS 140   1.724  18.826  -9.139
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.335  17.510  -9.033
 1144    HZ2  LYS 140           HZ2      LYS 140   0.335  16.309  -9.949
 1145    HZ3  LYS 140           HZ3      LYS 140   0.920  16.638  -8.450
 1146    H    ARG 141           H        ARG 141   2.476  24.153 -12.146
 1147    HA   ARG 141           HA       ARG 141   2.611  23.829 -14.850
 1148    HB2  ARG 141           HB2      ARG 141   2.016  25.898 -13.824
 1149    HB3  ARG 141           HB3      ARG 141   3.636  26.152 -13.171
 1150    HG2  ARG 141           HG2      ARG 141   4.544  26.796 -15.230
 1151    HG3  ARG 141           HG3      ARG 141   3.296  25.985 -16.165
 1152    HD2  ARG 141           HD2      ARG 141   2.943  28.374 -16.311
 1153    HD3  ARG 141           HD3      ARG 141   1.612  27.643 -15.434
 1154    HE   ARG 141           HE       ARG 141   3.892  29.164 -14.227
 1155   HH11  ARG 141          HH11      ARG 141   0.434  28.216 -14.058
 1156   HH12  ARG 141          HH12      ARG 141   0.125  29.194 -12.675
 1157   HH21  ARG 141          HH21      ARG 141   3.399  30.531 -12.464
 1158   HH22  ARG 141          HH22      ARG 141   1.837  30.463 -11.717
 1159    H    ASP 142           H        ASP 142   5.614  24.377 -12.921
 1160    HA   ASP 142           HA       ASP 142   7.304  24.465 -15.220
 1161    HB2  ASP 142           HB2      ASP 142   8.005  25.354 -13.056
 1162    HB3  ASP 142           HB3      ASP 142   7.975  23.735 -12.344
 1163    H    VAL 143           H        VAL 143   6.276  21.705 -13.168
 1164    HA   VAL 143           HA       VAL 143   8.049  19.902 -14.618
 1165    HB   VAL 143           HB       VAL 143   5.931  19.373 -12.519
 1166   HG11  VAL 143          HG11      VAL 143   6.097  17.366 -13.934
 1167   HG12  VAL 143          HG12      VAL 143   7.875  17.439 -13.844
 1168   HG13  VAL 143          HG13      VAL 143   6.923  17.074 -12.392
 1169   HG21  VAL 143          HG21      VAL 143   8.993  19.338 -12.457
 1170   HG22  VAL 143          HG22      VAL 143   7.948  20.520 -11.650
 1171   HG23  VAL 143          HG23      VAL 143   7.957  18.830 -11.117
 1172    H    TYR 144           H        TYR 144   4.595  20.850 -14.786
 1173    HA   TYR 144           HA       TYR 144   3.927  18.769 -16.586
 1174    HB2  TYR 144           HB2      TYR 144   2.405  20.387 -15.257
 1175    HB3  TYR 144           HB3      TYR 144   2.622  21.511 -16.579
 1176    HD1  TYR 144           HD1      TYR 144   2.478  18.012 -17.780
 1177    HD2  TYR 144           HD2      TYR 144   0.033  21.344 -16.477
 1178    HE1  TYR 144           HE1      TYR 144   0.498  16.834 -18.499
 1179    HE2  TYR 144           HE2      TYR 144  -1.960  20.201 -17.334
 1180    HH   TYR 144           HH       TYR 144  -2.794  18.307 -18.486
 1181    H    ARG 145           H        ARG 145   5.408  21.992 -17.109
 1182    HA   ARG 145           HA       ARG 145   5.468  22.020 -19.887
 1183    HB2  ARG 145           HB2      ARG 145   6.504  23.593 -17.895
 1184    HB3  ARG 145           HB3      ARG 145   7.989  22.774 -18.398
 1185    HG2  ARG 145           HG2      ARG 145   7.286  23.408 -20.818
 1186    HG3  ARG 145           HG3      ARG 145   6.050  24.414 -20.042
 1187    HD2  ARG 145           HD2      ARG 145   7.876  25.892 -20.508
 1188    HD3  ARG 145           HD3      ARG 145   7.937  25.575 -18.779
 1189    HE   ARG 145           HE       ARG 145   9.917  24.405 -19.013
 1190   HH11  ARG 145          HH11      ARG 145   8.671  25.131 -22.267
 1191   HH12  ARG 145          HH12      ARG 145  10.145  24.732 -23.070
 1192   HH21  ARG 145          HH21      ARG 145  11.873  23.877 -20.082
 1193   HH22  ARG 145          HH22      ARG 145  12.004  24.000 -21.797
 1194    H    ARG 146           H        ARG 146   7.472  19.990 -17.694
 1195    HA   ARG 146           HA       ARG 146   9.371  19.198 -19.722
 1196    HB2  ARG 146           HB2      ARG 146   8.484  17.419 -17.399
 1197    HB3  ARG 146           HB3      ARG 146  10.019  17.394 -18.246
 1198    HG2  ARG 146           HG2      ARG 146   9.013  19.571 -16.397
 1199    HG3  ARG 146           HG3      ARG 146  10.186  18.328 -15.978
 1200    HD2  ARG 146           HD2      ARG 146  11.830  19.310 -17.451
 1201    HD3  ARG 146           HD3      ARG 146  10.635  20.424 -18.153
 1202    HE   ARG 146           HE       ARG 146  10.404  21.147 -15.615
 1203   HH11  ARG 146          HH11      ARG 146  13.410  20.629 -17.469
 1204   HH12  ARG 146          HH12      ARG 146  14.331  21.747 -16.528
 1205   HH21  ARG 146          HH21      ARG 146  11.597  22.635 -14.405
 1206   HH22  ARG 146          HH22      ARG 146  13.281  22.907 -14.738
 1207    H    VAL 147           H        VAL 147   6.328  17.682 -18.540
 1208    HA   VAL 147           HA       VAL 147   6.284  15.476 -20.300
 1209    HB   VAL 147           HB       VAL 147   3.876  17.087 -19.334
 1210   HG11  VAL 147          HG11      VAL 147   3.293  15.390 -21.012
 1211   HG12  VAL 147          HG12      VAL 147   4.162  14.154 -20.086
 1212   HG13  VAL 147          HG13      VAL 147   2.696  14.908 -19.419
 1213   HG21  VAL 147          HG21      VAL 147   5.290  16.520 -17.363
 1214   HG22  VAL 147          HG22      VAL 147   3.795  15.593 -17.384
 1215   HG23  VAL 147          HG23      VAL 147   5.304  14.818 -17.900
 1216    H    MET 148           H        MET 148   4.924  18.797 -20.723
 1217    HA   MET 148           HA       MET 148   3.874  18.191 -23.274
 1218    HB2  MET 148           HB2      MET 148   4.499  20.837 -21.915
 1219    HB3  MET 148           HB3      MET 148   3.707  20.703 -23.494
 1220    HG2  MET 148           HG2      MET 148   2.025  19.137 -22.448
 1221    HG3  MET 148           HG3      MET 148   2.705  19.560 -20.865
 1222    HE1  MET 148           HE1      MET 148   0.325  20.335 -20.026
 1223    HE2  MET 148           HE2      MET 148  -0.702  21.446 -20.960
 1224    HE3  MET 148           HE3      MET 148  -0.337  19.831 -21.604
 1225    H    LYS 149           H        LYS 149   7.008  19.698 -22.333
 1226    HA   LYS 149           HA       LYS 149   7.923  20.317 -24.950
 1227    HB2  LYS 149           HB2      LYS 149   9.004  21.241 -23.048
 1228    HB3  LYS 149           HB3      LYS 149   9.289  19.678 -22.301
 1229    HG2  LYS 149           HG2      LYS 149  10.589  20.211 -24.968
 1230    HG3  LYS 149           HG3      LYS 149  11.214  21.050 -23.543
 1231    HD2  LYS 149           HD2      LYS 149  11.686  18.994 -22.380
 1232    HD3  LYS 149           HD3      LYS 149  10.880  18.020 -23.613
 1233    HE2  LYS 149           HE2      LYS 149  12.543  18.719 -25.301
 1234    HE3  LYS 149           HE3      LYS 149  13.385  19.673 -24.073
 1235    HZ1  LYS 149           HZ1      LYS 149  14.361  17.449 -24.415
 1236    HZ2  LYS 149           HZ2      LYS 149  13.873  17.646 -22.873
 1237    HZ3  LYS 149           HZ3      LYS 149  12.975  16.722 -23.892
 1238    H    GLU 150           H        GLU 150   8.069  17.300 -23.058
 1239    HA   GLU 150           HA       GLU 150   9.841  15.954 -24.864
 1240    HB2  GLU 150           HB2      GLU 150   7.916  14.965 -22.726
 1241    HB3  GLU 150           HB3      GLU 150   8.978  13.881 -23.616
 1242    HG2  GLU 150           HG2      GLU 150  10.102  16.267 -22.097
 1243    HG3  GLU 150           HG3      GLU 150   9.742  14.739 -21.299
 1244    H    PHE 151           H        PHE 151   6.276  16.192 -24.750
 1245    HA   PHE 151           HA       PHE 151   6.037  14.333 -27.042
 1246    HB2  PHE 151           HB2      PHE 151   3.957  15.676 -25.299
 1247    HB3  PHE 151           HB3      PHE 151   3.617  14.501 -26.551
 1248    HD1  PHE 151           HD1      PHE 151   6.066  12.590 -25.743
 1249    HD2  PHE 151           HD2      PHE 151   2.884  14.524 -23.547
 1250    HE1  PHE 151           HE1      PHE 151   6.200  10.858 -24.010
 1251    HE2  PHE 151           HE2      PHE 151   2.998  12.736 -21.835
 1252    HZ   PHE 151           HZ       PHE 151   4.661  10.916 -22.042
 1253    H    ALA 152           H        ALA 152   6.332  17.739 -26.705
 1254    HA   ALA 152           HA       ALA 152   4.362  18.802 -28.233
 1255    HB1  ALA 152           HB1      ALA 152   5.908  20.656 -28.762
 1256    HB2  ALA 152           HB2      ALA 152   6.029  20.169 -27.067
 1257    HB3  ALA 152           HB3      ALA 152   7.287  19.670 -28.224
 1258    H    SER 153           H        SER 153   7.553  17.925 -29.729
 1259    HA   SER 153           HA       SER 153   6.622  18.377 -32.340
 1260    HB2  SER 153           HB2      SER 153   8.834  16.449 -31.560
 1261    HB3  SER 153           HB3      SER 153   8.672  17.383 -33.059
 1262    HG   SER 153           HG       SER 153  10.160  18.365 -31.599
 1263    H    VAL 154           H        VAL 154   5.937  15.640 -30.257
 1264    HA   VAL 154           HA       VAL 154   5.733  13.694 -32.443
 1265    HB   VAL 154           HB       VAL 154   4.798  13.486 -29.539
 1266   HG11  VAL 154          HG11      VAL 154   3.771  11.787 -30.994
 1267   HG12  VAL 154          HG12      VAL 154   5.365  11.337 -31.632
 1268   HG13  VAL 154          HG13      VAL 154   4.962  11.041 -29.925
 1269   HG21  VAL 154          HG21      VAL 154   6.897  12.200 -29.148
 1270   HG22  VAL 154          HG22      VAL 154   7.459  12.649 -30.774
 1271   HG23  VAL 154          HG23      VAL 154   7.218  13.892 -29.524
 1272    H    VAL 155           H        VAL 155   3.619  15.766 -30.434
 1273    HA   VAL 155           HA       VAL 155   1.196  14.912 -31.820
 1274    HB   VAL 155           HB       VAL 155   1.762  17.301 -30.014
 1275   HG11  VAL 155          HG11      VAL 155  -0.887  16.067 -30.937
 1276   HG12  VAL 155          HG12      VAL 155  -0.713  17.334 -29.693
 1277   HG13  VAL 155          HG13      VAL 155  -0.269  17.677 -31.365
 1278   HG21  VAL 155          HG21      VAL 155   0.679  14.499 -29.487
 1279   HG22  VAL 155          HG22      VAL 155   2.128  15.253 -28.773
 1280   HG23  VAL 155          HG23      VAL 155   0.528  15.832 -28.335
 1281    H    MET 156           H        MET 156   3.304  17.868 -31.926
 1282    HA   MET 156           HA       MET 156   1.627  19.151 -33.815
 1283    HB2  MET 156           HB2      MET 156   4.589  19.541 -33.169
 1284    HB3  MET 156           HB3      MET 156   3.664  20.617 -34.222
 1285    HG2  MET 156           HG2      MET 156   2.998  20.056 -31.306
 1286    HG3  MET 156           HG3      MET 156   3.843  21.474 -31.918
 1287    HE1  MET 156           HE1      MET 156   2.162  23.062 -30.643
 1288    HE2  MET 156           HE2      MET 156   0.397  22.877 -30.729
 1289    HE3  MET 156           HE3      MET 156   1.391  21.589 -30.008
 1290    H    SER 157           H        SER 157   4.207  16.739 -34.468
 1291    HA   SER 157           HA       SER 157   4.511  17.283 -37.216
 1292    HB2  SER 157           HB2      SER 157   4.511  14.605 -35.759
 1293    HB3  SER 157           HB3      SER 157   5.062  14.859 -37.424
 1294    HG   SER 157           HG       SER 157   6.179  15.875 -35.020
 1295    H    LEU 158           H        LEU 158   1.789  15.804 -35.515
 1296    HA   LEU 158           HA       LEU 158   0.520  14.596 -37.827
 1297    HB2  LEU 158           HB2      LEU 158  -0.597  15.600 -35.207
 1298    HB3  LEU 158           HB3      LEU 158  -1.497  14.595 -36.329
 1299    HG   LEU 158           HG       LEU 158   1.018  13.722 -34.839
 1300   HD11  LEU 158          HD11      LEU 158  -1.928  13.245 -34.162
 1301   HD12  LEU 158          HD12      LEU 158  -0.521  12.568 -33.304
 1302   HD13  LEU 158          HD13      LEU 158  -0.827  14.316 -33.272
 1303   HD21  LEU 158          HD21      LEU 158   0.253  11.447 -35.418
 1304   HD22  LEU 158          HD22      LEU 158  -1.116  12.123 -36.330
 1305   HD23  LEU 158          HD23      LEU 158   0.555  12.398 -36.879
 1306    H    GLN 159           H        GLN 159   0.630  17.882 -36.477
 1307    HA   GLN 159           HA       GLN 159  -1.606  18.763 -38.234
 1308    HB2  GLN 159           HB2      GLN 159  -0.135  20.231 -35.980
 1309    HB3  GLN 159           HB3      GLN 159  -1.419  20.922 -36.961
 1310    HG2  GLN 159           HG2      GLN 159  -2.326  20.310 -34.950
 1311    HG3  GLN 159           HG3      GLN 159  -2.999  19.215 -36.170
 1312   HE21  GLN 159          HE22      GLN 159  -3.186  17.064 -35.337
 1313   HE22  GLN 159          HE21      GLN 159  -2.092  16.432 -34.131
 1314    H    GLU 160           H        GLU 160   1.910  19.126 -37.810
 1315    HA   GLU 160           HA       GLU 160   2.248  21.224 -39.705
 1316    HB2  GLU 160           HB2      GLU 160   3.824  20.509 -37.854
 1317    HB3  GLU 160           HB3      GLU 160   4.207  19.069 -38.800
 1318    HG2  GLU 160           HG2      GLU 160   5.958  20.670 -39.103
 1319    HG3  GLU 160           HG3      GLU 160   5.091  20.541 -40.623
 1320    H    ASN 161           H        ASN 161   1.856  17.727 -40.061
 1321    HA   ASN 161           HA       ASN 161   2.225  17.903 -43.003
 1322    HB2  ASN 161           HB2      ASN 161   3.916  16.400 -42.087
 1323    HB3  ASN 161           HB3      ASN 161   2.717  15.657 -41.016
 1324   HD21  ASN 161          HD21      ASN 161   3.338  13.558 -41.968
 1325   HD22  ASN 161          HD22      ASN 161   2.430  13.070 -43.387
 1326    H    THR 162           H        THR 162   0.028  18.830 -42.899
 1327    HA   THR 162           HA       THR 162  -2.129  17.647 -41.638
 1328    HB   THR 162           HB       THR 162  -3.159  18.784 -44.003
 1329    HG1  THR 162           HG1      THR 162  -1.944  20.634 -44.312
 1330   HG21  THR 162          HG21      THR 162  -3.977  19.188 -41.705
 1331   HG22  THR 162          HG22      THR 162  -2.509  20.124 -41.335
 1332   HG23  THR 162          HG23      THR 162  -3.672  20.714 -42.545
 1333    HA   PRO 163           HA       PRO 163  -2.750  14.747 -45.461
 1334    HB2  PRO 163           HB2      PRO 163   0.179  14.491 -46.162
 1335    HB3  PRO 163           HB3      PRO 163  -1.254  14.273 -47.216
 1336    HG2  PRO 163           HG2      PRO 163   0.138  16.596 -47.304
 1337    HG3  PRO 163           HG3      PRO 163  -1.656  16.645 -47.269
 1338    HD2  PRO 163           HD2      PRO 163   0.272  17.051 -44.962
 1339    HD3  PRO 163           HD3      PRO 163  -1.191  17.972 -45.375
 1340    H    LYS 164           H        LYS 164  -0.305  14.654 -42.913
 1341    HA   LYS 164           HA       LYS 164   0.530  13.021 -41.621
 1342    HB2  LYS 164           HB2      LYS 164  -2.281  11.958 -41.959
 1343    HB3  LYS 164           HB3      LYS 164  -1.139  11.399 -40.735
 1344    HG2  LYS 164           HG2      LYS 164  -1.033  13.551 -39.672
 1345    HG3  LYS 164           HG3      LYS 164  -1.981  14.325 -40.933
 1346    HD2  LYS 164           HD2      LYS 164  -3.004  12.150 -39.069
 1347    HD3  LYS 164           HD3      LYS 164  -3.292  13.873 -38.853
 1348    HE2  LYS 164           HE2      LYS 164  -4.242  12.224 -41.252
 1349    HE3  LYS 164           HE3      LYS 164  -5.221  12.637 -39.849
 1350    HZ1  LYS 164           HZ1      LYS 164  -5.643  14.147 -41.665
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.985  14.987 -40.431
 1352    HZ3  LYS 164           HZ3      LYS 164  -4.084  14.630 -41.761
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1  -3.416   1.182  -3.425
    2    H2   MET   1           H2       MET   1  -2.942   2.684  -2.973
    3    H3   MET   1           H3       MET   1  -2.687   2.187  -4.505
    4    HA   MET   1           HA       MET   1  -1.421   1.122  -2.068
    5    HB2  MET   1           HB2      MET   1  -0.121  -0.410  -3.370
    6    HB3  MET   1           HB3      MET   1  -1.815  -0.694  -3.718
    7    HG2  MET   1           HG2      MET   1  -1.545   0.551  -5.885
    8    HG3  MET   1           HG3      MET   1   0.173   0.776  -5.509
    9    HE1  MET   1           HE1      MET   1   1.033  -0.309  -7.756
   10    HE2  MET   1           HE2      MET   1   0.353  -1.804  -8.425
   11    HE3  MET   1           HE3      MET   1  -0.678  -0.371  -8.240
   12    H    ILE   2           H        ILE   2   0.855   1.636  -1.810
   13    HA   ILE   2           HA       ILE   2   1.864   3.863  -3.516
   14    HB   ILE   2           HB       ILE   2   2.296   3.409  -0.548
   15   HG12  ILE   2          HG12      ILE   2   0.135   4.435  -0.881
   16   HG13  ILE   2          HG13      ILE   2   1.253   5.592  -0.191
   17   HG21  ILE   2          HG21      ILE   2   3.556   5.577  -0.610
   18   HG22  ILE   2          HG22      ILE   2   4.372   4.263  -1.464
   19   HG23  ILE   2          HG23      ILE   2   3.511   5.514  -2.384
   20   HD11  ILE   2          HD11      ILE   2   0.356   5.523  -3.101
   21   HD12  ILE   2          HD12      ILE   2  -0.146   6.667  -1.854
   22   HD13  ILE   2          HD13      ILE   2   1.530   6.675  -2.421
   23    H    ASP   3           H        ASP   3   4.122   3.730  -3.999
   24    HA   ASP   3           HA       ASP   3   5.312   1.010  -3.896
   25    HB2  ASP   3           HB2      ASP   3   4.220   1.506  -6.079
   26    HB3  ASP   3           HB3      ASP   3   5.173   2.980  -6.228
   27    H    ASP   4           H        ASP   4   7.691   1.211  -4.420
   28    HA   ASP   4           HA       ASP   4   9.710   1.849  -3.599
   29    HB2  ASP   4           HB2      ASP   4   9.433   2.603  -5.935
   30    HB3  ASP   4           HB3      ASP   4   8.981   4.210  -5.355
   31    H    ASP   5           H        ASP   5   8.228   2.267  -1.499
   32    HA   ASP   5           HA       ASP   5   8.218   3.117   0.530
   33    HB2  ASP   5           HB2      ASP   5  10.622   2.683   0.221
   34    HB3  ASP   5           HB3      ASP   5  10.866   4.389  -0.154
   35    H    GLY   6           H        GLY   6   7.146   4.862  -1.770
   36    HA2  GLY   6           HA2      GLY   6   5.603   6.434  -0.217
   37    HA3  GLY   6           HA3      GLY   6   7.009   7.467  -0.393
   38    H    TYR   7           H        TYR   7   6.620   5.761  -3.359
   39    HA   TYR   7           HA       TYR   7   5.469   8.249  -4.489
   40    HB2  TYR   7           HB2      TYR   7   7.118   5.989  -5.647
   41    HB3  TYR   7           HB3      TYR   7   6.212   7.130  -6.647
   42    HD1  TYR   7           HD1      TYR   7   6.727   9.482  -6.753
   43    HD2  TYR   7           HD2      TYR   7   9.079   6.825  -4.306
   44    HE1  TYR   7           HE1      TYR   7   8.329  11.287  -6.367
   45    HE2  TYR   7           HE2      TYR   7  10.741   8.605  -3.960
   46    HH   TYR   7           HH       TYR   7  11.341  10.838  -4.416
   47    H    ARG   8           H        ARG   8   3.406   8.315  -5.256
   48    HA   ARG   8           HA       ARG   8   1.812   5.829  -5.150
   49    HB2  ARG   8           HB2      ARG   8   0.828   7.995  -4.505
   50    HB3  ARG   8           HB3      ARG   8   0.965   8.564  -6.176
   51    HG2  ARG   8           HG2      ARG   8  -0.576   6.793  -6.932
   52    HG3  ARG   8           HG3      ARG   8  -0.553   6.054  -5.326
   53    HD2  ARG   8           HD2      ARG   8  -2.621   7.136  -5.575
   54    HD3  ARG   8           HD3      ARG   8  -1.681   8.093  -4.413
   55    HE   ARG   8           HE       ARG   8  -1.186   9.247  -6.928
   56   HH11  ARG   8          HH11      ARG   8  -4.120   8.701  -4.965
   57   HH12  ARG   8          HH12      ARG   8  -4.966  10.047  -5.636
   58   HH21  ARG   8          HH21      ARG   8  -2.276  10.991  -7.772
   59   HH22  ARG   8          HH22      ARG   8  -3.905  11.374  -7.302
   60    HA   PRO   9           HA       PRO   9   3.120   5.039  -9.425
   61    HB2  PRO   9           HB2      PRO   9   2.217   2.494  -9.740
   62    HB3  PRO   9           HB3      PRO   9   3.605   2.875  -8.677
   63    HG2  PRO   9           HG2      PRO   9   0.709   2.429  -7.877
   64    HG3  PRO   9           HG3      PRO   9   2.180   1.739  -7.143
   65    HD2  PRO   9           HD2      PRO   9   0.896   3.979  -6.181
   66    HD3  PRO   9           HD3      PRO   9   2.655   3.714  -6.006
   67    H    ASN  10           H        ASN  10   1.975   6.086 -11.022
   68    HA   ASN  10           HA       ASN  10  -0.842   5.360 -11.503
   69    HB2  ASN  10           HB2      ASN  10  -1.653   7.614 -11.464
   70    HB3  ASN  10           HB3      ASN  10  -0.902   7.325  -9.900
   71   HD21  ASN  10          HD22      ASN  10   1.309   8.228  -9.670
   72   HD22  ASN  10          HD21      ASN  10   1.631   9.725 -10.551
   73    H    VAL  11           H        VAL  11  -1.596   6.450 -13.541
   74    HA   VAL  11           HA       VAL  11   0.600   6.828 -15.495
   75    HB   VAL  11           HB       VAL  11  -1.045   5.620 -17.084
   76   HG11  VAL  11          HG11      VAL  11   0.042   3.483 -16.651
   77   HG12  VAL  11          HG12      VAL  11   1.202   4.805 -16.469
   78   HG13  VAL  11          HG13      VAL  11   0.523   4.017 -15.027
   79   HG21  VAL  11          HG21      VAL  11  -2.232   3.720 -16.004
   80   HG22  VAL  11          HG22      VAL  11  -1.980   4.406 -14.423
   81   HG23  VAL  11          HG23      VAL  11  -2.974   5.277 -15.619
   82    H    GLY  12           H        GLY  12   0.235   8.543 -16.847
   83    HA2  GLY  12           HA2      GLY  12  -2.260  10.132 -16.366
   84    HA3  GLY  12           HA3      GLY  12  -0.676  10.787 -16.776
   85    H    ILE  13           H        ILE  13  -3.610  10.334 -18.140
   86    HA   ILE  13           HA       ILE  13  -2.642   9.353 -20.778
   87    HB   ILE  13           HB       ILE  13  -5.459  10.003 -19.744
   88   HG12  ILE  13          HG12      ILE  13  -5.845   7.591 -20.466
   89   HG13  ILE  13          HG13      ILE  13  -4.098   7.413 -20.626
   90   HG21  ILE  13          HG21      ILE  13  -6.282   9.315 -21.894
   91   HG22  ILE  13          HG22      ILE  13  -5.107  10.597 -22.199
   92   HG23  ILE  13          HG23      ILE  13  -4.658   8.911 -22.471
   93   HD11  ILE  13          HD11      ILE  13  -5.095   6.506 -18.564
   94   HD12  ILE  13          HD12      ILE  13  -3.840   7.684 -18.208
   95   HD13  ILE  13          HD13      ILE  13  -5.575   8.126 -18.053
   96    H    VAL  14           H        VAL  14  -1.522  11.004 -21.815
   97    HA   VAL  14           HA       VAL  14  -2.492  13.792 -21.563
   98    HB   VAL  14           HB       VAL  14  -0.317  12.699 -23.408
   99   HG11  VAL  14          HG11      VAL  14  -0.852  15.534 -22.412
  100   HG12  VAL  14          HG12      VAL  14   0.427  15.017 -23.529
  101   HG13  VAL  14          HG13      VAL  14  -1.258  14.929 -24.029
  102   HG21  VAL  14          HG21      VAL  14   0.424  12.229 -21.162
  103   HG22  VAL  14          HG22      VAL  14   1.301  13.630 -21.767
  104   HG23  VAL  14          HG23      VAL  14  -0.026  13.871 -20.616
  105    H    ILE  15           H        ILE  15  -4.708  13.273 -22.264
  106    HA   ILE  15           HA       ILE  15  -5.196  12.291 -24.930
  107    HB   ILE  15           HB       ILE  15  -6.876  14.268 -23.322
  108   HG12  ILE  15          HG12      ILE  15  -6.773  12.050 -22.240
  109   HG13  ILE  15          HG13      ILE  15  -8.371  12.478 -22.814
  110   HG21  ILE  15          HG21      ILE  15  -8.719  13.585 -24.915
  111   HG22  ILE  15          HG22      ILE  15  -7.476  14.629 -25.590
  112   HG23  ILE  15          HG23      ILE  15  -7.434  12.889 -25.954
  113   HD11  ILE  15          HD11      ILE  15  -7.820  10.101 -23.321
  114   HD12  ILE  15          HD12      ILE  15  -8.146  11.021 -24.777
  115   HD13  ILE  15          HD13      ILE  15  -6.471  10.647 -24.359
  116    H    CYS  16           H        CYS  16  -4.912  13.239 -26.844
  117    HA   CYS  16           HA       CYS  16  -4.529  16.204 -26.913
  118    HB2  CYS  16           HB2      CYS  16  -2.964  14.112 -28.478
  119    HB3  CYS  16           HB3      CYS  16  -3.036  15.852 -28.890
  120    HG   CYS  16           HG       CYS  16  -2.188  14.470 -25.999
  121    H    ASN  17           H        ASN  17  -5.916  17.151 -28.176
  122    HA   ASN  17           HA       ASN  17  -7.785  15.506 -29.786
  123    HB2  ASN  17           HB2      ASN  17  -8.750  17.261 -28.269
  124    HB3  ASN  17           HB3      ASN  17  -7.834  18.502 -29.139
  125   HD21  ASN  17          HD22      ASN  17 -10.750  16.575 -29.194
  126   HD22  ASN  17          HD21      ASN  17 -11.239  16.975 -30.822
  127    H    ARG  18           H        ARG  18  -7.693  15.617 -31.974
  128    HA   ARG  18           HA       ARG  18  -5.278  16.100 -33.278
  129    HB2  ARG  18           HB2      ARG  18  -8.065  15.832 -34.497
  130    HB3  ARG  18           HB3      ARG  18  -6.509  15.536 -35.311
  131    HG2  ARG  18           HG2      ARG  18  -6.000  13.796 -33.559
  132    HG3  ARG  18           HG3      ARG  18  -7.663  14.000 -32.945
  133    HD2  ARG  18           HD2      ARG  18  -8.549  13.502 -35.207
  134    HD3  ARG  18           HD3      ARG  18  -6.883  13.249 -35.773
  135    HE   ARG  18           HE       ARG  18  -7.937  11.635 -33.476
  136   HH11  ARG  18          HH11      ARG  18  -7.032  11.608 -36.925
  137   HH12  ARG  18          HH12      ARG  18  -6.876   9.892 -37.008
  138   HH21  ARG  18          HH21      ARG  18  -7.691   9.431 -33.565
  139   HH22  ARG  18          HH22      ARG  18  -7.280   8.600 -35.048
  140    H    GLN  19           H        GLN  19  -7.352  18.599 -32.362
  141    HA   GLN  19           HA       GLN  19  -6.604  20.365 -34.586
  142    HB2  GLN  19           HB2      GLN  19  -7.909  20.792 -31.870
  143    HB3  GLN  19           HB3      GLN  19  -7.589  22.110 -33.003
  144    HG2  GLN  19           HG2      GLN  19  -9.117  21.296 -34.617
  145    HG3  GLN  19           HG3      GLN  19  -9.182  19.684 -33.908
  146   HE21  GLN  19          HE22      GLN  19 -10.319  19.339 -31.912
  147   HE22  GLN  19          HE21      GLN  19 -11.522  20.487 -31.319
  148    H    GLY  20           H        GLY  20  -4.777  18.880 -32.185
  149    HA2  GLY  20           HA2      GLY  20  -2.545  19.247 -31.682
  150    HA3  GLY  20           HA3      GLY  20  -2.617  20.883 -32.342
  151    H    GLN  21           H        GLN  21  -4.856  19.520 -29.947
  152    HA   GLN  21           HA       GLN  21  -4.061  21.680 -28.042
  153    HB2  GLN  21           HB2      GLN  21  -6.926  20.933 -28.696
  154    HB3  GLN  21           HB3      GLN  21  -6.366  22.260 -27.686
  155    HG2  GLN  21           HG2      GLN  21  -6.201  21.994 -30.695
  156    HG3  GLN  21           HG3      GLN  21  -7.128  23.156 -29.774
  157   HE21  GLN  21          HE21      GLN  21  -4.653  23.203 -31.898
  158   HE22  GLN  21          HE22      GLN  21  -3.650  24.432 -31.181
  159    H    VAL  22           H        VAL  22  -4.670  21.135 -25.794
  160    HA   VAL  22           HA       VAL  22  -4.394  18.167 -25.462
  161    HB   VAL  22           HB       VAL  22  -3.045  18.686 -23.468
  162   HG11  VAL  22          HG11      VAL  22  -1.036  19.399 -24.708
  163   HG12  VAL  22          HG12      VAL  22  -1.963  18.176 -25.586
  164   HG13  VAL  22          HG13      VAL  22  -2.053  19.873 -26.087
  165   HG21  VAL  22          HG21      VAL  22  -2.172  20.914 -23.092
  166   HG22  VAL  22          HG22      VAL  22  -3.140  21.580 -24.411
  167   HG23  VAL  22          HG23      VAL  22  -3.937  20.932 -22.964
  168    H    MET  23           H        MET  23  -4.923  17.193 -23.524
  169    HA   MET  23           HA       MET  23  -7.463  17.364 -22.488
  170    HB2  MET  23           HB2      MET  23  -5.654  15.551 -22.201
  171    HB3  MET  23           HB3      MET  23  -4.948  16.538 -20.948
  172    HG2  MET  23           HG2      MET  23  -6.343  14.813 -19.986
  173    HG3  MET  23           HG3      MET  23  -7.033  16.406 -19.628
  174    HE1  MET  23           HE1      MET  23  -8.579  13.712 -19.152
  175    HE2  MET  23           HE2      MET  23  -9.420  15.268 -18.910
  176    HE3  MET  23           HE3      MET  23 -10.163  13.998 -19.907
  177    H    TRP  24           H        TRP  24  -8.485  18.750 -21.084
  178    HA   TRP  24           HA       TRP  24  -7.218  19.623 -18.672
  179    HB2  TRP  24           HB2      TRP  24  -6.564  21.371 -20.500
  180    HB3  TRP  24           HB3      TRP  24  -8.244  21.842 -20.504
  181    HD1  TRP  24           HD1      TRP  24  -8.325  24.081 -19.340
  182    HE1  TRP  24           HE1      TRP  24  -7.448  25.122 -17.186
  183    HE3  TRP  24           HE3      TRP  24  -5.268  20.278 -17.779
  184    HZ2  TRP  24           HZ2      TRP  24  -5.630  24.411 -15.049
  185    HZ3  TRP  24           HZ3      TRP  24  -3.925  20.531 -15.708
  186    HH2  TRP  24           HH2      TRP  24  -4.119  22.578 -14.323
  187    H    ALA  25           H        ALA  25  -8.951  19.317 -17.178
  188    HA   ALA  25           HA       ALA  25 -11.718  19.730 -18.223
  189    HB1  ALA  25           HB1      ALA  25 -12.376  17.534 -17.167
  190    HB2  ALA  25           HB2      ALA  25 -11.314  17.362 -18.585
  191    HB3  ALA  25           HB3      ALA  25 -10.659  17.169 -16.934
  192    H    ARG  26           H        ARG  26 -13.255  20.122 -16.890
  193    HA   ARG  26           HA       ARG  26 -12.501  21.903 -14.722
  194    HB2  ARG  26           HB2      ARG  26 -14.146  22.332 -16.643
  195    HB3  ARG  26           HB3      ARG  26 -15.228  21.165 -15.896
  196    HG2  ARG  26           HG2      ARG  26 -15.391  22.615 -13.894
  197    HG3  ARG  26           HG3      ARG  26 -14.226  23.733 -14.588
  198    HD2  ARG  26           HD2      ARG  26 -16.700  24.418 -14.806
  199    HD3  ARG  26           HD3      ARG  26 -15.720  24.477 -16.255
  200    HE   ARG  26           HE       ARG  26 -17.141  23.118 -17.270
  201   HH11  ARG  26          HH11      ARG  26 -17.610  22.372 -13.793
  202   HH12  ARG  26          HH12      ARG  26 -18.845  21.190 -14.119
  203   HH21  ARG  26          HH22      ARG  26 -18.956  21.738 -17.586
  204   HH22  ARG  26          HH21      ARG  26 -19.593  20.839 -16.256
  205    H    ARG  27           H        ARG  27 -13.020  21.554 -12.509
  206    HA   ARG  27           HA       ARG  27 -13.757  18.818 -11.780
  207    HB2  ARG  27           HB2      ARG  27 -11.836  19.790 -10.757
  208    HB3  ARG  27           HB3      ARG  27 -12.734  21.209 -10.209
  209    HG2  ARG  27           HG2      ARG  27 -13.764  20.120  -8.473
  210    HG3  ARG  27           HG3      ARG  27 -13.594  18.502  -9.199
  211    HD2  ARG  27           HD2      ARG  27 -11.267  18.420  -8.784
  212    HD3  ARG  27           HD3      ARG  27 -11.204  20.127  -8.272
  213    HE   ARG  27           HE       ARG  27 -12.970  19.034  -6.501
  214   HH11  ARG  27          HH11      ARG  27  -9.597  18.363  -7.433
  215   HH12  ARG  27          HH12      ARG  27  -9.158  17.707  -5.889
  216   HH21  ARG  27          HH21      ARG  27 -12.385  18.151  -4.449
  217   HH22  ARG  27          HH22      ARG  27 -10.783  17.590  -4.157
  218    H    PHE  28           H        PHE  28 -15.547  18.275 -10.442
  219    HA   PHE  28           HA       PHE  28 -17.956  19.764 -10.692
  220    HB2  PHE  28           HB2      PHE  28 -18.890  18.151  -9.071
  221    HB3  PHE  28           HB3      PHE  28 -18.133  17.439 -10.458
  222    HD1  PHE  28           HD1      PHE  28 -15.649  18.334  -7.855
  223    HD2  PHE  28           HD2      PHE  28 -18.471  15.356  -9.198
  224    HE1  PHE  28           HE1      PHE  28 -14.588  16.673  -6.402
  225    HE2  PHE  28           HE2      PHE  28 -17.405  13.700  -7.731
  226    HZ   PHE  28           HZ       PHE  28 -15.460  14.341  -6.305
  227    H    GLY  29           H        GLY  29 -19.321  20.624  -8.933
  228    HA2  GLY  29           HA2      GLY  29 -19.678  22.376  -7.526
  229    HA3  GLY  29           HA3      GLY  29 -18.399  21.697  -6.497
  230    H    GLN  30           H        GLN  30 -17.805  22.608  -9.813
  231    HA   GLN  30           HA       GLN  30 -15.619  23.287 -10.069
  232    HB2  GLN  30           HB2      GLN  30 -17.103  23.616 -11.833
  233    HB3  GLN  30           HB3      GLN  30 -17.889  24.997 -11.061
  234    HG2  GLN  30           HG2      GLN  30 -16.389  25.576 -12.972
  235    HG3  GLN  30           HG3      GLN  30 -16.067  26.425 -11.463
  236   HE21  GLN  30          HE22      GLN  30 -14.872  23.056 -11.877
  237   HE22  GLN  30          HE21      GLN  30 -13.201  23.585 -12.125
  238    H    HIS  31           H        HIS  31 -14.075  23.911  -9.010
  239    HA   HIS  31           HA       HIS  31 -13.872  26.711  -8.883
  240    HB2  HIS  31           HB2      HIS  31 -13.014  26.699  -6.440
  241    HB3  HIS  31           HB3      HIS  31 -14.680  26.164  -6.558
  242    HD1  HIS  31           HD1      HIS  31 -11.290  24.947  -5.439
  243    HD2  HIS  31           HD2      HIS  31 -15.040  23.306  -6.460
  244    HE1  HIS  31           HE1      HIS  31 -11.310  22.569  -4.542
  245    H    SER  32           H        SER  32 -12.631  24.218 -10.175
  246    HA   SER  32           HA       SER  32  -9.798  24.931 -10.078
  247    HB2  SER  32           HB2      SER  32 -10.823  22.234  -9.075
  248    HB3  SER  32           HB3      SER  32  -9.122  22.601  -9.435
  249    HG   SER  32           HG       SER  32  -9.508  22.830  -7.210
  250    H    TRP  33           H        TRP  33  -8.712  24.076 -11.928
  251    HA   TRP  33           HA       TRP  33 -10.288  22.267 -13.689
  252    HB2  TRP  33           HB2      TRP  33  -9.898  24.861 -14.318
  253    HB3  TRP  33           HB3      TRP  33  -8.359  24.235 -14.872
  254    HD1  TRP  33           HD1      TRP  33  -8.788  21.894 -16.510
  255    HE1  TRP  33           HE1      TRP  33 -10.376  21.709 -18.516
  256    HE3  TRP  33           HE3      TRP  33 -12.048  25.720 -15.424
  257    HZ2  TRP  33           HZ2      TRP  33 -12.801  22.836 -19.416
  258    HZ3  TRP  33           HZ3      TRP  33 -14.008  26.110 -16.893
  259    HH2  TRP  33           HH2      TRP  33 -14.415  24.599 -18.867
  260    H    GLN  34           H        GLN  34  -9.115  20.427 -14.274
  261    HA   GLN  34           HA       GLN  34  -6.302  20.208 -13.329
  262    HB2  GLN  34           HB2      GLN  34  -8.643  18.475 -12.393
  263    HB3  GLN  34           HB3      GLN  34  -6.945  18.112 -12.103
  264    HG2  GLN  34           HG2      GLN  34  -6.763  20.373 -10.923
  265    HG3  GLN  34           HG3      GLN  34  -8.526  20.453 -10.995
  266   HE21  GLN  34          HE22      GLN  34  -5.793  18.376  -9.800
  267   HE22  GLN  34          HE21      GLN  34  -6.683  17.727  -8.448
  268    H    PHE  35           H        PHE  35  -5.843  17.600 -13.626
  269    HA   PHE  35           HA       PHE  35  -6.350  16.858 -16.412
  270    HB2  PHE  35           HB2      PHE  35  -4.004  16.927 -16.999
  271    HB3  PHE  35           HB3      PHE  35  -4.515  18.501 -16.504
  272    HD1  PHE  35           HD1      PHE  35  -4.043  18.902 -13.717
  273    HD2  PHE  35           HD2      PHE  35  -1.843  16.392 -16.454
  274    HE1  PHE  35           HE1      PHE  35  -2.063  19.053 -12.270
  275    HE2  PHE  35           HE2      PHE  35   0.192  16.709 -15.082
  276    HZ   PHE  35           HZ       PHE  35   0.091  18.004 -12.982
  277    HA   PRO  36           HA       PRO  36  -6.088  12.858 -14.649
  278    HB2  PRO  36           HB2      PRO  36  -4.892  11.293 -16.610
  279    HB3  PRO  36           HB3      PRO  36  -6.578  11.889 -16.650
  280    HG2  PRO  36           HG2      PRO  36  -4.129  13.086 -17.954
  281    HG3  PRO  36           HG3      PRO  36  -5.758  12.801 -18.668
  282    HD2  PRO  36           HD2      PRO  36  -5.036  15.226 -17.767
  283    HD3  PRO  36           HD3      PRO  36  -6.691  14.618 -17.467
  284    H    GLN  37           H        GLN  37  -4.823  11.224 -13.730
  285    HA   GLN  37           HA       GLN  37  -2.056  10.724 -13.632
  286    HB2  GLN  37           HB2      GLN  37  -1.493  11.744 -11.437
  287    HB3  GLN  37           HB3      GLN  37  -1.442  12.757 -12.841
  288    HG2  GLN  37           HG2      GLN  37  -4.024  13.280 -11.828
  289    HG3  GLN  37           HG3      GLN  37  -3.063  13.013 -10.384
  290   HE21  GLN  37          HE22      GLN  37  -2.759  14.684 -13.588
  291   HE22  GLN  37          HE21      GLN  37  -2.090  16.172 -12.958
  292    H    GLY  38           H        GLY  38  -3.563   8.782 -13.764
  293    HA2  GLY  38           HA2      GLY  38  -5.244   8.275 -11.369
  294    HA3  GLY  38           HA3      GLY  38  -5.406   7.531 -12.942
  295    H    GLY  39           H        GLY  39  -4.540   6.913  -9.843
  296    HA2  GLY  39           HA2      GLY  39  -2.282   5.451  -9.668
  297    HA3  GLY  39           HA3      GLY  39  -3.732   5.143  -8.736
  298    H    ILE  40           H        ILE  40  -1.687   3.369  -9.791
  299    HA   ILE  40           HA       ILE  40  -2.923   1.736 -11.887
  300    HB   ILE  40           HB       ILE  40  -0.376   1.519 -10.250
  301   HG12  ILE  40          HG12      ILE  40  -0.992   2.185 -13.169
  302   HG13  ILE  40          HG13      ILE  40  -0.406   3.282 -11.937
  303   HG21  ILE  40          HG21      ILE  40  -1.252  -0.384 -12.461
  304   HG22  ILE  40          HG22      ILE  40   0.315  -0.386 -11.633
  305   HG23  ILE  40          HG23      ILE  40  -1.133  -0.788 -10.741
  306   HD11  ILE  40          HD11      ILE  40   1.713   1.832 -11.816
  307   HD12  ILE  40          HD12      ILE  40   1.125   1.058 -13.304
  308   HD13  ILE  40          HD13      ILE  40   1.459   2.795 -13.279
  309    H    ASN  41           H        ASN  41  -4.038  -0.162 -11.623
  310    HA   ASN  41           HA       ASN  41  -5.092  -0.741  -8.955
  311    HB2  ASN  41           HB2      ASN  41  -6.596  -0.823 -10.898
  312    HB3  ASN  41           HB3      ASN  41  -5.575  -2.042 -11.662
  313   HD21  ASN  41          HD22      ASN  41  -5.688  -4.266 -10.898
  314   HD22  ASN  41          HD21      ASN  41  -6.886  -4.756  -9.729
  315    HA   PRO  42           HA       PRO  42  -1.865  -3.423  -7.920
  316    HB2  PRO  42           HB2      PRO  42  -3.919  -5.156  -6.516
  317    HB3  PRO  42           HB3      PRO  42  -2.328  -4.585  -5.914
  318    HG2  PRO  42           HG2      PRO  42  -4.602  -3.334  -5.146
  319    HG3  PRO  42           HG3      PRO  42  -3.163  -2.365  -5.605
  320    HD2  PRO  42           HD2      PRO  42  -5.615  -3.006  -7.264
  321    HD3  PRO  42           HD3      PRO  42  -4.742  -1.456  -7.066
  322    H    GLY  43           H        GLY  43  -0.914  -4.544  -9.353
  323    HA2  GLY  43           HA2      GLY  43  -0.205  -6.514 -10.378
  324    HA3  GLY  43           HA3      GLY  43  -1.757  -7.281 -10.022
  325    H    GLU  44           H        GLU  44  -2.349  -4.226 -11.396
  326    HA   GLU  44           HA       GLU  44  -2.763  -5.366 -14.125
  327    HB2  GLU  44           HB2      GLU  44  -4.608  -4.155 -12.951
  328    HB3  GLU  44           HB3      GLU  44  -3.628  -2.673 -13.020
  329    HG2  GLU  44           HG2      GLU  44  -3.636  -2.706 -15.420
  330    HG3  GLU  44           HG3      GLU  44  -4.284  -4.344 -15.471
  331    H    SER  45           H        SER  45  -1.323  -4.959 -15.720
  332    HA   SER  45           HA       SER  45   1.126  -3.590 -15.163
  333    HB2  SER  45           HB2      SER  45   1.365  -4.202 -17.739
  334    HB3  SER  45           HB3      SER  45   1.501  -5.396 -16.438
  335    HG   SER  45           HG       SER  45   0.063  -6.360 -17.692
  336    H    ALA  46           H        ALA  46   2.042  -1.907 -16.546
  337    HA   ALA  46           HA       ALA  46   0.738   0.439 -16.015
  338    HB1  ALA  46           HB1      ALA  46   3.151   0.183 -16.493
  339    HB2  ALA  46           HB2      ALA  46   2.779  -0.089 -18.217
  340    HB3  ALA  46           HB3      ALA  46   2.440   1.496 -17.455
  341    H    GLU  47           H        GLU  47   0.626  -1.313 -19.177
  342    HA   GLU  47           HA       GLU  47  -0.696   0.943 -20.461
  343    HB2  GLU  47           HB2      GLU  47  -0.267  -1.949 -21.300
  344    HB3  GLU  47           HB3      GLU  47  -1.188  -0.794 -22.270
  345    HG2  GLU  47           HG2      GLU  47   0.733   0.662 -22.488
  346    HG3  GLU  47           HG3      GLU  47   1.694  -0.342 -21.399
  347    H    GLN  48           H        GLN  48  -1.683  -2.213 -19.120
  348    HA   GLN  48           HA       GLN  48  -4.448  -2.072 -19.677
  349    HB2  GLN  48           HB2      GLN  48  -2.837  -3.554 -17.536
  350    HB3  GLN  48           HB3      GLN  48  -4.557  -3.774 -17.779
  351    HG2  GLN  48           HG2      GLN  48  -3.159  -5.511 -18.880
  352    HG3  GLN  48           HG3      GLN  48  -4.297  -4.698 -19.944
  353   HE21  GLN  48          HE22      GLN  48  -0.777  -4.553 -18.971
  354   HE22  GLN  48          HE21      GLN  48  -0.222  -4.034 -20.549
  355    H    ALA  49           H        ALA  49  -2.557  -0.904 -16.879
  356    HA   ALA  49           HA       ALA  49  -4.781   0.170 -15.403
  357    HB1  ALA  49           HB1      ALA  49  -3.022   1.273 -14.100
  358    HB2  ALA  49           HB2      ALA  49  -2.631  -0.448 -14.355
  359    HB3  ALA  49           HB3      ALA  49  -1.805   0.815 -15.307
  360    H    MET  50           H        MET  50  -2.694   1.447 -18.041
  361    HA   MET  50           HA       MET  50  -3.534   4.172 -17.666
  362    HB2  MET  50           HB2      MET  50  -1.493   3.684 -18.815
  363    HB3  MET  50           HB3      MET  50  -2.312   2.753 -20.059
  364    HG2  MET  50           HG2      MET  50  -2.974   5.660 -19.529
  365    HG3  MET  50           HG3      MET  50  -1.660   5.186 -20.583
  366    HE1  MET  50           HE1      MET  50  -1.753   4.401 -22.949
  367    HE2  MET  50           HE2      MET  50  -2.455   2.855 -22.419
  368    HE3  MET  50           HE3      MET  50  -3.206   3.768 -23.746
  369    H    TYR  51           H        TYR  51  -4.892   1.423 -19.592
  370    HA   TYR  51           HA       TYR  51  -7.091   3.049 -20.373
  371    HB2  TYR  51           HB2      TYR  51  -7.118   0.057 -20.041
  372    HB3  TYR  51           HB3      TYR  51  -8.273   1.074 -20.904
  373    HD1  TYR  51           HD2      TYR  51  -7.560   2.305 -23.011
  374    HD2  TYR  51           HD1      TYR  51  -4.983  -0.425 -20.971
  375    HE1  TYR  51           HE2      TYR  51  -6.282   2.000 -25.094
  376    HE2  TYR  51           HE1      TYR  51  -3.530  -0.620 -22.972
  377    HH   TYR  51           HH       TYR  51  -4.444   0.933 -26.124
  378    H    ARG  52           H        ARG  52  -6.552   1.227 -17.329
  379    HA   ARG  52           HA       ARG  52  -9.180   1.548 -16.261
  380    HB2  ARG  52           HB2      ARG  52  -7.185   0.234 -15.281
  381    HB3  ARG  52           HB3      ARG  52  -6.591   1.763 -14.665
  382    HG2  ARG  52           HG2      ARG  52  -7.683   0.851 -12.843
  383    HG3  ARG  52           HG3      ARG  52  -8.794   2.073 -13.450
  384    HD2  ARG  52           HD2      ARG  52  -9.985   0.032 -12.807
  385    HD3  ARG  52           HD3      ARG  52 -10.147   0.297 -14.553
  386    HE   ARG  52           HE       ARG  52  -7.883  -1.385 -14.126
  387   HH11  ARG  52          HH11      ARG  52 -11.399  -1.616 -13.516
  388   HH12  ARG  52          HH12      ARG  52 -11.480  -3.296 -13.895
  389   HH21  ARG  52          HH21      ARG  52  -8.046  -3.509 -14.841
  390   HH22  ARG  52          HH22      ARG  52  -9.499  -4.438 -14.584
  391    H    ALA  53           H        ALA  53  -6.307   3.769 -16.097
  392    HA   ALA  53           HA       ALA  53  -7.734   5.870 -14.763
  393    HB1  ALA  53           HB1      ALA  53  -5.315   5.695 -14.628
  394    HB2  ALA  53           HB2      ALA  53  -5.170   5.868 -16.389
  395    HB3  ALA  53           HB3      ALA  53  -5.754   7.224 -15.420
  396    H    LEU  54           H        LEU  54  -7.438   5.018 -18.192
  397    HA   LEU  54           HA       LEU  54  -8.226   7.516 -19.355
  398    HB2  LEU  54           HB2      LEU  54  -7.161   5.664 -20.580
  399    HB3  LEU  54           HB3      LEU  54  -8.484   4.612 -20.106
  400    HG   LEU  54           HG       LEU  54 -10.075   5.818 -21.539
  401   HD11  LEU  54          HD11      LEU  54  -9.139   7.377 -23.243
  402   HD12  LEU  54          HD12      LEU  54  -8.951   8.039 -21.608
  403   HD13  LEU  54          HD13      LEU  54  -7.555   7.305 -22.436
  404   HD21  LEU  54          HD21      LEU  54  -8.982   3.819 -22.161
  405   HD22  LEU  54          HD22      LEU  54  -9.168   4.871 -23.573
  406   HD23  LEU  54          HD23      LEU  54  -7.560   4.702 -22.785
  407    H    PHE  55           H        PHE  55  -9.858   4.607 -18.228
  408    HA   PHE  55           HA       PHE  55 -12.565   5.485 -18.703
  409    HB2  PHE  55           HB2      PHE  55 -12.307   3.188 -18.603
  410    HB3  PHE  55           HB3      PHE  55 -11.236   3.235 -17.224
  411    HD1  PHE  55           HD2      PHE  55 -12.009   3.451 -14.979
  412    HD2  PHE  55           HD1      PHE  55 -14.770   3.263 -18.267
  413    HE1  PHE  55           HE2      PHE  55 -13.884   3.013 -13.370
  414    HE2  PHE  55           HE1      PHE  55 -16.634   2.780 -16.684
  415    HZ   PHE  55           HZ       PHE  55 -16.189   2.657 -14.236
  416    H    GLU  56           H        GLU  56 -10.579   5.400 -15.620
  417    HA   GLU  56           HA       GLU  56 -12.604   6.620 -14.122
  418    HB2  GLU  56           HB2      GLU  56  -9.588   6.560 -13.713
  419    HB3  GLU  56           HB3      GLU  56 -10.697   7.245 -12.534
  420    HG2  GLU  56           HG2      GLU  56 -11.873   5.090 -12.319
  421    HG3  GLU  56           HG3      GLU  56 -10.732   4.345 -13.439
  422    H    GLU  57           H        GLU  57 -10.079   8.237 -16.101
  423    HA   GLU  57           HA       GLU  57 -10.881  10.822 -14.886
  424    HB2  GLU  57           HB2      GLU  57  -8.376  10.063 -16.407
  425    HB3  GLU  57           HB3      GLU  57  -8.681  11.557 -15.508
  426    HG2  GLU  57           HG2      GLU  57  -9.009  10.154 -13.426
  427    HG3  GLU  57           HG3      GLU  57  -8.442   8.744 -14.353
  428    H    VAL  58           H        VAL  58 -11.263   9.136 -17.853
  429    HA   VAL  58           HA       VAL  58 -12.025  11.673 -19.212
  430    HB   VAL  58           HB       VAL  58 -10.933   9.340 -20.774
  431   HG11  VAL  58          HG11      VAL  58 -11.999  11.306 -21.850
  432   HG12  VAL  58          HG12      VAL  58 -10.704  12.333 -21.215
  433   HG13  VAL  58          HG13      VAL  58 -10.324  11.037 -22.360
  434   HG21  VAL  58          HG21      VAL  58  -9.079   9.691 -19.165
  435   HG22  VAL  58          HG22      VAL  58  -8.634  10.369 -20.727
  436   HG23  VAL  58          HG23      VAL  58  -9.159  11.442 -19.420
  437    H    GLY  59           H        GLY  59 -12.898   8.399 -18.312
  438    HA2  GLY  59           HA2      GLY  59 -14.737   7.156 -18.674
  439    HA3  GLY  59           HA3      GLY  59 -15.621   8.629 -19.112
  440    H    LEU  60           H        LEU  60 -12.897   6.687 -20.364
  441    HA   LEU  60           HA       LEU  60 -14.225   6.170 -22.953
  442    HB2  LEU  60           HB2      LEU  60 -11.455   7.348 -22.504
  443    HB3  LEU  60           HB3      LEU  60 -11.937   6.574 -23.991
  444    HG   LEU  60           HG       LEU  60 -13.080   9.118 -22.801
  445   HD11  LEU  60          HD11      LEU  60 -11.996  10.186 -24.762
  446   HD12  LEU  60          HD12      LEU  60 -10.806   9.260 -23.840
  447   HD13  LEU  60          HD13      LEU  60 -11.478   8.612 -25.353
  448   HD21  LEU  60          HD21      LEU  60 -13.901   7.715 -25.391
  449   HD22  LEU  60          HD22      LEU  60 -14.929   8.049 -23.993
  450   HD23  LEU  60          HD23      LEU  60 -14.325   9.372 -24.983
  451    H    SER  61           H        SER  61 -13.223   4.254 -23.951
  452    HA   SER  61           HA       SER  61 -12.154   2.386 -21.875
  453    HB2  SER  61           HB2      SER  61 -14.018   1.936 -24.235
  454    HB3  SER  61           HB3      SER  61 -13.509   0.709 -23.053
  455    HG   SER  61           HG       SER  61 -15.571   1.622 -22.528
  456    H    ARG  62           H        ARG  62 -11.382   0.283 -23.263
  457    HA   ARG  62           HA       ARG  62  -8.831   1.066 -24.219
  458    HB2  ARG  62           HB2      ARG  62  -9.852  -1.781 -24.428
  459    HB3  ARG  62           HB3      ARG  62  -8.235  -1.188 -24.073
  460    HG2  ARG  62           HG2      ARG  62  -9.468  -0.280 -21.872
  461    HG3  ARG  62           HG3      ARG  62 -10.616  -1.542 -22.258
  462    HD2  ARG  62           HD2      ARG  62  -8.920  -3.258 -22.085
  463    HD3  ARG  62           HD3      ARG  62  -7.628  -2.036 -21.960
  464    HE   ARG  62           HE       ARG  62  -9.549  -1.630 -19.880
  465   HH11  ARG  62          HH12      ARG  62  -7.130  -4.085 -20.724
  466   HH12  ARG  62          HH11      ARG  62  -6.728  -4.441 -19.080
  467   HH21  ARG  62          HH21      ARG  62  -8.873  -1.987 -17.702
  468   HH22  ARG  62          HH22      ARG  62  -7.569  -3.058 -17.333
  469    H    LYS  63           H        LYS  63 -10.554   2.198 -25.980
  470    HA   LYS  63           HA       LYS  63  -9.890   1.016 -28.589
  471    HB2  LYS  63           HB2      LYS  63 -12.184   0.583 -29.252
  472    HB3  LYS  63           HB3      LYS  63 -11.761  -0.363 -27.816
  473    HG2  LYS  63           HG2      LYS  63 -13.055   1.156 -26.373
  474    HG3  LYS  63           HG3      LYS  63 -13.390   2.223 -27.738
  475    HD2  LYS  63           HD2      LYS  63 -15.337   0.891 -27.267
  476    HD3  LYS  63           HD3      LYS  63 -14.689   0.470 -28.858
  477    HE2  LYS  63           HE2      LYS  63 -13.620  -1.568 -27.885
  478    HE3  LYS  63           HE3      LYS  63 -14.242  -1.133 -26.286
  479    HZ1  LYS  63           HZ1      LYS  63 -16.501  -1.390 -27.177
  480    HZ2  LYS  63           HZ2      LYS  63 -15.920  -1.795 -28.655
  481    HZ3  LYS  63           HZ3      LYS  63 -15.651  -2.769 -27.376
  482    H    ASP  64           H        ASP  64 -11.157   3.582 -26.599
  483    HA   ASP  64           HA       ASP  64 -12.260   5.198 -28.730
  484    HB2  ASP  64           HB2      ASP  64 -11.701   5.442 -25.771
  485    HB3  ASP  64           HB3      ASP  64 -12.286   6.825 -26.677
  486    H    VAL  65           H        VAL  65  -9.071   4.624 -27.933
  487    HA   VAL  65           HA       VAL  65  -8.128   7.240 -28.879
  488    HB   VAL  65           HB       VAL  65  -6.674   7.533 -26.935
  489   HG11  VAL  65          HG11      VAL  65  -8.261   8.519 -25.468
  490   HG12  VAL  65          HG12      VAL  65  -8.973   8.614 -27.094
  491   HG13  VAL  65          HG13      VAL  65  -9.543   7.391 -25.953
  492   HG21  VAL  65          HG21      VAL  65  -7.077   6.307 -24.818
  493   HG22  VAL  65          HG22      VAL  65  -8.295   5.292 -25.616
  494   HG23  VAL  65          HG23      VAL  65  -6.599   5.170 -26.090
  495    H    ARG  66           H        ARG  66  -5.666   7.162 -29.038
  496    HA   ARG  66           HA       ARG  66  -4.696   4.530 -30.067
  497    HB2  ARG  66           HB2      ARG  66  -5.668   5.669 -31.945
  498    HB3  ARG  66           HB3      ARG  66  -5.127   7.245 -31.382
  499    HG2  ARG  66           HG2      ARG  66  -3.867   6.724 -33.273
  500    HG3  ARG  66           HG3      ARG  66  -2.796   6.641 -31.886
  501    HD2  ARG  66           HD2      ARG  66  -4.121   4.073 -32.789
  502    HD3  ARG  66           HD3      ARG  66  -2.927   4.770 -33.886
  503    HE   ARG  66           HE       ARG  66  -1.494   4.817 -31.618
  504   HH11  ARG  66          HH11      ARG  66  -3.276   2.160 -33.198
  505   HH12  ARG  66          HH12      ARG  66  -2.178   0.943 -32.652
  506   HH21  ARG  66          HH21      ARG  66  -0.059   3.255 -30.953
  507   HH22  ARG  66          HH22      ARG  66  -0.298   1.576 -31.331
  508    H    ILE  67           H        ILE  67  -2.724   4.223 -28.946
  509    HA   ILE  67           HA       ILE  67  -1.387   6.458 -27.669
  510    HB   ILE  67           HB       ILE  67  -0.472   3.601 -28.162
  511   HG12  ILE  67          HG12      ILE  67  -1.660   4.761 -25.601
  512   HG13  ILE  67          HG13      ILE  67  -2.656   3.940 -26.787
  513   HG21  ILE  67          HG21      ILE  67   1.111   4.043 -26.285
  514   HG22  ILE  67          HG22      ILE  67   1.412   5.094 -27.653
  515   HG23  ILE  67          HG23      ILE  67   0.561   5.735 -26.229
  516   HD11  ILE  67          HD11      ILE  67  -1.163   1.907 -26.583
  517   HD12  ILE  67          HD12      ILE  67  -0.344   2.712 -25.224
  518   HD13  ILE  67          HD13      ILE  67  -2.062   2.320 -25.112
  519    H    LEU  68           H        LEU  68   0.068   7.814 -28.507
  520    HA   LEU  68           HA       LEU  68   1.289   7.116 -31.169
  521    HB2  LEU  68           HB2      LEU  68   0.247   9.665 -30.019
  522    HB3  LEU  68           HB3      LEU  68   1.839   9.813 -30.736
  523    HG   LEU  68           HG       LEU  68  -0.027  10.372 -32.263
  524   HD11  LEU  68          HD11      LEU  68   2.189   9.736 -33.158
  525   HD12  LEU  68          HD12      LEU  68   1.698   8.029 -33.199
  526   HD13  LEU  68          HD13      LEU  68   0.881   9.217 -34.234
  527   HD21  LEU  68          HD21      LEU  68  -1.426   8.700 -33.249
  528   HD22  LEU  68          HD22      LEU  68  -0.586   7.386 -32.402
  529   HD23  LEU  68          HD23      LEU  68  -1.574   8.546 -31.484
  530    H    ALA  69           H        ALA  69   2.011   8.087 -27.815
  531    HA   ALA  69           HA       ALA  69   4.826   7.353 -28.138
  532    HB1  ALA  69           HB1      ALA  69   5.639   9.596 -27.476
  533    HB2  ALA  69           HB2      ALA  69   4.722   9.727 -28.989
  534    HB3  ALA  69           HB3      ALA  69   3.981  10.231 -27.468
  535    H    SER  70           H        SER  70   5.904   7.448 -25.935
  536    HA   SER  70           HA       SER  70   4.154   7.851 -23.613
  537    HB2  SER  70           HB2      SER  70   5.752   5.291 -23.795
  538    HB3  SER  70           HB3      SER  70   4.452   5.709 -22.663
  539    HG   SER  70           HG       SER  70   3.892   4.188 -24.382
  540    H    THR  71           H        THR  71   5.516   8.151 -21.597
  541    HA   THR  71           HA       THR  71   7.986   9.469 -22.198
  542    HB   THR  71           HB       THR  71   8.229   9.328 -19.606
  543    HG1  THR  71           HG1      THR  71   6.811   7.719 -19.096
  544   HG21  THR  71          HG21      THR  71   6.432  11.058 -19.313
  545   HG22  THR  71          HG22      THR  71   7.505  11.364 -20.692
  546   HG23  THR  71          HG23      THR  71   5.883  10.700 -20.969
  547    H    ARG  72           H        ARG  72  10.153   8.887 -21.610
  548    HA   ARG  72           HA       ARG  72  10.725   6.276 -22.615
  549    HB2  ARG  72           HB2      ARG  72  12.627   8.272 -21.312
  550    HB3  ARG  72           HB3      ARG  72  13.084   6.898 -22.332
  551    HG2  ARG  72           HG2      ARG  72  11.849   7.941 -24.253
  552    HG3  ARG  72           HG3      ARG  72  11.443   9.313 -23.212
  553    HD2  ARG  72           HD2      ARG  72  14.062   9.435 -22.837
  554    HD3  ARG  72           HD3      ARG  72  14.127   8.546 -24.360
  555    HE   ARG  72           HE       ARG  72  12.853  11.218 -23.835
  556   HH11  ARG  72          HH11      ARG  72  14.264   9.040 -26.284
  557   HH12  ARG  72          HH12      ARG  72  14.219  10.228 -27.539
  558   HH21  ARG  72          HH21      ARG  72  12.801  12.759 -25.433
  559   HH22  ARG  72          HH22      ARG  72  13.354  12.403 -27.043
  560    H    ASN  73           H        ASN  73  10.549   7.544 -19.340
  561    HA   ASN  73           HA       ASN  73  10.514   4.902 -18.236
  562    HB2  ASN  73           HB2      ASN  73  12.216   5.134 -16.583
  563    HB3  ASN  73           HB3      ASN  73  12.991   5.487 -18.116
  564   HD21  ASN  73          HD22      ASN  73  13.437   7.849 -18.612
  565   HD22  ASN  73          HD21      ASN  73  13.597   8.969 -17.279
  566    H    TRP  74           H        TRP  74  10.107   5.324 -15.663
  567    HA   TRP  74           HA       TRP  74   7.691   6.858 -15.544
  568    HB2  TRP  74           HB2      TRP  74   9.394   5.635 -13.332
  569    HB3  TRP  74           HB3      TRP  74   7.763   6.281 -13.151
  570    HD1  TRP  74           HD1      TRP  74   9.659   3.287 -14.609
  571    HE1  TRP  74           HE1      TRP  74   8.034   1.409 -15.181
  572    HE3  TRP  74           HE3      TRP  74   5.259   5.651 -13.485
  573    HZ2  TRP  74           HZ2      TRP  74   5.191   1.051 -15.386
  574    HZ3  TRP  74           HZ3      TRP  74   3.094   4.520 -13.916
  575    HH2  TRP  74           HH2      TRP  74   3.027   2.274 -14.955
  576    H    LEU  75           H        LEU  75   7.528   8.991 -15.332
  577    HA   LEU  75           HA       LEU  75   9.732  10.690 -14.433
  578    HB2  LEU  75           HB2      LEU  75   6.913  11.098 -15.448
  579    HB3  LEU  75           HB3      LEU  75   7.554  12.325 -14.382
  580    HG   LEU  75           HG       LEU  75   7.834  12.859 -16.762
  581   HD11  LEU  75          HD11      LEU  75  10.497  12.537 -15.296
  582   HD12  LEU  75          HD12      LEU  75  10.115  13.691 -16.590
  583   HD13  LEU  75          HD13      LEU  75   9.303  13.828 -15.020
  584   HD21  LEU  75          HD21      LEU  75   9.906  10.632 -16.858
  585   HD22  LEU  75          HD22      LEU  75   8.289  10.546 -17.578
  586   HD23  LEU  75          HD23      LEU  75   9.457  11.750 -18.168
  587    H    ARG  76           H        ARG  76   9.622  11.927 -12.456
  588    HA   ARG  76           HA       ARG  76   7.946  10.785 -10.261
  589    HB2  ARG  76           HB2      ARG  76  10.963  10.605 -10.571
  590    HB3  ARG  76           HB3      ARG  76  10.217  10.619  -8.974
  591    HG2  ARG  76           HG2      ARG  76   9.181   8.566  -9.227
  592    HG3  ARG  76           HG3      ARG  76   9.196   8.594 -10.986
  593    HD2  ARG  76           HD2      ARG  76  11.727   8.452  -9.366
  594    HD3  ARG  76           HD3      ARG  76  10.811   7.016  -9.880
  595    HE   ARG  76           HE       ARG  76  11.082   8.125 -12.261
  596   HH11  ARG  76          HH11      ARG  76  13.592   7.834  -9.744
  597   HH12  ARG  76          HH12      ARG  76  14.893   7.723 -10.876
  598   HH21  ARG  76          HH21      ARG  76  12.800   7.874 -13.755
  599   HH22  ARG  76          HH22      ARG  76  14.432   7.784 -13.191
  600    H    TYR  77           H        TYR  77   7.413  12.391  -8.801
  601    HA   TYR  77           HA       TYR  77   9.252  14.588  -8.340
  602    HB2  TYR  77           HB2      TYR  77   7.640  16.378  -8.697
  603    HB3  TYR  77           HB3      TYR  77   8.000  15.533 -10.181
  604    HD1  TYR  77           HD1      TYR  77   5.430  15.756  -7.437
  605    HD2  TYR  77           HD2      TYR  77   6.205  14.795 -11.567
  606    HE1  TYR  77           HE1      TYR  77   3.022  15.527  -7.821
  607    HE2  TYR  77           HE2      TYR  77   3.795  14.619 -11.990
  608    HH   TYR  77           HH       TYR  77   1.615  14.795 -11.059
  609    H    LYS  78           H        LYS  78   8.561  15.820  -6.413
  610    HA   LYS  78           HA       LYS  78   7.107  14.009  -4.576
  611    HB2  LYS  78           HB2      LYS  78   9.158  16.177  -4.049
  612    HB3  LYS  78           HB3      LYS  78   8.116  15.504  -2.785
  613    HG2  LYS  78           HG2      LYS  78   8.917  13.168  -3.593
  614    HG3  LYS  78           HG3      LYS  78  10.222  14.041  -4.412
  615    HD2  LYS  78           HD2      LYS  78   9.524  14.212  -1.443
  616    HD3  LYS  78           HD3      LYS  78  10.792  13.175  -2.125
  617    HE2  LYS  78           HE2      LYS  78  11.951  15.204  -3.034
  618    HE3  LYS  78           HE3      LYS  78  10.728  16.232  -2.271
  619    HZ1  LYS  78           HZ1      LYS  78  12.604  14.437  -0.822
  620    HZ2  LYS  78           HZ2      LYS  78  12.709  16.060  -0.905
  621    HZ3  LYS  78           HZ3      LYS  78  11.463  15.377  -0.104
  622    H    LEU  79           H        LEU  79   5.747  14.881  -3.023
  623    HA   LEU  79           HA       LEU  79   3.988  17.073  -4.001
  624    HB2  LEU  79           HB2      LEU  79   3.646  15.063  -1.737
  625    HB3  LEU  79           HB3      LEU  79   2.447  16.263  -2.196
  626    HG   LEU  79           HG       LEU  79   3.378  13.917  -3.902
  627   HD11  LEU  79          HD11      LEU  79   2.105  13.153  -1.973
  628   HD12  LEU  79          HD12      LEU  79   0.800  14.305  -2.335
  629   HD13  LEU  79          HD13      LEU  79   1.147  12.950  -3.438
  630   HD21  LEU  79          HD21      LEU  79   2.636  15.746  -5.340
  631   HD22  LEU  79          HD22      LEU  79   1.438  14.443  -5.353
  632   HD23  LEU  79          HD23      LEU  79   1.132  15.907  -4.396
  633    HA   PRO  80           HA       PRO  80   5.912  19.653  -0.796
  634    HB2  PRO  80           HB2      PRO  80   4.001  21.550  -0.380
  635    HB3  PRO  80           HB3      PRO  80   4.869  21.437  -1.942
  636    HG2  PRO  80           HG2      PRO  80   2.206  20.144  -1.216
  637    HG3  PRO  80           HG3      PRO  80   2.534  21.272  -2.602
  638    HD2  PRO  80           HD2      PRO  80   2.591  18.613  -2.979
  639    HD3  PRO  80           HD3      PRO  80   3.873  19.631  -3.697
  640    H    LYS  81           H        LYS  81   5.747  19.874   1.595
  641    HA   LYS  81           HA       LYS  81   4.507  17.604   2.606
  642    HB2  LYS  81           HB2      LYS  81   5.277  18.189   4.792
  643    HB3  LYS  81           HB3      LYS  81   6.529  18.512   3.595
  644    HG2  LYS  81           HG2      LYS  81   6.181  20.891   3.747
  645    HG3  LYS  81           HG3      LYS  81   4.706  20.708   4.703
  646    HD2  LYS  81           HD2      LYS  81   7.427  19.733   5.647
  647    HD3  LYS  81           HD3      LYS  81   6.790  21.354   5.992
  648    HE2  LYS  81           HE2      LYS  81   4.797  20.305   7.098
  649    HE3  LYS  81           HE3      LYS  81   5.512  18.710   6.834
  650    HZ1  LYS  81           HZ1      LYS  81   6.728  20.858   8.483
  651    HZ2  LYS  81           HZ2      LYS  81   5.984  19.521   9.053
  652    HZ3  LYS  81           HZ3      LYS  81   7.385  19.375   8.233
  653    H    ARG  82           H        ARG  82   3.019  20.671   2.338
  654    HA   ARG  82           HA       ARG  82   0.934  20.214   4.271
  655    HB2  ARG  82           HB2      ARG  82  -0.099  22.189   3.346
  656    HB3  ARG  82           HB3      ARG  82   1.632  22.446   3.514
  657    HG2  ARG  82           HG2      ARG  82   1.601  21.649   0.901
  658    HG3  ARG  82           HG3      ARG  82  -0.071  22.180   1.033
  659    HD2  ARG  82           HD2      ARG  82   1.235  24.020   0.217
  660    HD3  ARG  82           HD3      ARG  82   0.776  24.396   1.889
  661    HE   ARG  82           HE       ARG  82   3.343  23.067   1.800
  662   HH11  ARG  82          HH21      ARG  82   1.855  26.215   1.076
  663   HH12  ARG  82          HH22      ARG  82   3.284  27.132   1.389
  664   HH21  ARG  82          HH11      ARG  82   5.270  24.290   2.213
  665   HH22  ARG  82          HH12      ARG  82   5.272  26.002   2.022
  666    H    LEU  83           H        LEU  83   1.457  19.163   0.966
  667    HA   LEU  83           HA       LEU  83  -1.357  18.294   0.683
  668    HB2  LEU  83           HB2      LEU  83  -0.198  19.563  -1.157
  669    HB3  LEU  83           HB3      LEU  83   0.932  18.209  -1.313
  670    HG   LEU  83           HG       LEU  83  -0.903  16.718  -2.004
  671   HD11  LEU  83          HD11      LEU  83  -3.150  17.704  -2.547
  672   HD12  LEU  83          HD12      LEU  83  -2.834  17.654  -0.815
  673   HD13  LEU  83          HD13      LEU  83  -2.669  19.191  -1.694
  674   HD21  LEU  83          HD21      LEU  83  -1.335  17.772  -4.186
  675   HD22  LEU  83          HD22      LEU  83  -0.835  19.351  -3.532
  676   HD23  LEU  83          HD23      LEU  83   0.345  18.030  -3.671
  677    H    VAL  84           H        VAL  84   1.916  17.074   1.190
  678    HA   VAL  84           HA       VAL  84   1.435  14.289   0.916
  679    HB   VAL  84           HB       VAL  84   3.208  15.803   2.874
  680   HG11  VAL  84          HG11      VAL  84   3.236  12.816   2.260
  681   HG12  VAL  84          HG12      VAL  84   4.477  13.696   3.174
  682   HG13  VAL  84          HG13      VAL  84   2.846  13.567   3.819
  683   HG21  VAL  84          HG21      VAL  84   5.035  15.222   1.374
  684   HG22  VAL  84          HG22      VAL  84   3.948  14.259   0.354
  685   HG23  VAL  84          HG23      VAL  84   3.785  16.025   0.430
  686    H    ARG  85           H        ARG  85   0.284  12.893   2.091
  687    HA   ARG  85           HA       ARG  85  -1.715  13.941   3.917
  688    HB2  ARG  85           HB2      ARG  85  -1.088  11.235   2.673
  689    HB3  ARG  85           HB3      ARG  85  -2.104  11.253   4.097
  690    HG2  ARG  85           HG2      ARG  85  -3.475  11.247   2.137
  691    HG3  ARG  85           HG3      ARG  85  -3.707  12.704   3.104
  692    HD2  ARG  85           HD2      ARG  85  -3.752  13.435   0.882
  693    HD3  ARG  85           HD3      ARG  85  -2.173  13.926   1.487
  694    HE   ARG  85           HE       ARG  85  -1.961  11.336   0.251
  695   HH11  ARG  85          HH11      ARG  85  -2.055  14.748  -0.607
  696   HH12  ARG  85          HH12      ARG  85  -2.202  14.483  -2.323
  697   HH21  ARG  85          HH21      ARG  85  -2.078  10.943  -2.039
  698   HH22  ARG  85          HH22      ARG  85  -1.983  12.267  -3.146
  699    H    TRP  86           H        TRP  86   1.114  11.946   4.380
  700    HA   TRP  86           HA       TRP  86   2.176  10.992   6.129
  701    HB2  TRP  86           HB2      TRP  86   0.857  13.055   7.880
  702    HB3  TRP  86           HB3      TRP  86   2.298  12.124   8.239
  703    HD1  TRP  86           HD1      TRP  86   1.102  15.049   6.123
  704    HE1  TRP  86           HE1      TRP  86   3.068  16.446   5.296
  705    HE3  TRP  86           HE3      TRP  86   4.878  11.988   7.681
  706    HZ2  TRP  86           HZ2      TRP  86   5.995  16.133   5.163
  707    HZ3  TRP  86           HZ3      TRP  86   7.241  12.544   7.176
  708    HH2  TRP  86           HH2      TRP  86   7.807  14.604   5.910
  709    H    ASP  87           H        ASP  87  -0.992  10.593   5.677
  710    HA   ASP  87           HA       ASP  87  -1.452   8.803   8.024
  711    HB2  ASP  87           HB2      ASP  87  -3.172  10.483   7.518
  712    HB3  ASP  87           HB3      ASP  87  -3.333   9.845   5.883
  713    H    THR  88           H        THR  88  -0.555   8.713   4.655
  714    HA   THR  88           HA       THR  88  -1.521   6.054   4.082
  715    HB   THR  88           HB       THR  88   0.018   6.651   1.997
  716    HG1  THR  88           HG1      THR  88  -0.271   9.165   1.948
  717   HG21  THR  88          HG21      THR  88  -1.833   7.915   1.000
  718   HG22  THR  88          HG22      THR  88  -2.460   6.589   1.979
  719   HG23  THR  88          HG23      THR  88  -2.508   8.246   2.619
  720    H    LYS  89           H        LYS  89  -0.044   4.297   3.676
  721    HA   LYS  89           HA       LYS  89   2.665   4.502   4.891
  722    HB2  LYS  89           HB2      LYS  89   0.538   2.515   5.715
  723    HB3  LYS  89           HB3      LYS  89   2.277   2.267   5.974
  724    HG2  LYS  89           HG2      LYS  89   2.402   4.394   7.257
  725    HG3  LYS  89           HG3      LYS  89   0.672   4.657   6.997
  726    HD2  LYS  89           HD2      LYS  89   1.014   3.854   9.204
  727    HD3  LYS  89           HD3      LYS  89   0.132   2.635   8.265
  728    HE2  LYS  89           HE2      LYS  89   2.224   1.324   7.990
  729    HE3  LYS  89           HE3      LYS  89   3.136   2.580   8.850
  730    HZ1  LYS  89           HZ1      LYS  89   1.804   2.074  10.829
  731    HZ2  LYS  89           HZ2      LYS  89   0.986   0.901  10.026
  732    HZ3  LYS  89           HZ3      LYS  89   2.585   0.741  10.306
  733    HA   PRO  90           HA       PRO  90   4.746   4.184   3.999
  734    HB2  PRO  90           HB2      PRO  90   5.204   4.605   1.045
  735    HB3  PRO  90           HB3      PRO  90   6.410   4.408   2.357
  736    HG2  PRO  90           HG2      PRO  90   5.827   2.343   0.696
  737    HG3  PRO  90           HG3      PRO  90   6.018   2.060   2.459
  738    HD2  PRO  90           HD2      PRO  90   3.460   2.319   0.875
  739    HD3  PRO  90           HD3      PRO  90   3.853   1.195   2.199
  740    H    VAL  91           H        VAL  91   4.814   6.467   4.240
  741    HA   VAL  91           HA       VAL  91   2.625   8.112   3.671
  742    HB   VAL  91           HB       VAL  91   5.546   8.722   4.323
  743   HG11  VAL  91          HG11      VAL  91   3.189  10.638   4.156
  744   HG12  VAL  91          HG12      VAL  91   4.727  11.007   4.975
  745   HG13  VAL  91          HG13      VAL  91   4.706  10.708   3.239
  746   HG21  VAL  91          HG21      VAL  91   4.346   7.557   6.139
  747   HG22  VAL  91          HG22      VAL  91   4.651   9.235   6.581
  748   HG23  VAL  91          HG23      VAL  91   3.030   8.736   6.049
  749    H    CYS  92           H        CYS  92   2.043   9.154   1.912
  750    HA   CYS  92           HA       CYS  92   3.419   8.532  -0.554
  751    HB2  CYS  92           HB2      CYS  92   1.035   8.397  -0.247
  752    HB3  CYS  92           HB3      CYS  92   0.933  10.158   0.042
  753    HG   CYS  92           HG       CYS  92   0.070   9.569  -2.411
  754    H    ILE  93           H        ILE  93   5.323   9.595  -0.752
  755    HA   ILE  93           HA       ILE  93   5.587  12.449  -0.091
  756    HB   ILE  93           HB       ILE  93   7.962  12.138  -0.399
  757   HG12  ILE  93          HG12      ILE  93   7.253   9.385  -1.451
  758   HG13  ILE  93          HG13      ILE  93   8.157  10.648  -2.254
  759   HG21  ILE  93          HG21      ILE  93   6.832  11.525   1.755
  760   HG22  ILE  93          HG22      ILE  93   6.939   9.817   1.265
  761   HG23  ILE  93          HG23      ILE  93   8.406  10.774   1.503
  762   HD11  ILE  93          HD11      ILE  93   9.099   8.925   0.083
  763   HD12  ILE  93          HD12      ILE  93   9.634   8.849  -1.591
  764   HD13  ILE  93          HD13      ILE  93  10.031  10.285  -0.621
  765    H    GLY  94           H        GLY  94   4.828  10.599  -2.975
  766    HA2  GLY  94           HA2      GLY  94   5.138  12.929  -4.696
  767    HA3  GLY  94           HA3      GLY  94   6.434  11.750  -4.881
  768    H    GLN  95           H        GLN  95   5.045  12.173  -7.108
  769    HA   GLN  95           HA       GLN  95   3.149   9.845  -7.318
  770    HB2  GLN  95           HB2      GLN  95   3.453  12.266  -9.149
  771    HB3  GLN  95           HB3      GLN  95   2.467  10.865  -9.473
  772    HG2  GLN  95           HG2      GLN  95   1.919  13.077  -7.526
  773    HG3  GLN  95           HG3      GLN  95   0.977  12.511  -8.923
  774   HE21  GLN  95          HE22      GLN  95   1.726  11.806  -5.466
  775   HE22  GLN  95          HE21      GLN  95   0.328  10.801  -5.246
  776    H    LYS  96           H        LYS  96   3.943   8.125  -8.492
  777    HA   LYS  96           HA       LYS  96   6.428   8.494 -10.152
  778    HB2  LYS  96           HB2      LYS  96   6.855   6.699  -8.689
  779    HB3  LYS  96           HB3      LYS  96   5.180   6.136  -8.674
  780    HG2  LYS  96           HG2      LYS  96   5.430   5.268 -10.966
  781    HG3  LYS  96           HG3      LYS  96   7.093   5.901 -11.034
  782    HD2  LYS  96           HD2      LYS  96   7.820   4.380  -9.306
  783    HD3  LYS  96           HD3      LYS  96   6.149   3.875  -8.972
  784    HE2  LYS  96           HE2      LYS  96   5.950   2.878 -11.221
  785    HE3  LYS  96           HE3      LYS  96   7.574   3.427 -11.647
  786    HZ1  LYS  96           HZ1      LYS  96   7.068   1.587  -9.363
  787    HZ2  LYS  96           HZ2      LYS  96   7.430   1.057 -10.887
  788    HZ3  LYS  96           HZ3      LYS  96   8.511   1.942 -10.037
  789    H    GLN  97           H        GLN  97   5.812   8.914 -12.311
  790    HA   GLN  97           HA       GLN  97   3.175   7.863 -13.141
  791    HB2  GLN  97           HB2      GLN  97   3.330  10.385 -14.357
  792    HB3  GLN  97           HB3      GLN  97   2.160   9.754 -13.249
  793    HG2  GLN  97           HG2      GLN  97   2.745  11.757 -12.277
  794    HG3  GLN  97           HG3      GLN  97   3.648  10.599 -11.330
  795   HE21  GLN  97          HE22      GLN  97   5.694  11.487 -10.802
  796   HE22  GLN  97          HE21      GLN  97   6.608  12.469 -11.926
  797    H    LYS  98           H        LYS  98   3.115   6.936 -15.053
  798    HA   LYS  98           HA       LYS  98   5.268   7.613 -17.027
  799    HB2  LYS  98           HB2      LYS  98   5.320   5.237 -16.543
  800    HB3  LYS  98           HB3      LYS  98   3.568   5.091 -16.762
  801    HG2  LYS  98           HG2      LYS  98   3.796   5.654 -19.147
  802    HG3  LYS  98           HG3      LYS  98   5.531   5.905 -18.960
  803    HD2  LYS  98           HD2      LYS  98   4.131   3.252 -18.413
  804    HD3  LYS  98           HD3      LYS  98   4.806   3.713 -19.983
  805    HE2  LYS  98           HE2      LYS  98   7.055   4.032 -18.895
  806    HE3  LYS  98           HE3      LYS  98   6.384   3.421 -17.379
  807    HZ1  LYS  98           HZ1      LYS  98   5.941   1.295 -18.530
  808    HZ2  LYS  98           HZ2      LYS  98   6.565   1.884 -19.929
  809    HZ3  LYS  98           HZ3      LYS  98   7.527   1.678 -18.634
  810    H    TRP  99           H        TRP  99   4.529   8.731 -18.787
  811    HA   TRP  99           HA       TRP  99   1.605   9.323 -18.824
  812    HB2  TRP  99           HB2      TRP  99   3.959  10.941 -19.814
  813    HB3  TRP  99           HB3      TRP  99   2.270  11.347 -20.072
  814    HD1  TRP  99           HD1      TRP  99   4.870  11.149 -17.254
  815    HE1  TRP  99           HE1      TRP  99   4.116  12.617 -15.314
  816    HE3  TRP  99           HE3      TRP  99   0.172  12.292 -18.907
  817    HZ2  TRP  99           HZ2      TRP  99   1.753  14.207 -14.618
  818    HZ3  TRP  99           HZ3      TRP  99  -1.362  13.667 -17.519
  819    HH2  TRP  99           HH2      TRP  99  -0.593  14.546 -15.331
  820    H    PHE 100           H        PHE 100   0.479   8.777 -20.594
  821    HA   PHE 100           HA       PHE 100   1.943   7.651 -22.956
  822    HB2  PHE 100           HB2      PHE 100  -0.778   6.925 -21.824
  823    HB3  PHE 100           HB3      PHE 100  -0.182   6.439 -23.401
  824    HD1  PHE 100           HD2      PHE 100   0.518   6.058 -19.714
  825    HD2  PHE 100           HD1      PHE 100   1.217   4.567 -23.702
  826    HE1  PHE 100           HE2      PHE 100   1.445   3.962 -18.779
  827    HE2  PHE 100           HE1      PHE 100   2.183   2.497 -22.756
  828    HZ   PHE 100           HZ       PHE 100   2.271   2.170 -20.290
  829    H    LEU 101           H        LEU 101   1.641   8.784 -24.782
  830    HA   LEU 101           HA       LEU 101  -0.107  11.156 -24.804
  831    HB2  LEU 101           HB2      LEU 101   2.239  11.262 -25.712
  832    HB3  LEU 101           HB3      LEU 101   1.794  10.026 -26.883
  833    HG   LEU 101           HG       LEU 101  -0.018  11.601 -27.764
  834   HD11  LEU 101          HD11      LEU 101   0.434  14.029 -27.240
  835   HD12  LEU 101          HD12      LEU 101  -0.277  13.118 -25.907
  836   HD13  LEU 101          HD13      LEU 101   1.457  13.507 -25.895
  837   HD21  LEU 101          HD21      LEU 101   2.108  11.258 -28.929
  838   HD22  LEU 101          HD22      LEU 101   1.572  12.937 -29.075
  839   HD23  LEU 101          HD23      LEU 101   2.886  12.508 -27.947
  840    H    LEU 102           H        LEU 102  -2.181  10.800 -25.321
  841    HA   LEU 102           HA       LEU 102  -2.862   8.527 -27.127
  842    HB2  LEU 102           HB2      LEU 102  -4.205   9.734 -24.683
  843    HB3  LEU 102           HB3      LEU 102  -5.205   9.045 -25.942
  844    HG   LEU 102           HG       LEU 102  -4.896   7.390 -24.281
  845   HD11  LEU 102          HD11      LEU 102  -3.013   6.460 -26.428
  846   HD12  LEU 102          HD12      LEU 102  -4.349   5.588 -25.672
  847   HD13  LEU 102          HD13      LEU 102  -4.635   6.884 -26.882
  848   HD21  LEU 102          HD21      LEU 102  -2.765   6.477 -23.605
  849   HD22  LEU 102          HD22      LEU 102  -1.884   7.517 -24.729
  850   HD23  LEU 102          HD23      LEU 102  -2.720   8.218 -23.328
  851    H    GLN 103           H        GLN 103  -3.621   8.993 -29.040
  852    HA   GLN 103           HA       GLN 103  -4.653  11.753 -29.548
  853    HB2  GLN 103           HB2      GLN 103  -4.020   9.389 -31.372
  854    HB3  GLN 103           HB3      GLN 103  -4.933  10.798 -31.925
  855    HG2  GLN 103           HG2      GLN 103  -2.123  10.876 -30.733
  856    HG3  GLN 103           HG3      GLN 103  -2.508  10.969 -32.454
  857   HE21  GLN 103          HE22      GLN 103  -1.097  12.967 -30.664
  858   HE22  GLN 103          HE21      GLN 103  -2.055  14.435 -30.909
  859    H    LEU 104           H        LEU 104  -6.822  12.141 -29.604
  860    HA   LEU 104           HA       LEU 104  -8.679  10.102 -28.776
  861    HB2  LEU 104           HB2      LEU 104  -9.125  12.747 -30.227
  862    HB3  LEU 104           HB3      LEU 104 -10.465  11.700 -29.750
  863    HG   LEU 104           HG       LEU 104  -8.400  12.773 -27.854
  864   HD11  LEU 104          HD11      LEU 104 -10.158  14.319 -27.015
  865   HD12  LEU 104          HD12      LEU 104  -9.665  14.634 -28.685
  866   HD13  LEU 104          HD13      LEU 104 -11.204  13.824 -28.361
  867   HD21  LEU 104          HD21      LEU 104 -10.304  12.124 -26.155
  868   HD22  LEU 104          HD22      LEU 104 -10.815  11.022 -27.458
  869   HD23  LEU 104          HD23      LEU 104  -9.194  10.899 -26.763
  870    H    VAL 105           H        VAL 105  -9.906   8.642 -29.793
  871    HA   VAL 105           HA       VAL 105  -9.921   8.609 -32.777
  872    HB   VAL 105           HB       VAL 105 -10.166   6.326 -30.787
  873   HG11  VAL 105          HG11      VAL 105 -10.194   4.819 -32.732
  874   HG12  VAL 105          HG12      VAL 105 -11.639   5.822 -32.614
  875   HG13  VAL 105          HG13      VAL 105 -10.377   6.229 -33.805
  876   HG21  VAL 105          HG21      VAL 105  -8.037   6.869 -32.889
  877   HG22  VAL 105          HG22      VAL 105  -7.818   7.137 -31.147
  878   HG23  VAL 105          HG23      VAL 105  -8.094   5.502 -31.757
  879    H    SER 106           H        SER 106 -11.795   8.778 -29.744
  880    HA   SER 106           HA       SER 106 -14.243   9.169 -31.449
  881    HB2  SER 106           HB2      SER 106 -15.532   8.451 -29.467
  882    HB3  SER 106           HB3      SER 106 -14.518   7.176 -30.174
  883    HG   SER 106           HG       SER 106 -14.221   7.092 -28.020
  884    H    GLY 107           H        GLY 107 -13.174  10.016 -28.148
  885    HA2  GLY 107           HA2      GLY 107 -12.615  12.185 -27.320
  886    HA3  GLY 107           HA3      GLY 107 -13.069  12.864 -28.896
  887    H    ASP 108           H        ASP 108 -14.317  14.483 -28.014
  888    HA   ASP 108           HA       ASP 108 -15.911  14.639 -25.881
  889    HB2  ASP 108           HB2      ASP 108 -15.467  16.531 -27.276
  890    HB3  ASP 108           HB3      ASP 108 -16.267  15.792 -28.664
  891    H    ALA 109           H        ALA 109 -16.919  13.170 -28.978
  892    HA   ALA 109           HA       ALA 109 -19.685  13.082 -28.436
  893    HB1  ALA 109           HB1      ALA 109 -18.714  12.840 -30.697
  894    HB2  ALA 109           HB2      ALA 109 -18.006  11.271 -30.233
  895    HB3  ALA 109           HB3      ALA 109 -19.768  11.471 -30.311
  896    H    GLU 110           H        GLU 110 -17.119  11.012 -27.236
  897    HA   GLU 110           HA       GLU 110 -19.090   9.116 -26.127
  898    HB2  GLU 110           HB2      GLU 110 -16.299   8.558 -27.171
  899    HB3  GLU 110           HB3      GLU 110 -17.273   7.392 -26.283
  900    HG2  GLU 110           HG2      GLU 110 -17.942   8.606 -28.999
  901    HG3  GLU 110           HG3      GLU 110 -17.383   6.966 -28.690
  902    H    ILE 111           H        ILE 111 -16.513  11.328 -25.480
  903    HA   ILE 111           HA       ILE 111 -15.565  10.334 -23.005
  904    HB   ILE 111           HB       ILE 111 -15.744  13.023 -24.333
  905   HG12  ILE 111          HG12      ILE 111 -13.545  11.240 -23.296
  906   HG13  ILE 111          HG13      ILE 111 -13.936  11.585 -24.967
  907   HG21  ILE 111          HG21      ILE 111 -14.750  14.207 -22.496
  908   HG22  ILE 111          HG22      ILE 111 -16.241  13.523 -21.911
  909   HG23  ILE 111          HG23      ILE 111 -14.707  12.735 -21.485
  910   HD11  ILE 111          HD11      ILE 111 -11.927  12.762 -24.457
  911   HD12  ILE 111          HD12      ILE 111 -13.220  13.979 -24.554
  912   HD13  ILE 111          HD13      ILE 111 -12.591  13.436 -22.971
  913    H    ASN 112           H        ASN 112 -16.178  10.632 -20.959
  914    HA   ASN 112           HA       ASN 112 -18.952  11.602 -20.402
  915    HB2  ASN 112           HB2      ASN 112 -19.159   9.221 -20.747
  916    HB3  ASN 112           HB3      ASN 112 -17.769   8.874 -19.731
  917   HD21  ASN 112          HD22      ASN 112 -20.136   7.515 -19.223
  918   HD22  ASN 112          HD21      ASN 112 -20.775   8.103 -17.703
  919    H    MET 113           H        MET 113 -15.808  10.506 -19.122
  920    HA   MET 113           HA       MET 113 -14.656  10.906 -17.295
  921    HB2  MET 113           HB2      MET 113 -15.824  13.691 -17.086
  922    HB3  MET 113           HB3      MET 113 -14.228  13.082 -16.638
  923    HG2  MET 113           HG2      MET 113 -13.976  12.568 -19.163
  924    HG3  MET 113           HG3      MET 113 -15.288  13.741 -19.363
  925    HE1  MET 113           HE1      MET 113 -11.876  15.470 -20.455
  926    HE2  MET 113           HE2      MET 113 -12.392  13.768 -20.621
  927    HE3  MET 113           HE3      MET 113 -13.526  15.085 -20.969
  928    H    GLN 114           H        GLN 114 -18.012  10.547 -16.774
  929    HA   GLN 114           HA       GLN 114 -17.499  10.507 -13.853
  930    HB2  GLN 114           HB2      GLN 114 -19.991  11.504 -15.276
  931    HB3  GLN 114           HB3      GLN 114 -19.935  11.082 -13.551
  932    HG2  GLN 114           HG2      GLN 114 -18.051  12.669 -13.221
  933    HG3  GLN 114           HG3      GLN 114 -18.184  13.173 -14.903
  934   HE21  GLN 114          HE22      GLN 114 -18.246  15.051 -13.088
  935   HE22  GLN 114          HE21      GLN 114 -19.828  15.816 -13.052
  936    H    THR 115           H        THR 115 -17.114   8.539 -15.910
  937    HA   THR 115           HA       THR 115 -18.857   6.322 -15.740
  938    HB   THR 115           HB       THR 115 -16.320   5.331 -16.097
  939    HG1  THR 115           HG1      THR 115 -14.934   6.938 -16.292
  940   HG21  THR 115          HG21      THR 115 -16.590   5.722 -18.495
  941   HG22  THR 115          HG22      THR 115 -18.185   5.373 -17.807
  942   HG23  THR 115          HG23      THR 115 -17.724   7.055 -18.175
  943    H    SER 116           H        SER 116 -16.189   7.502 -13.640
  944    HA   SER 116           HA       SER 116 -16.154   5.271 -11.908
  945    HB2  SER 116           HB2      SER 116 -15.102   7.825 -10.886
  946    HB3  SER 116           HB3      SER 116 -14.260   6.285 -11.183
  947    HG   SER 116           HG       SER 116 -13.599   8.110 -12.566
  948    H    SER 117           H        SER 117 -18.609   7.321 -12.192
  949    HA   SER 117           HA       SER 117 -20.452   7.860 -11.126
  950    HB2  SER 117           HB2      SER 117 -19.536   6.224  -8.749
  951    HB3  SER 117           HB3      SER 117 -21.175   6.774  -9.117
  952    HG   SER 117           HG       SER 117 -20.832   4.597  -9.785
  953    H    THR 118           H        THR 118 -17.620   8.275  -8.943
  954    HA   THR 118           HA       THR 118 -18.593  11.041  -8.421
  955    HB   THR 118           HB       THR 118 -17.758  10.700  -6.025
  956    HG1  THR 118           HG1      THR 118 -16.665   8.766  -6.130
  957   HG21  THR 118          HG21      THR 118 -20.162  10.777  -6.628
  958   HG22  THR 118          HG22      THR 118 -20.156   9.011  -6.833
  959   HG23  THR 118          HG23      THR 118 -19.816   9.726  -5.246
  960    HA   PRO 119           HA       PRO 119 -13.928  11.061  -9.203
  961    HB2  PRO 119           HB2      PRO 119 -13.534  11.448 -11.832
  962    HB3  PRO 119           HB3      PRO 119 -13.807   9.803 -11.184
  963    HG2  PRO 119           HG2      PRO 119 -15.841  11.698 -12.420
  964    HG3  PRO 119           HG3      PRO 119 -15.556   9.973 -12.829
  965    HD2  PRO 119           HD2      PRO 119 -17.524  10.832 -11.092
  966    HD3  PRO 119           HD3      PRO 119 -16.698   9.255 -10.941
  967    H    GLU 120           H        GLU 120 -12.802  13.003  -9.638
  968    HA   GLU 120           HA       GLU 120 -14.008  15.373  -8.960
  969    HB2  GLU 120           HB2      GLU 120 -11.421  14.698 -10.435
  970    HB3  GLU 120           HB3      GLU 120 -11.833  16.348 -10.004
  971    HG2  GLU 120           HG2      GLU 120 -10.381  15.460  -8.304
  972    HG3  GLU 120           HG3      GLU 120 -11.976  15.798  -7.637
  973    H    PHE 121           H        PHE 121 -13.465  14.174 -12.278
  974    HA   PHE 121           HA       PHE 121 -13.697  16.775 -13.435
  975    HB2  PHE 121           HB2      PHE 121 -13.784  14.045 -14.715
  976    HB3  PHE 121           HB3      PHE 121 -13.504  15.572 -15.565
  977    HD1  PHE 121           HD2      PHE 121 -11.482  17.037 -14.649
  978    HD2  PHE 121           HD1      PHE 121 -11.921  12.802 -13.931
  979    HE1  PHE 121           HE2      PHE 121  -9.064  16.865 -14.172
  980    HE2  PHE 121           HE1      PHE 121  -9.504  12.650 -13.390
  981    HZ   PHE 121           HZ       PHE 121  -8.064  14.671 -13.523
  982    H    ASP 122           H        ASP 122 -15.282  17.738 -14.601
  983    HA   ASP 122           HA       ASP 122 -17.998  16.521 -14.720
  984    HB2  ASP 122           HB2      ASP 122 -17.626  17.675 -12.560
  985    HB3  ASP 122           HB3      ASP 122 -17.259  19.165 -13.422
  986    H    GLY 123           H        GLY 123 -15.600  18.306 -16.396
  987    HA2  GLY 123           HA2      GLY 123 -17.247  18.504 -18.704
  988    HA3  GLY 123           HA3      GLY 123 -17.003  20.122 -18.011
  989    H    TRP 124           H        TRP 124 -15.980  19.373 -20.544
  990    HA   TRP 124           HA       TRP 124 -13.059  19.567 -20.008
  991    HB2  TRP 124           HB2      TRP 124 -12.788  18.042 -21.994
  992    HB3  TRP 124           HB3      TRP 124 -13.372  17.328 -20.498
  993    HD1  TRP 124           HD1      TRP 124 -14.482  18.065 -24.065
  994    HE1  TRP 124           HE1      TRP 124 -16.737  16.968 -24.566
  995    HE3  TRP 124           HE3      TRP 124 -15.603  16.355 -19.368
  996    HZ2  TRP 124           HZ2      TRP 124 -18.743  15.455 -23.128
  997    HZ3  TRP 124           HZ3      TRP 124 -17.713  15.126 -18.955
  998    HH2  TRP 124           HH2      TRP 124 -19.292  14.668 -20.821
  999    H    ARG 125           H        ARG 125 -11.858  20.618 -21.484
 1000    HA   ARG 125           HA       ARG 125 -13.017  21.870 -23.882
 1001    HB2  ARG 125           HB2      ARG 125 -13.545  23.527 -22.157
 1002    HB3  ARG 125           HB3      ARG 125 -11.908  23.416 -21.493
 1003    HG2  ARG 125           HG2      ARG 125 -10.970  24.483 -23.500
 1004    HG3  ARG 125           HG3      ARG 125 -12.562  24.469 -24.280
 1005    HD2  ARG 125           HD2      ARG 125 -12.026  26.691 -23.382
 1006    HD3  ARG 125           HD3      ARG 125 -13.447  25.995 -22.585
 1007    HE   ARG 125           HE       ARG 125 -11.039  25.407 -21.110
 1008   HH11  ARG 125          HH11      ARG 125 -13.214  28.123 -21.811
 1009   HH12  ARG 125          HH12      ARG 125 -12.981  28.898 -20.282
 1010   HH21  ARG 125          HH21      ARG 125 -10.831  26.365 -19.015
 1011   HH22  ARG 125          HH22      ARG 125 -11.556  27.889 -18.680
 1012    H    TRP 126           H        TRP 126 -11.364  21.656 -25.496
 1013    HA   TRP 126           HA       TRP 126  -8.711  20.868 -24.534
 1014    HB2  TRP 126           HB2      TRP 126  -9.489  21.318 -27.410
 1015    HB3  TRP 126           HB3      TRP 126  -8.220  20.287 -26.748
 1016    HD1  TRP 126           HD1      TRP 126 -11.253  19.834 -28.444
 1017    HE1  TRP 126           HE1      TRP 126 -12.721  17.896 -27.703
 1018    HE3  TRP 126           HE3      TRP 126  -8.986  18.773 -23.969
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.979  16.172 -25.396
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.955  17.060 -22.467
 1021    HH2  TRP 126           HH2      TRP 126 -11.958  15.784 -23.143
 1022    H    VAL 127           H        VAL 127  -6.882  22.092 -24.603
 1023    HA   VAL 127           HA       VAL 127  -7.212  25.008 -25.156
 1024    HB   VAL 127           HB       VAL 127  -5.894  25.340 -23.064
 1025   HG11  VAL 127          HG11      VAL 127  -7.708  25.051 -21.517
 1026   HG12  VAL 127          HG12      VAL 127  -8.380  25.521 -23.083
 1027   HG13  VAL 127          HG13      VAL 127  -8.480  23.826 -22.542
 1028   HG21  VAL 127          HG21      VAL 127  -4.842  23.104 -22.928
 1029   HG22  VAL 127          HG22      VAL 127  -5.679  23.514 -21.425
 1030   HG23  VAL 127          HG23      VAL 127  -6.411  22.370 -22.559
 1031    H    SER 128           H        SER 128  -5.062  26.174 -25.203
 1032    HA   SER 128           HA       SER 128  -3.339  25.269 -27.154
 1033    HB2  SER 128           HB2      SER 128  -2.489  27.029 -24.831
 1034    HB3  SER 128           HB3      SER 128  -1.872  27.033 -26.489
 1035    HG   SER 128           HG       SER 128  -3.396  28.742 -26.132
 1036    H    TYR 129           H        TYR 129  -1.319  24.229 -27.171
 1037    HA   TYR 129           HA       TYR 129  -1.274  21.918 -25.708
 1038    HB2  TYR 129           HB2      TYR 129  -0.250  22.274 -27.880
 1039    HB3  TYR 129           HB3      TYR 129   1.013  23.280 -27.157
 1040    HD1  TYR 129           HD1      TYR 129  -0.272  19.836 -27.596
 1041    HD2  TYR 129           HD2      TYR 129   2.859  22.269 -25.904
 1042    HE1  TYR 129           HE1      TYR 129   1.026  17.793 -27.028
 1043    HE2  TYR 129           HE2      TYR 129   4.199  20.249 -25.444
 1044    HH   TYR 129           HH       TYR 129   4.245  17.927 -25.501
 1045    H    TRP 130           H        TRP 130   0.515  24.901 -24.810
 1046    HA   TRP 130           HA       TRP 130   1.717  23.481 -22.521
 1047    HB2  TRP 130           HB2      TRP 130   2.058  26.358 -23.389
 1048    HB3  TRP 130           HB3      TRP 130   3.042  25.475 -22.228
 1049    HD1  TRP 130           HD1      TRP 130   2.592  26.058 -25.926
 1050    HE1  TRP 130           HE1      TRP 130   4.309  24.801 -27.289
 1051    HE3  TRP 130           HE3      TRP 130   4.675  23.261 -22.169
 1052    HZ2  TRP 130           HZ2      TRP 130   6.436  22.846 -26.809
 1053    HZ3  TRP 130           HZ3      TRP 130   6.568  21.725 -22.655
 1054    HH2  TRP 130           HH2      TRP 130   7.438  21.499 -24.964
 1055    H    TYR 131           H        TYR 131  -1.314  24.870 -22.926
 1056    HA   TYR 131           HA       TYR 131  -1.366  26.802 -20.863
 1057    HB2  TYR 131           HB2      TYR 131  -3.002  26.678 -22.684
 1058    HB3  TYR 131           HB3      TYR 131  -3.675  25.207 -22.021
 1059    HD1  TYR 131           HD2      TYR 131  -3.212  28.848 -21.483
 1060    HD2  TYR 131           HD1      TYR 131  -5.218  25.278 -20.118
 1061    HE1  TYR 131           HE2      TYR 131  -4.785  30.238 -20.179
 1062    HE2  TYR 131           HE1      TYR 131  -6.852  26.667 -18.885
 1063    HH   TYR 131           HH       TYR 131  -6.669  30.259 -18.793
 1064    HA   PRO 132           HA       PRO 132  -3.014  23.331 -17.880
 1065    HB2  PRO 132           HB2      PRO 132  -1.377  21.060 -19.023
 1066    HB3  PRO 132           HB3      PRO 132  -2.896  20.962 -18.119
 1067    HG2  PRO 132           HG2      PRO 132  -2.943  20.696 -20.777
 1068    HG3  PRO 132           HG3      PRO 132  -4.148  21.791 -20.013
 1069    HD2  PRO 132           HD2      PRO 132  -1.517  22.544 -21.335
 1070    HD3  PRO 132           HD3      PRO 132  -3.126  23.259 -21.563
 1071    H    VAL 133           H        VAL 133   0.228  23.316 -19.404
 1072    HA   VAL 133           HA       VAL 133   1.641  22.761 -16.956
 1073    HB   VAL 133           HB       VAL 133   2.215  23.061 -19.768
 1074   HG11  VAL 133          HG11      VAL 133   4.194  24.626 -18.092
 1075   HG12  VAL 133          HG12      VAL 133   4.422  24.064 -19.768
 1076   HG13  VAL 133          HG13      VAL 133   3.167  25.237 -19.422
 1077   HG21  VAL 133          HG21      VAL 133   4.171  21.731 -19.198
 1078   HG22  VAL 133          HG22      VAL 133   3.975  22.114 -17.468
 1079   HG23  VAL 133          HG23      VAL 133   2.764  21.130 -18.333
 1080    H    ARG 134           H        ARG 134   0.599  25.773 -18.648
 1081    HA   ARG 134           HA       ARG 134   2.065  27.313 -16.634
 1082    HB2  ARG 134           HB2      ARG 134  -0.020  28.248 -18.663
 1083    HB3  ARG 134           HB3      ARG 134   0.958  29.300 -17.645
 1084    HG2  ARG 134           HG2      ARG 134   1.868  27.569 -19.960
 1085    HG3  ARG 134           HG3      ARG 134   1.952  29.311 -19.796
 1086    HD2  ARG 134           HD2      ARG 134   3.677  27.202 -18.452
 1087    HD3  ARG 134           HD3      ARG 134   4.195  28.466 -19.550
 1088    HE   ARG 134           HE       ARG 134   3.921  28.586 -16.689
 1089   HH11  ARG 134          HH11      ARG 134   3.831  30.648 -19.598
 1090   HH12  ARG 134          HH12      ARG 134   4.143  32.113 -18.741
 1091   HH21  ARG 134          HH21      ARG 134   4.281  30.587 -15.544
 1092   HH22  ARG 134          HH22      ARG 134   4.428  32.066 -16.408
 1093    H    GLN 135           H        GLN 135  -1.216  26.064 -16.918
 1094    HA   GLN 135           HA       GLN 135  -2.188  27.725 -14.737
 1095    HB2  GLN 135           HB2      GLN 135  -3.324  25.245 -16.082
 1096    HB3  GLN 135           HB3      GLN 135  -4.152  26.170 -14.820
 1097    HG2  GLN 135           HG2      GLN 135  -3.408  27.208 -17.582
 1098    HG3  GLN 135           HG3      GLN 135  -5.008  26.781 -16.996
 1099   HE21  GLN 135          HE22      GLN 135  -5.945  28.140 -15.187
 1100   HE22  GLN 135          HE21      GLN 135  -5.431  29.805 -15.059
 1101    H    VAL 136           H        VAL 136  -0.609  24.503 -14.895
 1102    HA   VAL 136           HA       VAL 136  -1.646  23.641 -12.445
 1103    HB   VAL 136           HB       VAL 136  -0.596  22.258 -14.279
 1104   HG11  VAL 136          HG11      VAL 136   1.601  23.314 -14.449
 1105   HG12  VAL 136          HG12      VAL 136   1.948  22.919 -12.766
 1106   HG13  VAL 136          HG13      VAL 136   1.785  21.620 -13.948
 1107   HG21  VAL 136          HG21      VAL 136  -1.433  21.318 -12.196
 1108   HG22  VAL 136          HG22      VAL 136   0.007  20.468 -12.788
 1109   HG23  VAL 136          HG23      VAL 136   0.144  21.589 -11.424
 1110    H    VAL 137           H        VAL 137  -0.586  23.330 -10.377
 1111    HA   VAL 137           HA       VAL 137   0.715  25.525  -9.197
 1112    HB   VAL 137           HB       VAL 137   1.265  23.775  -7.395
 1113   HG11  VAL 137          HG11      VAL 137  -1.091  23.676  -6.643
 1114   HG12  VAL 137          HG12      VAL 137  -0.703  25.273  -7.302
 1115   HG13  VAL 137          HG13      VAL 137  -1.649  24.118  -8.268
 1116   HG21  VAL 137          HG21      VAL 137   0.096  21.644  -7.446
 1117   HG22  VAL 137          HG22      VAL 137  -0.557  21.961  -9.053
 1118   HG23  VAL 137          HG23      VAL 137   1.201  21.735  -8.825
 1119    H    SER 138           H        SER 138   2.821  25.897  -8.477
 1120    HA   SER 138           HA       SER 138   4.718  25.633 -10.432
 1121    HB2  SER 138           HB2      SER 138   5.162  26.176  -7.475
 1122    HB3  SER 138           HB3      SER 138   6.182  26.736  -8.818
 1123    HG   SER 138           HG       SER 138   4.489  28.245  -7.944
 1124    H    PHE 139           H        PHE 139   4.381  23.445  -7.567
 1125    HA   PHE 139           HA       PHE 139   6.964  22.276  -8.047
 1126    HB2  PHE 139           HB2      PHE 139   6.414  20.645  -6.409
 1127    HB3  PHE 139           HB3      PHE 139   5.888  22.220  -5.857
 1128    HD1  PHE 139           HD2      PHE 139   4.819  18.862  -6.934
 1129    HD2  PHE 139           HD1      PHE 139   3.483  22.727  -5.560
 1130    HE1  PHE 139           HE2      PHE 139   2.582  17.920  -6.454
 1131    HE2  PHE 139           HE1      PHE 139   1.238  21.787  -5.105
 1132    HZ   PHE 139           HZ       PHE 139   0.768  19.396  -5.584
 1133    H    LYS 140           H        LYS 140   3.810  21.699  -9.497
 1134    HA   LYS 140           HA       LYS 140   4.768  19.225 -10.842
 1135    HB2  LYS 140           HB2      LYS 140   2.120  20.694 -11.035
 1136    HB3  LYS 140           HB3      LYS 140   2.529  19.201 -11.891
 1137    HG2  LYS 140           HG2      LYS 140   2.939  18.100  -9.648
 1138    HG3  LYS 140           HG3      LYS 140   2.342  19.575  -8.876
 1139    HD2  LYS 140           HD2      LYS 140   0.158  19.302 -10.060
 1140    HD3  LYS 140           HD3      LYS 140   0.766  17.791 -10.783
 1141    HE2  LYS 140           HE2      LYS 140   1.043  16.797  -8.545
 1142    HE3  LYS 140           HE3      LYS 140   0.512  18.307  -7.783
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.296  16.695  -7.898
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.680  17.977  -8.834
 1145    HZ3  LYS 140           HZ3      LYS 140  -1.186  16.559  -9.521
 1146    H    ARG 141           H        ARG 141   3.980  22.654 -11.657
 1147    HA   ARG 141           HA       ARG 141   4.028  22.588 -14.385
 1148    HB2  ARG 141           HB2      ARG 141   3.637  24.571 -13.005
 1149    HB3  ARG 141           HB3      ARG 141   5.346  24.672 -12.576
 1150    HG2  ARG 141           HG2      ARG 141   5.976  25.413 -14.743
 1151    HG3  ARG 141           HG3      ARG 141   4.504  24.803 -15.484
 1152    HD2  ARG 141           HD2      ARG 141   4.351  27.181 -15.367
 1153    HD3  ARG 141           HD3      ARG 141   3.180  26.526 -14.226
 1154    HE   ARG 141           HE       ARG 141   5.829  27.767 -13.598
 1155   HH11  ARG 141          HH11      ARG 141   2.562  26.831 -12.353
 1156   HH12  ARG 141          HH12      ARG 141   2.813  27.678 -10.873
 1157   HH21  ARG 141          HH21      ARG 141   6.051  28.843 -11.602
 1158   HH22  ARG 141          HH22      ARG 141   4.837  28.658 -10.379
 1159    H    ASP 142           H        ASP 142   7.082  22.709 -12.469
 1160    HA   ASP 142           HA       ASP 142   8.764  22.938 -14.768
 1161    HB2  ASP 142           HB2      ASP 142   9.535  23.538 -12.538
 1162    HB3  ASP 142           HB3      ASP 142   9.345  21.874 -11.980
 1163    H    VAL 143           H        VAL 143   7.475  20.065 -13.098
 1164    HA   VAL 143           HA       VAL 143   9.170  18.279 -14.710
 1165    HB   VAL 143           HB       VAL 143   9.015  17.789 -12.412
 1166   HG11  VAL 143          HG11      VAL 143   5.986  17.533 -12.687
 1167   HG12  VAL 143          HG12      VAL 143   6.955  17.164 -11.252
 1168   HG13  VAL 143          HG13      VAL 143   6.876  18.805 -11.800
 1169   HG21  VAL 143          HG21      VAL 143   9.152  15.919 -14.015
 1170   HG22  VAL 143          HG22      VAL 143   8.406  15.453 -12.484
 1171   HG23  VAL 143          HG23      VAL 143   7.390  15.707 -13.929
 1172    H    TYR 144           H        TYR 144   5.741  19.296 -14.541
 1173    HA   TYR 144           HA       TYR 144   4.804  17.483 -16.514
 1174    HB2  TYR 144           HB2      TYR 144   3.441  18.706 -14.863
 1175    HB3  TYR 144           HB3      TYR 144   3.763  20.213 -15.715
 1176    HD1  TYR 144           HD2      TYR 144   2.937  16.994 -17.579
 1177    HD2  TYR 144           HD1      TYR 144   1.397  20.632 -15.814
 1178    HE1  TYR 144           HE2      TYR 144   0.751  16.545 -18.545
 1179    HE2  TYR 144           HE1      TYR 144  -0.789  20.215 -16.817
 1180    HH   TYR 144           HH       TYR 144  -1.412  17.403 -19.012
 1181    H    ARG 145           H        ARG 145   6.433  20.697 -16.779
 1182    HA   ARG 145           HA       ARG 145   6.251  20.978 -19.606
 1183    HB2  ARG 145           HB2      ARG 145   8.357  21.773 -17.561
 1184    HB3  ARG 145           HB3      ARG 145   8.700  21.921 -19.279
 1185    HG2  ARG 145           HG2      ARG 145   6.677  23.336 -19.577
 1186    HG3  ARG 145           HG3      ARG 145   6.372  23.237 -17.837
 1187    HD2  ARG 145           HD2      ARG 145   7.486  25.333 -18.348
 1188    HD3  ARG 145           HD3      ARG 145   8.578  24.302 -17.400
 1189    HE   ARG 145           HE       ARG 145   9.054  23.871 -20.191
 1190   HH11  ARG 145          HH11      ARG 145   9.579  26.398 -17.729
 1191   HH12  ARG 145          HH12      ARG 145  10.943  27.082 -18.534
 1192   HH21  ARG 145          HH21      ARG 145  10.867  24.792 -21.255
 1193   HH22  ARG 145          HH22      ARG 145  11.682  26.151 -20.579
 1194    H    ARG 146           H        ARG 146   8.341  18.743 -17.706
 1195    HA   ARG 146           HA       ARG 146  10.033  18.071 -19.946
 1196    HB2  ARG 146           HB2      ARG 146   9.393  16.283 -17.548
 1197    HB3  ARG 146           HB3      ARG 146  10.777  16.174 -18.629
 1198    HG2  ARG 146           HG2      ARG 146  11.609  18.373 -17.819
 1199    HG3  ARG 146           HG3      ARG 146  10.188  18.522 -16.782
 1200    HD2  ARG 146           HD2      ARG 146  10.932  16.283 -15.724
 1201    HD3  ARG 146           HD3      ARG 146  12.497  16.610 -16.501
 1202    HE   ARG 146           HE       ARG 146  11.639  18.950 -15.109
 1203   HH11  ARG 146          HH11      ARG 146  12.998  15.727 -14.425
 1204   HH12  ARG 146          HH12      ARG 146  13.557  16.156 -12.850
 1205   HH21  ARG 146          HH21      ARG 146  12.310  19.500 -13.007
 1206   HH22  ARG 146          HH22      ARG 146  13.199  18.362 -12.041
 1207    H    VAL 147           H        VAL 147   7.069  16.575 -18.581
 1208    HA   VAL 147           HA       VAL 147   6.750  14.482 -20.439
 1209    HB   VAL 147           HB       VAL 147   4.568  16.190 -19.161
 1210   HG11  VAL 147          HG11      VAL 147   3.187  14.173 -19.299
 1211   HG12  VAL 147          HG12      VAL 147   3.728  14.676 -20.905
 1212   HG13  VAL 147          HG13      VAL 147   4.518  13.303 -20.101
 1213   HG21  VAL 147          HG21      VAL 147   6.110  15.376 -17.388
 1214   HG22  VAL 147          HG22      VAL 147   4.542  14.599 -17.310
 1215   HG23  VAL 147          HG23      VAL 147   5.922  13.720 -18.003
 1216    H    MET 148           H        MET 148   5.465  17.874 -20.565
 1217    HA   MET 148           HA       MET 148   4.223  17.507 -23.061
 1218    HB2  MET 148           HB2      MET 148   5.186  20.001 -21.615
 1219    HB3  MET 148           HB3      MET 148   4.330  20.048 -23.163
 1220    HG2  MET 148           HG2      MET 148   2.487  18.678 -22.101
 1221    HG3  MET 148           HG3      MET 148   3.276  18.962 -20.537
 1222    HE1  MET 148           HE1      MET 148   0.213  21.426 -20.498
 1223    HE2  MET 148           HE2      MET 148   0.258  19.795 -21.211
 1224    HE3  MET 148           HE3      MET 148   1.036  20.109 -19.638
 1225    H    LYS 149           H        LYS 149   7.539  18.714 -22.294
 1226    HA   LYS 149           HA       LYS 149   8.312  19.463 -24.910
 1227    HB2  LYS 149           HB2      LYS 149   9.566  20.143 -23.000
 1228    HB3  LYS 149           HB3      LYS 149   9.810  18.502 -22.436
 1229    HG2  LYS 149           HG2      LYS 149  10.982  19.294 -25.102
 1230    HG3  LYS 149           HG3      LYS 149  11.731  19.883 -23.616
 1231    HD2  LYS 149           HD2      LYS 149  12.134  17.652 -22.781
 1232    HD3  LYS 149           HD3      LYS 149  11.194  16.913 -24.080
 1233    HE2  LYS 149           HE2      LYS 149  12.800  17.739 -25.760
 1234    HE3  LYS 149           HE3      LYS 149  13.778  18.463 -24.475
 1235    HZ1  LYS 149           HZ1      LYS 149  14.553  16.234 -25.196
 1236    HZ2  LYS 149           HZ2      LYS 149  14.209  16.268 -23.599
 1237    HZ3  LYS 149           HZ3      LYS 149  13.163  15.543 -24.638
 1238    H    GLU 150           H        GLU 150   8.350  16.272 -23.320
 1239    HA   GLU 150           HA       GLU 150   9.868  15.004 -25.402
 1240    HB2  GLU 150           HB2      GLU 150   8.085  13.915 -23.195
 1241    HB3  GLU 150           HB3      GLU 150   9.049  12.885 -24.256
 1242    HG2  GLU 150           HG2      GLU 150  10.361  15.118 -22.650
 1243    HG3  GLU 150           HG3      GLU 150  10.002  13.550 -21.937
 1244    H    PHE 151           H        PHE 151   6.441  15.753 -25.125
 1245    HA   PHE 151           HA       PHE 151   5.825  14.043 -27.489
 1246    HB2  PHE 151           HB2      PHE 151   4.014  15.377 -25.457
 1247    HB3  PHE 151           HB3      PHE 151   3.478  14.380 -26.790
 1248    HD1  PHE 151           HD2      PHE 151   5.662  12.144 -26.473
 1249    HD2  PHE 151           HD1      PHE 151   3.083  14.175 -23.668
 1250    HE1  PHE 151           HE2      PHE 151   5.743  10.191 -24.984
 1251    HE2  PHE 151           HE1      PHE 151   3.140  12.181 -22.195
 1252    HZ   PHE 151           HZ       PHE 151   4.457  10.190 -22.846
 1253    H    ALA 152           H        ALA 152   6.479  17.343 -26.828
 1254    HA   ALA 152           HA       ALA 152   4.505  18.733 -28.090
 1255    HB1  ALA 152           HB1      ALA 152   7.488  19.383 -28.152
 1256    HB2  ALA 152           HB2      ALA 152   6.166  20.525 -28.484
 1257    HB3  ALA 152           HB3      ALA 152   6.334  19.822 -26.867
 1258    H    SER 153           H        SER 153   7.516  17.711 -29.859
 1259    HA   SER 153           HA       SER 153   6.587  18.602 -32.333
 1260    HB2  SER 153           HB2      SER 153   8.452  16.235 -31.959
 1261    HB3  SER 153           HB3      SER 153   8.412  17.424 -33.282
 1262    HG   SER 153           HG       SER 153  10.094  17.894 -31.775
 1263    H    VAL 154           H        VAL 154   5.551  15.702 -30.621
 1264    HA   VAL 154           HA       VAL 154   4.844  14.187 -33.019
 1265    HB   VAL 154           HB       VAL 154   3.876  13.758 -30.162
 1266   HG11  VAL 154          HG11      VAL 154   4.107  11.883 -32.561
 1267   HG12  VAL 154          HG12      VAL 154   3.633  11.405 -30.916
 1268   HG13  VAL 154          HG13      VAL 154   2.598  12.498 -31.843
 1269   HG21  VAL 154          HG21      VAL 154   5.703  12.078 -29.959
 1270   HG22  VAL 154          HG22      VAL 154   6.373  12.634 -31.509
 1271   HG23  VAL 154          HG23      VAL 154   6.335  13.715 -30.094
 1272    H    VAL 155           H        VAL 155   3.194  16.305 -30.627
 1273    HA   VAL 155           HA       VAL 155   0.635  16.024 -32.013
 1274    HB   VAL 155           HB       VAL 155   1.491  17.842 -29.721
 1275   HG11  VAL 155          HG11      VAL 155  -0.958  17.890 -29.198
 1276   HG12  VAL 155          HG12      VAL 155  -0.580  18.644 -30.752
 1277   HG13  VAL 155          HG13      VAL 155  -1.291  17.007 -30.705
 1278   HG21  VAL 155          HG21      VAL 155   0.343  16.131 -28.301
 1279   HG22  VAL 155          HG22      VAL 155   0.156  15.087 -29.718
 1280   HG23  VAL 155          HG23      VAL 155   1.775  15.481 -29.076
 1281    H    MET 156           H        MET 156   3.285  18.444 -31.879
 1282    HA   MET 156           HA       MET 156   1.806  20.433 -33.313
 1283    HB2  MET 156           HB2      MET 156   4.799  20.028 -32.929
 1284    HB3  MET 156           HB3      MET 156   4.095  21.432 -33.732
 1285    HG2  MET 156           HG2      MET 156   3.472  20.604 -30.874
 1286    HG3  MET 156           HG3      MET 156   4.630  21.844 -31.346
 1287    HE1  MET 156           HE1      MET 156   3.493  23.520 -29.678
 1288    HE2  MET 156           HE2      MET 156   1.748  23.860 -29.653
 1289    HE3  MET 156           HE3      MET 156   2.348  22.242 -29.219
 1290    H    SER 157           H        SER 157   3.908  17.743 -34.489
 1291    HA   SER 157           HA       SER 157   4.100  18.619 -37.150
 1292    HB2  SER 157           HB2      SER 157   3.914  15.781 -36.064
 1293    HB3  SER 157           HB3      SER 157   4.413  16.205 -37.709
 1294    HG   SER 157           HG       SER 157   5.732  16.739 -35.261
 1295    H    LEU 158           H        LEU 158   1.370  17.083 -35.517
 1296    HA   LEU 158           HA       LEU 158  -0.109  16.312 -37.847
 1297    HB2  LEU 158           HB2      LEU 158  -1.039  17.120 -35.072
 1298    HB3  LEU 158           HB3      LEU 158  -2.073  16.361 -36.278
 1299    HG   LEU 158           HG       LEU 158   0.381  15.055 -35.040
 1300   HD11  LEU 158          HD11      LEU 158  -1.222  13.752 -33.711
 1301   HD12  LEU 158          HD12      LEU 158  -1.410  15.484 -33.374
 1302   HD13  LEU 158          HD13      LEU 158  -2.583  14.658 -34.421
 1303   HD21  LEU 158          HD21      LEU 158  -1.847  13.901 -36.776
 1304   HD22  LEU 158          HD22      LEU 158  -0.145  14.109 -37.253
 1305   HD23  LEU 158          HD23      LEU 158  -0.567  12.962 -35.976
 1306    H    GLN 159           H        GLN 159   0.422  19.456 -36.336
 1307    HA   GLN 159           HA       GLN 159  -1.795  20.673 -37.922
 1308    HB2  GLN 159           HB2      GLN 159  -0.251  22.042 -35.696
 1309    HB3  GLN 159           HB3      GLN 159  -1.820  22.467 -36.370
 1310    HG2  GLN 159           HG2      GLN 159  -1.134  20.199 -34.496
 1311    HG3  GLN 159           HG3      GLN 159  -2.199  21.577 -34.254
 1312   HE21  GLN 159          HE22      GLN 159  -2.447  18.329 -34.481
 1313   HE22  GLN 159          HE21      GLN 159  -3.991  18.220 -35.311
 1314    H    GLU 160           H        GLU 160   1.724  20.724 -37.361
 1315    HA   GLU 160           HA       GLU 160   2.267  23.051 -38.898
 1316    HB2  GLU 160           HB2      GLU 160   3.688  22.052 -37.098
 1317    HB3  GLU 160           HB3      GLU 160   4.078  20.703 -38.169
 1318    HG2  GLU 160           HG2      GLU 160   5.182  22.253 -39.743
 1319    HG3  GLU 160           HG3      GLU 160   4.675  23.637 -38.768
 1320    H    ASN 161           H        ASN 161   1.688  19.705 -39.845
 1321    HA   ASN 161           HA       ASN 161   2.430  20.280 -42.664
 1322    HB2  ASN 161           HB2      ASN 161   3.544  18.253 -41.894
 1323    HB3  ASN 161           HB3      ASN 161   2.068  17.697 -41.100
 1324   HD21  ASN 161          HD22      ASN 161   2.249  15.687 -42.372
 1325   HD22  ASN 161          HD21      ASN 161   1.470  15.708 -43.946
 1326    H    THR 162           H        THR 162   0.580  21.756 -42.551
 1327    HA   THR 162           HA       THR 162  -1.976  21.070 -41.778
 1328    HB   THR 162           HB       THR 162  -2.230  22.794 -44.022
 1329    HG1  THR 162           HG1      THR 162  -0.591  24.277 -43.730
 1330   HG21  THR 162          HG21      THR 162  -3.412  23.013 -41.862
 1331   HG22  THR 162          HG22      THR 162  -1.891  23.471 -41.066
 1332   HG23  THR 162          HG23      THR 162  -2.611  24.523 -42.307
 1333    HA   PRO 163           HA       PRO 163  -2.758  19.140 -46.137
 1334    HB2  PRO 163           HB2      PRO 163   0.065  18.156 -46.596
 1335    HB3  PRO 163           HB3      PRO 163  -1.198  18.552 -47.805
 1336    HG2  PRO 163           HG2      PRO 163   0.767  20.340 -47.282
 1337    HG3  PRO 163           HG3      PRO 163  -0.931  20.905 -47.421
 1338    HD2  PRO 163           HD2      PRO 163   0.662  20.347 -44.902
 1339    HD3  PRO 163           HD3      PRO 163  -0.427  21.704 -45.251
 1340    H    LYS 164           H        LYS 164  -0.856  17.921 -43.425
 1341    HA   LYS 164           HA       LYS 164  -0.640  15.917 -42.449
 1342    HB2  LYS 164           HB2      LYS 164  -3.547  15.690 -43.266
 1343    HB3  LYS 164           HB3      LYS 164  -2.744  14.660 -42.079
 1344    HG2  LYS 164           HG2      LYS 164  -2.255  16.565 -40.637
 1345    HG3  LYS 164           HG3      LYS 164  -2.972  17.694 -41.791
 1346    HD2  LYS 164           HD2      LYS 164  -4.487  15.455 -40.386
 1347    HD3  LYS 164           HD3      LYS 164  -4.452  17.151 -39.873
 1348    HE2  LYS 164           HE2      LYS 164  -5.421  17.842 -42.060
 1349    HE3  LYS 164           HE3      LYS 164  -5.505  16.146 -42.561
 1350    HZ1  LYS 164           HZ1      LYS 164  -7.049  15.750 -40.721
 1351    HZ2  LYS 164           HZ2      LYS 164  -6.983  17.327 -40.274
 1352    HZ3  LYS 164           HZ3      LYS 164  -7.625  16.911 -41.713
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  -2.406   3.045  -3.304
    2    H2   MET   1           H2       MET   1  -2.980   1.592  -2.804
    3    H3   MET   1           H3       MET   1  -2.069   2.507  -1.794
    4    HA   MET   1           HA       MET   1  -0.746   0.695  -2.626
    5    HB2  MET   1           HB2      MET   1  -2.055   0.394  -4.743
    6    HB3  MET   1           HB3      MET   1  -1.323   1.862  -5.397
    7    HG2  MET   1           HG2      MET   1  -0.201  -0.064  -6.296
    8    HG3  MET   1           HG3      MET   1   0.921   0.788  -5.246
    9    HE1  MET   1           HE1      MET   1   1.513  -2.060  -6.344
   10    HE2  MET   1           HE2      MET   1   2.590  -1.247  -5.185
   11    HE3  MET   1           HE3      MET   1   2.079  -2.922  -4.898
   12    H    ILE   2           H        ILE   2   1.428   1.178  -2.208
   13    HA   ILE   2           HA       ILE   2   2.530   3.723  -3.241
   14    HB   ILE   2           HB       ILE   2   2.952   2.556  -0.466
   15   HG12  ILE   2          HG12      ILE   2   2.854   5.130   0.051
   16   HG13  ILE   2          HG13      ILE   2   2.157   5.303  -1.549
   17   HG21  ILE   2          HG21      ILE   2   4.862   4.154  -0.238
   18   HG22  ILE   2          HG22      ILE   2   5.185   2.876  -1.381
   19   HG23  ILE   2          HG23      ILE   2   4.755   4.491  -1.985
   20   HD11  ILE   2          HD11      ILE   2   0.501   5.228   0.320
   21   HD12  ILE   2          HD12      ILE   2   0.223   3.929  -0.842
   22   HD13  ILE   2          HD13      ILE   2   1.019   3.576   0.706
   23    H    ASP   3           H        ASP   3   4.560   3.459  -4.172
   24    HA   ASP   3           HA       ASP   3   4.896   0.905  -5.457
   25    HB2  ASP   3           HB2      ASP   3   5.153   3.064  -6.577
   26    HB3  ASP   3           HB3      ASP   3   6.521   3.466  -5.541
   27    H    ASP   4           H        ASP   4   6.864   2.773  -3.126
   28    HA   ASP   4           HA       ASP   4   7.806   0.299  -1.940
   29    HB2  ASP   4           HB2      ASP   4   9.529   0.516  -3.629
   30    HB3  ASP   4           HB3      ASP   4   9.807   2.200  -3.187
   31    H    ASP   5           H        ASP   5   9.222   3.571  -1.758
   32    HA   ASP   5           HA       ASP   5   9.028   3.408   1.103
   33    HB2  ASP   5           HB2      ASP   5  11.048   4.201   0.042
   34    HB3  ASP   5           HB3      ASP   5  10.181   5.566  -0.674
   35    H    GLY   6           H        GLY   6   7.775   5.770  -1.251
   36    HA2  GLY   6           HA2      GLY   6   5.441   6.394   0.441
   37    HA3  GLY   6           HA3      GLY   6   6.683   7.645   0.395
   38    H    TYR   7           H        TYR   7   6.530   6.029  -2.663
   39    HA   TYR   7           HA       TYR   7   5.061   8.367  -3.771
   40    HB2  TYR   7           HB2      TYR   7   7.200   6.513  -4.824
   41    HB3  TYR   7           HB3      TYR   7   6.074   7.260  -5.945
   42    HD1  TYR   7           HD1      TYR   7   8.502   8.124  -3.188
   43    HD2  TYR   7           HD2      TYR   7   6.300   9.473  -6.640
   44    HE1  TYR   7           HE1      TYR   7   9.606  10.339  -3.031
   45    HE2  TYR   7           HE2      TYR   7   7.355  11.675  -6.466
   46    HH   TYR   7           HH       TYR   7   8.717  13.061  -5.196
   47    H    ARG   8           H        ARG   8   3.105   8.098  -4.850
   48    HA   ARG   8           HA       ARG   8   2.010   5.325  -4.784
   49    HB2  ARG   8           HB2      ARG   8  -0.134   6.165  -5.367
   50    HB3  ARG   8           HB3      ARG   8   0.490   6.908  -3.907
   51    HG2  ARG   8           HG2      ARG   8   0.820   9.032  -5.010
   52    HG3  ARG   8           HG3      ARG   8   0.606   8.318  -6.611
   53    HD2  ARG   8           HD2      ARG   8  -1.415   9.522  -5.990
   54    HD3  ARG   8           HD3      ARG   8  -1.715   7.780  -6.151
   55    HE   ARG   8           HE       ARG   8  -1.113   8.736  -3.430
   56   HH11  ARG   8          HH11      ARG   8  -3.758   8.192  -5.754
   57   HH12  ARG   8          HH12      ARG   8  -4.963   7.965  -4.540
   58   HH21  ARG   8          HH21      ARG   8  -2.717   8.369  -1.814
   59   HH22  ARG   8          HH22      ARG   8  -4.358   8.086  -2.261
   60    HA   PRO   9           HA       PRO   9   3.209   5.128  -9.118
   61    HB2  PRO   9           HB2      PRO   9   2.607   2.540  -9.684
   62    HB3  PRO   9           HB3      PRO   9   3.940   2.978  -8.590
   63    HG2  PRO   9           HG2      PRO   9   1.144   2.084  -7.847
   64    HG3  PRO   9           HG3      PRO   9   2.708   1.549  -7.154
   65    HD2  PRO   9           HD2      PRO   9   1.071   3.514  -6.058
   66    HD3  PRO   9           HD3      PRO   9   2.843   3.440  -5.812
   67    H    ASN  10           H        ASN  10   2.044   5.903 -10.877
   68    HA   ASN  10           HA       ASN  10  -0.608   4.868 -11.448
   69    HB2  ASN  10           HB2      ASN  10  -1.898   6.759 -11.092
   70    HB3  ASN  10           HB3      ASN  10  -0.866   6.848  -9.689
   71   HD21  ASN  10          HD22      ASN  10   1.248   8.194 -10.231
   72   HD22  ASN  10          HD21      ASN  10   0.872   9.730 -11.034
   73    H    VAL  11           H        VAL  11  -1.452   6.324 -13.498
   74    HA   VAL  11           HA       VAL  11   0.879   7.177 -15.091
   75    HB   VAL  11           HB       VAL  11  -0.136   6.123 -17.086
   76   HG11  VAL  11          HG11      VAL  11   0.737   4.149 -14.924
   77   HG12  VAL  11          HG12      VAL  11   0.776   3.876 -16.674
   78   HG13  VAL  11          HG13      VAL  11   1.819   5.118 -15.960
   79   HG21  VAL  11          HG21      VAL  11  -2.404   5.604 -16.395
   80   HG22  VAL  11          HG22      VAL  11  -1.526   4.108 -16.741
   81   HG23  VAL  11          HG23      VAL  11  -1.829   4.555 -15.073
   82    H    GLY  12           H        GLY  12   0.421   9.131 -16.151
   83    HA2  GLY  12           HA2      GLY  12  -2.309  10.265 -15.836
   84    HA3  GLY  12           HA3      GLY  12  -0.848  11.146 -16.259
   85    H    ILE  13           H        ILE  13  -3.633  10.635 -17.680
   86    HA   ILE  13           HA       ILE  13  -2.597   9.620 -20.289
   87    HB   ILE  13           HB       ILE  13  -5.357  10.104 -19.156
   88   HG12  ILE  13          HG12      ILE  13  -5.808   8.060 -20.633
   89   HG13  ILE  13          HG13      ILE  13  -4.073   7.999 -20.975
   90   HG21  ILE  13          HG21      ILE  13  -5.516  11.568 -21.036
   91   HG22  ILE  13          HG22      ILE  13  -4.762  10.363 -22.120
   92   HG23  ILE  13          HG23      ILE  13  -6.377  10.084 -21.424
   93   HD11  ILE  13          HD11      ILE  13  -5.390   7.807 -18.236
   94   HD12  ILE  13          HD12      ILE  13  -4.792   6.457 -19.218
   95   HD13  ILE  13          HD13      ILE  13  -3.638   7.629 -18.564
   96    H    VAL  14           H        VAL  14  -2.155  10.951 -21.972
   97    HA   VAL  14           HA       VAL  14  -2.910  13.816 -21.695
   98    HB   VAL  14           HB       VAL  14  -0.504  12.747 -23.239
   99   HG11  VAL  14          HG11      VAL  14  -1.550  14.906 -23.985
  100   HG12  VAL  14          HG12      VAL  14  -1.294  15.570 -22.361
  101   HG13  VAL  14          HG13      VAL  14   0.096  15.120 -23.376
  102   HG21  VAL  14          HG21      VAL  14   0.016  12.376 -20.923
  103   HG22  VAL  14          HG22      VAL  14   0.865  13.840 -21.441
  104   HG23  VAL  14          HG23      VAL  14  -0.613  13.996 -20.475
  105    H    ILE  15           H        ILE  15  -4.952  13.437 -22.722
  106    HA   ILE  15           HA       ILE  15  -5.009  12.103 -25.347
  107    HB   ILE  15           HB       ILE  15  -7.021  14.086 -24.181
  108   HG12  ILE  15          HG12      ILE  15  -6.964  11.966 -22.901
  109   HG13  ILE  15          HG13      ILE  15  -8.494  12.278 -23.697
  110   HG21  ILE  15          HG21      ILE  15  -7.186  12.400 -26.702
  111   HG22  ILE  15          HG22      ILE  15  -8.566  13.234 -25.940
  112   HG23  ILE  15          HG23      ILE  15  -7.213  14.172 -26.563
  113   HD11  ILE  15          HD11      ILE  15  -6.386  10.504 -24.986
  114   HD12  ILE  15          HD12      ILE  15  -7.610   9.869 -23.852
  115   HD13  ILE  15          HD13      ILE  15  -8.102  10.617 -25.385
  116    H    CYS  16           H        CYS  16  -4.548  13.060 -27.209
  117    HA   CYS  16           HA       CYS  16  -4.248  16.031 -27.237
  118    HB2  CYS  16           HB2      CYS  16  -2.383  13.980 -28.471
  119    HB3  CYS  16           HB3      CYS  16  -2.462  15.689 -28.999
  120    HG   CYS  16           HG       CYS  16  -1.999  14.496 -25.946
  121    H    ASN  17           H        ASN  17  -5.720  16.831 -28.457
  122    HA   ASN  17           HA       ASN  17  -7.295  15.176 -30.297
  123    HB2  ASN  17           HB2      ASN  17  -8.372  16.981 -28.914
  124    HB3  ASN  17           HB3      ASN  17  -7.375  18.191 -29.733
  125   HD21  ASN  17          HD22      ASN  17 -10.242  16.181 -30.021
  126   HD22  ASN  17          HD21      ASN  17 -10.641  16.624 -31.663
  127    H    ARG  18           H        ARG  18  -7.111  15.350 -32.545
  128    HA   ARG  18           HA       ARG  18  -4.455  15.716 -33.476
  129    HB2  ARG  18           HB2      ARG  18  -6.988  15.426 -35.149
  130    HB3  ARG  18           HB3      ARG  18  -5.334  14.996 -35.615
  131    HG2  ARG  18           HG2      ARG  18  -5.325  13.280 -33.739
  132    HG3  ARG  18           HG3      ARG  18  -7.038  13.670 -33.447
  133    HD2  ARG  18           HD2      ARG  18  -7.525  13.169 -35.832
  134    HD3  ARG  18           HD3      ARG  18  -5.825  12.657 -36.019
  135    HE   ARG  18           HE       ARG  18  -7.396  11.370 -33.854
  136   HH11  ARG  18          HH21      ARG  18  -6.363  11.017 -37.242
  137   HH12  ARG  18          HH22      ARG  18  -6.623   9.310 -37.278
  138   HH21  ARG  18          HH11      ARG  18  -7.724   9.183 -33.879
  139   HH22  ARG  18          HH12      ARG  18  -7.434   8.221 -35.308
  140    H    GLN  19           H        GLN  19  -6.915  18.122 -33.154
  141    HA   GLN  19           HA       GLN  19  -5.884  19.878 -35.235
  142    HB2  GLN  19           HB2      GLN  19  -7.504  20.373 -32.715
  143    HB3  GLN  19           HB3      GLN  19  -7.144  21.614 -33.925
  144    HG2  GLN  19           HG2      GLN  19  -8.440  20.565 -35.610
  145    HG3  GLN  19           HG3      GLN  19  -8.538  19.041 -34.733
  146   HE21  GLN  19          HE22      GLN  19  -9.786  18.942 -32.745
  147   HE22  GLN  19          HE21      GLN  19 -11.127  20.050 -32.461
  148    H    GLY  20           H        GLY  20  -4.494  18.778 -32.271
  149    HA2  GLY  20           HA2      GLY  20  -2.223  19.159 -31.785
  150    HA3  GLY  20           HA3      GLY  20  -2.300  20.782 -32.497
  151    H    GLN  21           H        GLN  21  -4.308  19.130 -30.047
  152    HA   GLN  21           HA       GLN  21  -3.777  21.321 -28.122
  153    HB2  GLN  21           HB2      GLN  21  -6.465  20.796 -29.463
  154    HB3  GLN  21           HB3      GLN  21  -6.355  21.502 -27.866
  155    HG2  GLN  21           HG2      GLN  21  -6.413  23.431 -29.070
  156    HG3  GLN  21           HG3      GLN  21  -4.678  23.221 -29.001
  157   HE21  GLN  21          HE22      GLN  21  -3.541  23.135 -31.057
  158   HE22  GLN  21          HE21      GLN  21  -4.345  22.917 -32.584
  159    H    VAL  22           H        VAL  22  -4.455  20.762 -25.953
  160    HA   VAL  22           HA       VAL  22  -4.134  17.824 -25.625
  161    HB   VAL  22           HB       VAL  22  -3.060  18.395 -23.479
  162   HG11  VAL  22          HG11      VAL  22  -1.811  19.832 -25.852
  163   HG12  VAL  22          HG12      VAL  22  -0.966  19.219 -24.411
  164   HG13  VAL  22          HG13      VAL  22  -1.725  18.087 -25.537
  165   HG21  VAL  22          HG21      VAL  22  -4.107  20.579 -23.000
  166   HG22  VAL  22          HG22      VAL  22  -2.337  20.690 -23.014
  167   HG23  VAL  22          HG23      VAL  22  -3.267  21.302 -24.389
  168    H    MET  23           H        MET  23  -4.955  16.799 -23.767
  169    HA   MET  23           HA       MET  23  -7.665  17.221 -23.096
  170    HB2  MET  23           HB2      MET  23  -5.927  15.191 -22.742
  171    HB3  MET  23           HB3      MET  23  -5.778  15.878 -21.151
  172    HG2  MET  23           HG2      MET  23  -8.385  15.012 -22.471
  173    HG3  MET  23           HG3      MET  23  -7.470  14.073 -21.291
  174    HE1  MET  23           HE1      MET  23  -9.617  13.674 -19.818
  175    HE2  MET  23           HE2      MET  23 -10.706  14.975 -19.309
  176    HE3  MET  23           HE3      MET  23 -10.555  14.574 -21.037
  177    H    TRP  24           H        TRP  24  -8.564  18.673 -21.689
  178    HA   TRP  24           HA       TRP  24  -7.441  19.163 -19.140
  179    HB2  TRP  24           HB2      TRP  24  -6.407  20.988 -20.778
  180    HB3  TRP  24           HB3      TRP  24  -7.994  21.737 -20.630
  181    HD1  TRP  24           HD1      TRP  24  -7.751  23.632 -18.945
  182    HE1  TRP  24           HE1      TRP  24  -6.722  23.984 -16.636
  183    HE3  TRP  24           HE3      TRP  24  -5.249  19.190 -18.515
  184    HZ2  TRP  24           HZ2      TRP  24  -4.855  22.554 -14.864
  185    HZ3  TRP  24           HZ3      TRP  24  -3.814  18.749 -16.571
  186    HH2  TRP  24           HH2      TRP  24  -3.662  20.383 -14.711
  187    H    ALA  25           H        ALA  25  -9.280  19.256 -17.807
  188    HA   ALA  25           HA       ALA  25 -11.895  19.781 -19.065
  189    HB1  ALA  25           HB1      ALA  25 -11.072  17.144 -17.791
  190    HB2  ALA  25           HB2      ALA  25 -12.757  17.628 -18.080
  191    HB3  ALA  25           HB3      ALA  25 -11.644  17.413 -19.451
  192    H    ARG  26           H        ARG  26 -13.541  20.187 -17.516
  193    HA   ARG  26           HA       ARG  26 -12.472  21.832 -15.383
  194    HB2  ARG  26           HB2      ARG  26 -14.393  22.454 -16.842
  195    HB3  ARG  26           HB3      ARG  26 -15.341  21.127 -16.153
  196    HG2  ARG  26           HG2      ARG  26 -15.362  22.208 -13.979
  197    HG3  ARG  26           HG3      ARG  26 -14.174  23.421 -14.520
  198    HD2  ARG  26           HD2      ARG  26 -16.437  24.376 -14.466
  199    HD3  ARG  26           HD3      ARG  26 -15.750  24.361 -16.101
  200    HE   ARG  26           HE       ARG  26 -17.321  21.984 -15.707
  201   HH11  ARG  26          HH11      ARG  26 -17.791  25.490 -16.235
  202   HH12  ARG  26          HH12      ARG  26 -19.307  25.268 -17.036
  203   HH21  ARG  26          HH21      ARG  26 -19.191  21.709 -16.692
  204   HH22  ARG  26          HH22      ARG  26 -20.173  23.030 -17.309
  205    H    ARG  27           H        ARG  27 -12.611  21.372 -13.109
  206    HA   ARG  27           HA       ARG  27 -12.527  18.529 -12.676
  207    HB2  ARG  27           HB2      ARG  27 -10.978  20.246 -11.641
  208    HB3  ARG  27           HB3      ARG  27 -12.246  20.607 -10.488
  209    HG2  ARG  27           HG2      ARG  27 -10.876  17.908 -10.946
  210    HG3  ARG  27           HG3      ARG  27 -10.528  19.030  -9.634
  211    HD2  ARG  27           HD2      ARG  27 -12.809  18.636  -8.726
  212    HD3  ARG  27           HD3      ARG  27 -13.075  17.426 -10.002
  213    HE   ARG  27           HE       ARG  27 -10.725  16.621  -8.793
  214   HH11  ARG  27          HH11      ARG  27 -14.136  17.037  -7.765
  215   HH12  ARG  27          HH12      ARG  27 -13.968  15.937  -6.433
  216   HH21  ARG  27          HH21      ARG  27 -10.569  15.145  -7.218
  217   HH22  ARG  27          HH22      ARG  27 -11.876  14.786  -6.105
  218    H    PHE  28           H        PHE  28 -14.147  17.279 -12.180
  219    HA   PHE  28           HA       PHE  28 -16.846  17.819 -11.867
  220    HB2  PHE  28           HB2      PHE  28 -16.022  15.618 -12.319
  221    HB3  PHE  28           HB3      PHE  28 -14.990  15.625 -10.899
  222    HD1  PHE  28           HD2      PHE  28 -18.594  15.485 -11.942
  223    HD2  PHE  28           HD1      PHE  28 -15.661  14.716  -8.864
  224    HE1  PHE  28           HE2      PHE  28 -20.282  14.202 -10.646
  225    HE2  PHE  28           HE1      PHE  28 -17.360  13.420  -7.582
  226    HZ   PHE  28           HZ       PHE  28 -19.668  13.157  -8.477
  227    H    GLY  29           H        GLY  29 -18.049  18.755 -10.280
  228    HA2  GLY  29           HA2      GLY  29 -18.856  19.315  -8.245
  229    HA3  GLY  29           HA3      GLY  29 -17.695  18.202  -7.516
  230    H    GLN  30           H        GLN  30 -15.772  20.334  -9.212
  231    HA   GLN  30           HA       GLN  30 -15.429  22.132  -6.856
  232    HB2  GLN  30           HB2      GLN  30 -13.888  20.143  -7.116
  233    HB3  GLN  30           HB3      GLN  30 -13.338  20.845  -8.636
  234    HG2  GLN  30           HG2      GLN  30 -12.567  22.856  -7.392
  235    HG3  GLN  30           HG3      GLN  30 -13.113  22.107  -5.885
  236   HE21  GLN  30          HE22      GLN  30 -10.671  21.959  -8.508
  237   HE22  GLN  30          HE21      GLN  30  -9.592  20.857  -7.678
  238    H    HIS  31           H        HIS  31 -15.508  21.828 -10.380
  239    HA   HIS  31           HA       HIS  31 -15.719  23.251 -12.010
  240    HB2  HIS  31           HB2      HIS  31 -16.524  25.331  -9.980
  241    HB3  HIS  31           HB3      HIS  31 -16.908  25.316 -11.696
  242    HD1  HIS  31           HD1      HIS  31 -18.730  23.373 -12.500
  243    HD2  HIS  31           HD2      HIS  31 -18.022  23.802  -8.367
  244    HE1  HIS  31           HE1      HIS  31 -20.550  22.051 -11.321
  245    H    SER  32           H        SER  32 -13.029  23.289 -10.416
  246    HA   SER  32           HA       SER  32 -11.813  25.528 -11.966
  247    HB2  SER  32           HB2      SER  32  -9.859  25.118 -10.444
  248    HB3  SER  32           HB3      SER  32 -11.320  25.739  -9.665
  249    HG   SER  32           HG       SER  32 -10.478  24.081  -8.442
  250    H    TRP  33           H        TRP  33  -9.228  23.729 -11.725
  251    HA   TRP  33           HA       TRP  33  -9.930  21.734 -13.819
  252    HB2  TRP  33           HB2      TRP  33  -7.480  23.515 -13.828
  253    HB3  TRP  33           HB3      TRP  33  -7.931  22.297 -15.018
  254    HD1  TRP  33           HD1      TRP  33  -8.745  25.849 -13.913
  255    HE1  TRP  33           HE1      TRP  33 -10.035  27.067 -15.744
  256    HE3  TRP  33           HE3      TRP  33  -9.591  21.902 -17.048
  257    HZ2  TRP  33           HZ2      TRP  33 -11.178  26.436 -18.336
  258    HZ3  TRP  33           HZ3      TRP  33 -10.701  22.255 -19.247
  259    HH2  TRP  33           HH2      TRP  33 -11.446  24.525 -19.919
  260    H    GLN  34           H        GLN  34  -7.999  20.118 -14.050
  261    HA   GLN  34           HA       GLN  34  -6.498  19.652 -11.598
  262    HB2  GLN  34           HB2      GLN  34  -8.678  18.782 -10.994
  263    HB3  GLN  34           HB3      GLN  34  -8.808  17.877 -12.498
  264    HG2  GLN  34           HG2      GLN  34  -8.409  16.369 -10.722
  265    HG3  GLN  34           HG3      GLN  34  -6.978  16.378 -11.717
  266   HE21  GLN  34          HE22      GLN  34  -7.785  16.028  -8.618
  267   HE22  GLN  34          HE21      GLN  34  -6.484  16.899  -7.810
  268    H    PHE  35           H        PHE  35  -4.907  17.948 -11.906
  269    HA   PHE  35           HA       PHE  35  -4.107  17.720 -14.716
  270    HB2  PHE  35           HB2      PHE  35  -2.013  16.913 -13.945
  271    HB3  PHE  35           HB3      PHE  35  -2.413  18.365 -13.053
  272    HD1  PHE  35           HD1      PHE  35  -3.408  18.083 -10.656
  273    HD2  PHE  35           HD2      PHE  35  -1.444  14.892 -12.795
  274    HE1  PHE  35           HE1      PHE  35  -3.329  16.734  -8.576
  275    HE2  PHE  35           HE2      PHE  35  -1.221  13.621 -10.681
  276    HZ   PHE  35           HZ       PHE  35  -2.215  14.507  -8.576
  277    HA   PRO  36           HA       PRO  36  -5.856  13.647 -15.017
  278    HB2  PRO  36           HB2      PRO  36  -3.608  13.081 -16.926
  279    HB3  PRO  36           HB3      PRO  36  -5.351  12.741 -17.119
  280    HG2  PRO  36           HG2      PRO  36  -4.218  14.889 -18.366
  281    HG3  PRO  36           HG3      PRO  36  -5.835  15.026 -17.605
  282    HD2  PRO  36           HD2      PRO  36  -3.161  15.946 -16.525
  283    HD3  PRO  36           HD3      PRO  36  -4.763  16.748 -16.470
  284    H    GLN  37           H        GLN  37  -5.541  11.801 -13.868
  285    HA   GLN  37           HA       GLN  37  -2.884  10.632 -13.423
  286    HB2  GLN  37           HB2      GLN  37  -3.059  10.602 -10.994
  287    HB3  GLN  37           HB3      GLN  37  -2.762  12.190 -11.680
  288    HG2  GLN  37           HG2      GLN  37  -5.073  12.882 -11.271
  289    HG3  GLN  37           HG3      GLN  37  -5.525  11.259 -10.762
  290   HE21  GLN  37          HE22      GLN  37  -6.226  13.195  -9.022
  291   HE22  GLN  37          HE21      GLN  37  -5.143  13.197  -7.642
  292    H    GLY  38           H        GLY  38  -2.969   8.488 -12.802
  293    HA2  GLY  38           HA2      GLY  38  -5.637   7.129 -12.948
  294    HA3  GLY  38           HA3      GLY  38  -4.056   6.469 -13.354
  295    H    GLY  39           H        GLY  39  -3.609   4.896 -12.063
  296    HA2  GLY  39           HA2      GLY  39  -2.823   4.990  -9.430
  297    HA3  GLY  39           HA3      GLY  39  -4.533   4.496  -9.364
  298    H    ILE  40           H        ILE  40  -1.457   3.190  -9.549
  299    HA   ILE  40           HA       ILE  40  -2.111   1.058 -11.513
  300    HB   ILE  40           HB       ILE  40   0.347   1.955 -10.041
  301   HG12  ILE  40          HG12      ILE  40  -0.007   1.019 -12.905
  302   HG13  ILE  40          HG13      ILE  40  -0.423   2.664 -12.421
  303   HG21  ILE  40          HG21      ILE  40   1.582  -0.087 -10.754
  304   HG22  ILE  40          HG22      ILE  40   0.370  -0.416  -9.523
  305   HG23  ILE  40          HG23      ILE  40   0.029  -0.825 -11.221
  306   HD11  ILE  40          HD11      ILE  40   1.906   3.106 -11.805
  307   HD12  ILE  40          HD12      ILE  40   2.361   1.435 -12.212
  308   HD13  ILE  40          HD13      ILE  40   1.771   2.533 -13.469
  309    H    ASN  41           H        ASN  41  -3.116  -0.736 -10.932
  310    HA   ASN  41           HA       ASN  41  -3.638  -1.337  -8.101
  311    HB2  ASN  41           HB2      ASN  41  -4.344  -2.794 -10.689
  312    HB3  ASN  41           HB3      ASN  41  -4.775  -3.389  -9.100
  313   HD21  ASN  41          HD22      ASN  41  -5.306  -0.750 -11.438
  314   HD22  ASN  41          HD21      ASN  41  -6.798  -0.164 -10.701
  315    HA   PRO  42           HA       PRO  42  -0.083  -3.666  -7.355
  316    HB2  PRO  42           HB2      PRO  42  -0.900  -5.928  -5.949
  317    HB3  PRO  42           HB3      PRO  42  -0.762  -4.282  -5.264
  318    HG2  PRO  42           HG2      PRO  42  -3.243  -5.652  -6.356
  319    HG3  PRO  42           HG3      PRO  42  -3.064  -4.732  -4.828
  320    HD2  PRO  42           HD2      PRO  42  -4.121  -3.572  -7.018
  321    HD3  PRO  42           HD3      PRO  42  -2.983  -2.657  -5.984
  322    H    GLY  43           H        GLY  43   0.972  -4.434  -8.952
  323    HA2  GLY  43           HA2      GLY  43   1.913  -6.065 -10.317
  324    HA3  GLY  43           HA3      GLY  43   0.550  -7.147 -10.009
  325    H    GLU  44           H        GLU  44  -0.537  -4.006 -10.885
  326    HA   GLU  44           HA       GLU  44  -1.357  -4.889 -13.581
  327    HB2  GLU  44           HB2      GLU  44  -2.851  -3.699 -12.024
  328    HB3  GLU  44           HB3      GLU  44  -1.780  -2.287 -12.081
  329    HG2  GLU  44           HG2      GLU  44  -2.213  -2.015 -14.465
  330    HG3  GLU  44           HG3      GLU  44  -3.189  -3.491 -14.484
  331    H    SER  45           H        SER  45  -0.120  -4.553 -15.342
  332    HA   SER  45           HA       SER  45   2.291  -3.027 -15.250
  333    HB2  SER  45           HB2      SER  45   2.020  -3.697 -17.851
  334    HB3  SER  45           HB3      SER  45   2.645  -4.763 -16.587
  335    HG   SER  45           HG       SER  45   1.105  -5.996 -17.464
  336    H    ALA  46           H        ALA  46   2.840  -1.309 -16.756
  337    HA   ALA  46           HA       ALA  46   1.385   0.921 -16.071
  338    HB1  ALA  46           HB1      ALA  46   2.801   2.134 -17.637
  339    HB2  ALA  46           HB2      ALA  46   3.767   0.869 -16.842
  340    HB3  ALA  46           HB3      ALA  46   3.199   0.628 -18.509
  341    H    GLU  47           H        GLU  47   1.039  -0.943 -19.164
  342    HA   GLU  47           HA       GLU  47  -0.546   1.162 -20.352
  343    HB2  GLU  47           HB2      GLU  47  -0.582  -1.727 -21.271
  344    HB3  GLU  47           HB3      GLU  47  -0.919  -0.268 -22.174
  345    HG2  GLU  47           HG2      GLU  47   1.160  -0.941 -22.965
  346    HG3  GLU  47           HG3      GLU  47   1.537   0.374 -21.854
  347    H    GLN  48           H        GLN  48  -1.167  -1.867 -18.569
  348    HA   GLN  48           HA       GLN  48  -3.979  -1.973 -19.005
  349    HB2  GLN  48           HB2      GLN  48  -2.145  -3.211 -16.895
  350    HB3  GLN  48           HB3      GLN  48  -3.870  -3.516 -16.954
  351    HG2  GLN  48           HG2      GLN  48  -2.474  -5.279 -18.079
  352    HG3  GLN  48           HG3      GLN  48  -3.756  -4.596 -19.070
  353   HE21  GLN  48          HE22      GLN  48  -0.195  -4.195 -18.437
  354   HE22  GLN  48          HE21      GLN  48   0.196  -3.508 -19.993
  355    H    ALA  49           H        ALA  49  -1.987  -0.602 -16.353
  356    HA   ALA  49           HA       ALA  49  -4.124   0.645 -14.926
  357    HB1  ALA  49           HB1      ALA  49  -1.235   1.513 -15.282
  358    HB2  ALA  49           HB2      ALA  49  -2.360   2.056 -14.014
  359    HB3  ALA  49           HB3      ALA  49  -1.831   0.355 -14.057
  360    H    MET  50           H        MET  50  -2.462   1.561 -17.957
  361    HA   MET  50           HA       MET  50  -3.401   4.291 -17.837
  362    HB2  MET  50           HB2      MET  50  -1.307   3.692 -18.980
  363    HB3  MET  50           HB3      MET  50  -2.204   2.749 -20.162
  364    HG2  MET  50           HG2      MET  50  -2.657   5.704 -19.658
  365    HG3  MET  50           HG3      MET  50  -1.549   5.062 -20.847
  366    HE1  MET  50           HE1      MET  50  -3.613   3.632 -23.682
  367    HE2  MET  50           HE2      MET  50  -2.025   4.187 -23.111
  368    HE3  MET  50           HE3      MET  50  -2.786   2.749 -22.379
  369    H    TYR  51           H        TYR  51  -4.566   1.329 -19.462
  370    HA   TYR  51           HA       TYR  51  -6.839   2.747 -20.444
  371    HB2  TYR  51           HB2      TYR  51  -6.589  -0.210 -19.802
  372    HB3  TYR  51           HB3      TYR  51  -7.878   0.542 -20.741
  373    HD1  TYR  51           HD2      TYR  51  -7.157   1.913 -22.879
  374    HD2  TYR  51           HD1      TYR  51  -4.557  -0.816 -20.835
  375    HE1  TYR  51           HE2      TYR  51  -5.884   1.599 -24.971
  376    HE2  TYR  51           HE1      TYR  51  -3.171  -1.068 -22.877
  377    HH   TYR  51           HH       TYR  51  -4.077   0.498 -26.005
  378    H    ARG  52           H        ARG  52  -6.152   1.214 -17.302
  379    HA   ARG  52           HA       ARG  52  -8.767   1.545 -16.226
  380    HB2  ARG  52           HB2      ARG  52  -6.542   0.394 -15.263
  381    HB3  ARG  52           HB3      ARG  52  -6.297   1.977 -14.528
  382    HG2  ARG  52           HG2      ARG  52  -7.440   0.763 -12.887
  383    HG3  ARG  52           HG3      ARG  52  -8.695   1.764 -13.622
  384    HD2  ARG  52           HD2      ARG  52  -9.602  -0.449 -13.341
  385    HD3  ARG  52           HD3      ARG  52  -9.316  -0.251 -15.082
  386    HE   ARG  52           HE       ARG  52  -6.966  -1.391 -14.029
  387   HH11  ARG  52          HH11      ARG  52 -10.392  -2.410 -14.277
  388   HH12  ARG  52          HH12      ARG  52  -9.996  -4.089 -14.337
  389   HH21  ARG  52          HH21      ARG  52  -6.477  -3.450 -14.123
  390   HH22  ARG  52          HH22      ARG  52  -7.660  -4.745 -14.249
  391    H    ALA  53           H        ALA  53  -5.939   3.781 -16.206
  392    HA   ALA  53           HA       ALA  53  -7.224   5.907 -14.870
  393    HB1  ALA  53           HB1      ALA  53  -4.941   5.916 -16.881
  394    HB2  ALA  53           HB2      ALA  53  -5.316   7.222 -15.735
  395    HB3  ALA  53           HB3      ALA  53  -4.767   5.616 -15.160
  396    H    LEU  54           H        LEU  54  -7.103   5.017 -18.284
  397    HA   LEU  54           HA       LEU  54  -8.097   7.410 -19.453
  398    HB2  LEU  54           HB2      LEU  54  -6.967   5.656 -20.687
  399    HB3  LEU  54           HB3      LEU  54  -8.105   4.469 -20.081
  400    HG   LEU  54           HG       LEU  54  -9.921   5.415 -21.491
  401   HD11  LEU  54          HD11      LEU  54  -7.620   7.103 -22.579
  402   HD12  LEU  54          HD12      LEU  54  -9.203   6.896 -23.370
  403   HD13  LEU  54          HD13      LEU  54  -9.097   7.711 -21.795
  404   HD21  LEU  54          HD21      LEU  54  -8.698   3.478 -22.043
  405   HD22  LEU  54          HD22      LEU  54  -8.983   4.420 -23.517
  406   HD23  LEU  54          HD23      LEU  54  -7.358   4.418 -22.753
  407    H    PHE  55           H        PHE  55  -9.604   4.466 -18.175
  408    HA   PHE  55           HA       PHE  55 -12.342   5.268 -18.590
  409    HB2  PHE  55           HB2      PHE  55 -12.186   3.008 -18.358
  410    HB3  PHE  55           HB3      PHE  55 -10.893   3.067 -17.185
  411    HD1  PHE  55           HD1      PHE  55 -14.573   3.221 -17.600
  412    HD2  PHE  55           HD2      PHE  55 -11.269   3.168 -14.834
  413    HE1  PHE  55           HE1      PHE  55 -16.137   2.673 -15.733
  414    HE2  PHE  55           HE2      PHE  55 -12.837   2.664 -12.966
  415    HZ   PHE  55           HZ       PHE  55 -15.275   2.424 -13.419
  416    H    GLU  56           H        GLU  56 -10.199   5.398 -15.638
  417    HA   GLU  56           HA       GLU  56 -12.095   6.523 -13.945
  418    HB2  GLU  56           HB2      GLU  56  -9.071   6.810 -14.048
  419    HB3  GLU  56           HB3      GLU  56 -10.045   7.512 -12.761
  420    HG2  GLU  56           HG2      GLU  56 -10.912   5.318 -12.126
  421    HG3  GLU  56           HG3      GLU  56 -10.010   4.540 -13.416
  422    H    GLU  57           H        GLU  57  -9.813   8.220 -16.105
  423    HA   GLU  57           HA       GLU  57 -10.695  10.813 -15.138
  424    HB2  GLU  57           HB2      GLU  57  -8.639  10.027 -17.244
  425    HB3  GLU  57           HB3      GLU  57  -8.849  11.634 -16.554
  426    HG2  GLU  57           HG2      GLU  57  -8.098   9.155 -14.936
  427    HG3  GLU  57           HG3      GLU  57  -6.951  10.304 -15.606
  428    H    VAL  58           H        VAL  58 -10.722   9.091 -18.311
  429    HA   VAL  58           HA       VAL  58 -12.176  11.389 -19.444
  430    HB   VAL  58           HB       VAL  58 -11.075   9.166 -21.144
  431   HG11  VAL  58          HG11      VAL  58 -10.723  10.993 -22.718
  432   HG12  VAL  58          HG12      VAL  58 -12.371  11.083 -22.080
  433   HG13  VAL  58          HG13      VAL  58 -11.135  12.196 -21.474
  434   HG21  VAL  58          HG21      VAL  58  -9.098   9.586 -19.732
  435   HG22  VAL  58          HG22      VAL  58  -8.860  10.388 -21.277
  436   HG23  VAL  58          HG23      VAL  58  -9.332  11.339 -19.852
  437    H    GLY  59           H        GLY  59 -12.769   8.131 -18.359
  438    HA2  GLY  59           HA2      GLY  59 -14.554   6.747 -18.534
  439    HA3  GLY  59           HA3      GLY  59 -15.561   8.142 -18.954
  440    H    LEU  60           H        LEU  60 -12.841   6.301 -20.329
  441    HA   LEU  60           HA       LEU  60 -14.278   5.631 -22.812
  442    HB2  LEU  60           HB2      LEU  60 -11.495   6.852 -22.565
  443    HB3  LEU  60           HB3      LEU  60 -12.049   5.991 -23.985
  444    HG   LEU  60           HG       LEU  60 -13.143   8.612 -22.918
  445   HD11  LEU  60          HD11      LEU  60 -10.929   8.756 -23.996
  446   HD12  LEU  60          HD12      LEU  60 -11.534   7.875 -25.416
  447   HD13  LEU  60          HD13      LEU  60 -12.137   9.489 -25.059
  448   HD21  LEU  60          HD21      LEU  60 -14.469   8.699 -25.063
  449   HD22  LEU  60          HD22      LEU  60 -14.021   7.013 -25.372
  450   HD23  LEU  60          HD23      LEU  60 -15.018   7.431 -23.972
  451    H    SER  61           H        SER  61 -13.104   3.725 -23.828
  452    HA   SER  61           HA       SER  61 -11.879   2.040 -21.675
  453    HB2  SER  61           HB2      SER  61 -13.759   1.237 -23.913
  454    HB3  SER  61           HB3      SER  61 -13.148   0.195 -22.614
  455    HG   SER  61           HG       SER  61 -15.251   0.951 -22.112
  456    H    ARG  62           H        ARG  62 -10.888  -0.020 -22.884
  457    HA   ARG  62           HA       ARG  62  -8.586   1.026 -24.157
  458    HB2  ARG  62           HB2      ARG  62  -7.666  -1.205 -23.860
  459    HB3  ARG  62           HB3      ARG  62  -8.548  -0.699 -22.433
  460    HG2  ARG  62           HG2      ARG  62 -10.530  -2.118 -23.400
  461    HG3  ARG  62           HG3      ARG  62  -9.291  -2.824 -24.436
  462    HD2  ARG  62           HD2      ARG  62  -9.343  -4.281 -22.599
  463    HD3  ARG  62           HD3      ARG  62  -7.937  -3.273 -22.294
  464    HE   ARG  62           HE       ARG  62  -8.965  -2.352 -20.432
  465   HH11  ARG  62          HH22      ARG  62 -11.376  -4.273 -22.220
  466   HH12  ARG  62          HH21      ARG  62 -12.548  -4.236 -20.953
  467   HH21  ARG  62          HH11      ARG  62 -10.537  -2.301 -18.751
  468   HH22  ARG  62          HH12      ARG  62 -12.053  -3.101 -18.946
  469    H    LYS  63           H        LYS  63 -10.166   1.840 -25.893
  470    HA   LYS  63           HA       LYS  63  -9.661   0.435 -28.411
  471    HB2  LYS  63           HB2      LYS  63 -12.009  -0.019 -28.920
  472    HB3  LYS  63           HB3      LYS  63 -11.536  -0.850 -27.432
  473    HG2  LYS  63           HG2      LYS  63 -12.661   0.854 -26.069
  474    HG3  LYS  63           HG3      LYS  63 -13.094   1.766 -27.530
  475    HD2  LYS  63           HD2      LYS  63 -14.573   0.030 -28.294
  476    HD3  LYS  63           HD3      LYS  63 -14.012  -1.076 -27.034
  477    HE2  LYS  63           HE2      LYS  63 -16.195  -0.143 -26.440
  478    HE3  LYS  63           HE3      LYS  63 -14.948   0.312 -25.273
  479    HZ1  LYS  63           HZ1      LYS  63 -15.919   2.121 -27.432
  480    HZ2  LYS  63           HZ2      LYS  63 -16.452   2.157 -25.892
  481    HZ3  LYS  63           HZ3      LYS  63 -14.895   2.537 -26.207
  482    H    ASP  64           H        ASP  64 -10.963   3.145 -26.552
  483    HA   ASP  64           HA       ASP  64 -12.010   4.575 -28.846
  484    HB2  ASP  64           HB2      ASP  64 -11.610   5.207 -25.904
  485    HB3  ASP  64           HB3      ASP  64 -12.427   6.306 -27.007
  486    H    VAL  65           H        VAL  65  -8.872   4.131 -28.049
  487    HA   VAL  65           HA       VAL  65  -7.944   6.775 -28.914
  488    HB   VAL  65           HB       VAL  65  -6.481   6.961 -26.902
  489   HG11  VAL  65          HG11      VAL  65  -9.405   6.905 -26.070
  490   HG12  VAL  65          HG12      VAL  65  -8.113   7.937 -25.443
  491   HG13  VAL  65          HG13      VAL  65  -8.715   8.165 -27.102
  492   HG21  VAL  65          HG21      VAL  65  -7.017   5.646 -24.858
  493   HG22  VAL  65          HG22      VAL  65  -8.221   4.716 -25.744
  494   HG23  VAL  65          HG23      VAL  65  -6.497   4.575 -26.157
  495    H    ARG  66           H        ARG  66  -5.446   6.704 -28.951
  496    HA   ARG  66           HA       ARG  66  -4.390   4.069 -29.899
  497    HB2  ARG  66           HB2      ARG  66  -5.274   5.161 -31.866
  498    HB3  ARG  66           HB3      ARG  66  -4.790   6.751 -31.303
  499    HG2  ARG  66           HG2      ARG  66  -3.430   6.220 -33.114
  500    HG3  ARG  66           HG3      ARG  66  -2.420   6.194 -31.679
  501    HD2  ARG  66           HD2      ARG  66  -3.648   3.576 -32.589
  502    HD3  ARG  66           HD3      ARG  66  -2.418   4.284 -33.645
  503    HE   ARG  66           HE       ARG  66  -1.121   4.396 -31.285
  504   HH11  ARG  66          HH11      ARG  66  -2.714   1.686 -32.966
  505   HH12  ARG  66          HH12      ARG  66  -1.576   0.515 -32.398
  506   HH21  ARG  66          HH21      ARG  66   0.359   2.897 -30.583
  507   HH22  ARG  66          HH22      ARG  66   0.217   1.214 -30.992
  508    H    ILE  67           H        ILE  67  -2.358   3.841 -28.774
  509    HA   ILE  67           HA       ILE  67  -1.244   6.208 -27.459
  510    HB   ILE  67           HB       ILE  67  -0.198   3.374 -27.761
  511   HG12  ILE  67          HG12      ILE  67  -1.379   4.496 -25.207
  512   HG13  ILE  67          HG13      ILE  67  -2.483   3.884 -26.433
  513   HG21  ILE  67          HG21      ILE  67   1.634   4.887 -27.228
  514   HG22  ILE  67          HG22      ILE  67   0.691   5.651 -25.928
  515   HG23  ILE  67          HG23      ILE  67   1.242   3.961 -25.786
  516   HD11  ILE  67          HD11      ILE  67  -1.335   1.721 -26.481
  517   HD12  ILE  67          HD12      ILE  67  -0.218   2.268 -25.200
  518   HD13  ILE  67          HD13      ILE  67  -1.946   2.100 -24.858
  519    H    LEU  68           H        LEU  68   0.297   7.525 -28.271
  520    HA   LEU  68           HA       LEU  68   1.690   6.636 -30.803
  521    HB2  LEU  68           HB2      LEU  68   0.895   9.331 -29.803
  522    HB3  LEU  68           HB3      LEU  68   2.462   9.244 -30.553
  523    HG   LEU  68           HG       LEU  68   0.555   9.882 -32.086
  524   HD11  LEU  68          HD11      LEU  68   2.749   9.205 -32.941
  525   HD12  LEU  68          HD12      LEU  68   2.271   7.497 -32.890
  526   HD13  LEU  68          HD13      LEU  68   1.453   8.624 -33.996
  527   HD21  LEU  68          HD21      LEU  68  -0.856   8.184 -33.042
  528   HD22  LEU  68          HD22      LEU  68  -0.060   6.894 -32.133
  529   HD23  LEU  68          HD23      LEU  68  -1.039   8.097 -31.272
  530    H    ALA  69           H        ALA  69   2.135   8.106 -27.613
  531    HA   ALA  69           HA       ALA  69   4.902   7.028 -27.450
  532    HB1  ALA  69           HB1      ALA  69   5.080   9.282 -28.513
  533    HB2  ALA  69           HB2      ALA  69   4.198   9.996 -27.152
  534    HB3  ALA  69           HB3      ALA  69   5.797   9.271 -26.891
  535    H    SER  70           H        SER  70   5.827   7.482 -25.212
  536    HA   SER  70           HA       SER  70   3.941   8.235 -23.146
  537    HB2  SER  70           HB2      SER  70   4.372   6.269 -21.742
  538    HB3  SER  70           HB3      SER  70   3.506   5.841 -23.220
  539    HG   SER  70           HG       SER  70   5.372   4.963 -24.082
  540    H    THR  71           H        THR  71   5.286   8.607 -21.007
  541    HA   THR  71           HA       THR  71   7.659  10.039 -21.824
  542    HB   THR  71           HB       THR  71   8.001  10.290 -19.305
  543    HG1  THR  71           HG1      THR  71   6.908   8.702 -18.377
  544   HG21  THR  71          HG21      THR  71   6.900  12.037 -20.559
  545   HG22  THR  71          HG22      THR  71   5.381  11.126 -20.610
  546   HG23  THR  71          HG23      THR  71   5.982  11.763 -19.064
  547    H    ARG  72           H        ARG  72   9.850   9.519 -21.580
  548    HA   ARG  72           HA       ARG  72  10.330   6.782 -22.128
  549    HB2  ARG  72           HB2      ARG  72  12.156   9.174 -21.669
  550    HB3  ARG  72           HB3      ARG  72  12.793   7.562 -22.038
  551    HG2  ARG  72           HG2      ARG  72  11.485   7.442 -24.092
  552    HG3  ARG  72           HG3      ARG  72  10.764   9.024 -23.803
  553    HD2  ARG  72           HD2      ARG  72  13.777   8.682 -23.988
  554    HD3  ARG  72           HD3      ARG  72  12.770   8.769 -25.442
  555    HE   ARG  72           HE       ARG  72  12.063  10.977 -23.795
  556   HH11  ARG  72          HH21      ARG  72  14.823   9.850 -25.769
  557   HH12  ARG  72          HH22      ARG  72  15.304  11.438 -26.239
  558   HH21  ARG  72          HH11      ARG  72  12.696  13.046 -24.399
  559   HH22  ARG  72          HH12      ARG  72  14.055  13.310 -25.460
  560    H    ASN  73           H        ASN  73  10.245   8.387 -19.059
  561    HA   ASN  73           HA       ASN  73  10.681   5.843 -17.753
  562    HB2  ASN  73           HB2      ASN  73  12.232   8.328 -16.878
  563    HB3  ASN  73           HB3      ASN  73  12.032   6.872 -15.907
  564   HD21  ASN  73          HD22      ASN  73  13.904   8.295 -18.507
  565   HD22  ASN  73          HD21      ASN  73  14.921   6.904 -18.772
  566    H    TRP  74           H        TRP  74  10.077   6.341 -15.276
  567    HA   TRP  74           HA       TRP  74   7.479   7.646 -15.244
  568    HB2  TRP  74           HB2      TRP  74   9.167   6.542 -12.955
  569    HB3  TRP  74           HB3      TRP  74   7.468   6.996 -12.891
  570    HD1  TRP  74           HD1      TRP  74   9.795   4.332 -14.399
  571    HE1  TRP  74           HE1      TRP  74   8.450   2.368 -15.272
  572    HE3  TRP  74           HE3      TRP  74   5.098   5.946 -13.164
  573    HZ2  TRP  74           HZ2      TRP  74   5.691   1.682 -15.658
  574    HZ3  TRP  74           HZ3      TRP  74   3.117   4.593 -13.811
  575    HH2  TRP  74           HH2      TRP  74   3.370   2.543 -15.147
  576    H    LEU  75           H        LEU  75   7.096   9.719 -14.687
  577    HA   LEU  75           HA       LEU  75   9.291  11.498 -13.857
  578    HB2  LEU  75           HB2      LEU  75   6.412  11.883 -14.756
  579    HB3  LEU  75           HB3      LEU  75   7.153  13.105 -13.758
  580    HG   LEU  75           HG       LEU  75   7.311  13.755 -16.042
  581   HD11  LEU  75          HD11      LEU  75   9.608  14.354 -16.160
  582   HD12  LEU  75          HD12      LEU  75   9.244  14.211 -14.427
  583   HD13  LEU  75          HD13      LEU  75  10.139  12.927 -15.258
  584   HD21  LEU  75          HD21      LEU  75   7.254  11.482 -17.056
  585   HD22  LEU  75          HD22      LEU  75   8.510  12.526 -17.755
  586   HD23  LEU  75          HD23      LEU  75   8.956  11.251 -16.605
  587    H    ARG  76           H        ARG  76   8.966  12.844 -11.942
  588    HA   ARG  76           HA       ARG  76   7.164  11.928  -9.844
  589    HB2  ARG  76           HB2      ARG  76   9.086  11.476  -8.246
  590    HB3  ARG  76           HB3      ARG  76   8.708  10.225  -9.418
  591    HG2  ARG  76           HG2      ARG  76  10.609  10.898 -10.828
  592    HG3  ARG  76           HG3      ARG  76  11.003  12.209  -9.689
  593    HD2  ARG  76           HD2      ARG  76  11.332  10.514  -7.903
  594    HD3  ARG  76           HD3      ARG  76  10.948   9.229  -9.075
  595    HE   ARG  76           HE       ARG  76  13.049  10.818 -10.129
  596   HH11  ARG  76          HH11      ARG  76  12.540   8.492  -7.488
  597   HH12  ARG  76          HH12      ARG  76  14.177   7.944  -7.469
  598   HH21  ARG  76          HH21      ARG  76  15.229  10.086 -10.107
  599   HH22  ARG  76          HH22      ARG  76  15.738   8.873  -8.991
  600    H    TYR  77           H        TYR  77   7.131  13.440  -8.101
  601    HA   TYR  77           HA       TYR  77   8.930  15.728  -8.059
  602    HB2  TYR  77           HB2      TYR  77   6.925  17.321  -7.873
  603    HB3  TYR  77           HB3      TYR  77   7.365  16.772  -9.462
  604    HD1  TYR  77           HD2      TYR  77   4.934  15.983  -6.665
  605    HD2  TYR  77           HD1      TYR  77   5.770  15.861 -10.894
  606    HE1  TYR  77           HE2      TYR  77   2.649  15.257  -7.086
  607    HE2  TYR  77           HE1      TYR  77   3.499  15.081 -11.348
  608    HH   TYR  77           HH       TYR  77   1.400  14.507 -10.412
  609    H    LYS  78           H        LYS  78   8.077  17.068  -5.993
  610    HA   LYS  78           HA       LYS  78   7.450  15.047  -3.877
  611    HB2  LYS  78           HB2      LYS  78   9.856  15.886  -3.887
  612    HB3  LYS  78           HB3      LYS  78   9.238  17.512  -3.658
  613    HG2  LYS  78           HG2      LYS  78   9.933  16.737  -1.525
  614    HG3  LYS  78           HG3      LYS  78   8.183  16.792  -1.507
  615    HD2  LYS  78           HD2      LYS  78   8.921  14.812  -0.344
  616    HD3  LYS  78           HD3      LYS  78   8.078  14.338  -1.807
  617    HE2  LYS  78           HE2      LYS  78   9.981  12.897  -1.586
  618    HE3  LYS  78           HE3      LYS  78  10.291  13.963  -2.947
  619    HZ1  LYS  78           HZ1      LYS  78  11.425  14.328  -0.212
  620    HZ2  LYS  78           HZ2      LYS  78  12.230  13.723  -1.492
  621    HZ3  LYS  78           HZ3      LYS  78  11.759  15.283  -1.502
  622    H    LEU  79           H        LEU  79   5.622  15.570  -2.742
  623    HA   LEU  79           HA       LEU  79   4.059  17.893  -3.500
  624    HB2  LEU  79           HB2      LEU  79   3.774  15.871  -1.235
  625    HB3  LEU  79           HB3      LEU  79   2.604  17.147  -1.536
  626    HG   LEU  79           HG       LEU  79   3.321  14.993  -3.570
  627   HD11  LEU  79          HD11      LEU  79   0.925  15.129  -1.690
  628   HD12  LEU  79          HD12      LEU  79   1.210  13.906  -2.950
  629   HD13  LEU  79          HD13      LEU  79   2.286  13.993  -1.553
  630   HD21  LEU  79          HD21      LEU  79   0.993  16.957  -3.469
  631   HD22  LEU  79          HD22      LEU  79   2.364  17.011  -4.608
  632   HD23  LEU  79          HD23      LEU  79   1.219  15.668  -4.667
  633    HA   PRO  80           HA       PRO  80   5.850  20.697  -0.426
  634    HB2  PRO  80           HB2      PRO  80   3.773  22.423  -0.007
  635    HB3  PRO  80           HB3      PRO  80   4.685  22.401  -1.552
  636    HG2  PRO  80           HG2      PRO  80   2.131  20.898  -0.886
  637    HG3  PRO  80           HG3      PRO  80   2.393  22.043  -2.278
  638    HD2  PRO  80           HD2      PRO  80   2.654  19.396  -2.647
  639    HD3  PRO  80           HD3      PRO  80   3.886  20.492  -3.339
  640    H    LYS  81           H        LYS  81   5.619  20.992   1.922
  641    HA   LYS  81           HA       LYS  81   4.833  18.597   3.071
  642    HB2  LYS  81           HB2      LYS  81   5.293  21.283   4.459
  643    HB3  LYS  81           HB3      LYS  81   5.265  19.747   5.305
  644    HG2  LYS  81           HG2      LYS  81   7.252  20.447   3.097
  645    HG3  LYS  81           HG3      LYS  81   7.559  20.693   4.803
  646    HD2  LYS  81           HD2      LYS  81   6.943  17.974   3.567
  647    HD3  LYS  81           HD3      LYS  81   8.566  18.598   3.776
  648    HE2  LYS  81           HE2      LYS  81   6.609  18.161   6.088
  649    HE3  LYS  81           HE3      LYS  81   7.803  16.981   5.551
  650    HZ1  LYS  81           HZ1      LYS  81   9.558  18.580   6.084
  651    HZ2  LYS  81           HZ2      LYS  81   8.460  19.669   6.634
  652    HZ3  LYS  81           HZ3      LYS  81   8.657  18.242   7.395
  653    H    ARG  82           H        ARG  82   2.877  21.452   2.805
  654    HA   ARG  82           HA       ARG  82   0.838  20.612   4.639
  655    HB2  ARG  82           HB2      ARG  82  -0.418  22.515   3.821
  656    HB3  ARG  82           HB3      ARG  82   1.262  22.947   4.070
  657    HG2  ARG  82           HG2      ARG  82   1.392  22.355   1.399
  658    HG3  ARG  82           HG3      ARG  82  -0.327  22.704   1.517
  659    HD2  ARG  82           HD2      ARG  82   0.799  24.721   0.886
  660    HD3  ARG  82           HD3      ARG  82   0.260  24.922   2.561
  661    HE   ARG  82           HE       ARG  82   2.944  23.883   2.519
  662   HH11  ARG  82          HH11      ARG  82   1.175  26.890   1.828
  663   HH12  ARG  82          HH12      ARG  82   2.507  27.931   2.188
  664   HH21  ARG  82          HH21      ARG  82   4.730  25.289   3.026
  665   HH22  ARG  82          HH22      ARG  82   4.564  26.995   2.868
  666    H    LEU  83           H        LEU  83   1.489  19.770   1.294
  667    HA   LEU  83           HA       LEU  83  -1.255  18.700   0.988
  668    HB2  LEU  83           HB2      LEU  83  -0.263  20.303  -0.728
  669    HB3  LEU  83           HB3      LEU  83   0.849  18.994  -1.164
  670    HG   LEU  83           HG       LEU  83  -1.084  17.568  -1.826
  671   HD11  LEU  83          HD11      LEU  83  -2.758  20.012  -1.083
  672   HD12  LEU  83          HD12      LEU  83  -3.338  18.646  -2.069
  673   HD13  LEU  83          HD13      LEU  83  -2.882  18.378  -0.392
  674   HD21  LEU  83          HD21      LEU  83  -1.143  20.364  -3.060
  675   HD22  LEU  83          HD22      LEU  83   0.049  19.114  -3.442
  676   HD23  LEU  83          HD23      LEU  83  -1.657  18.851  -3.842
  677    H    VAL  84           H        VAL  84   2.066  17.673   1.478
  678    HA   VAL  84           HA       VAL  84   1.930  14.942   0.704
  679    HB   VAL  84           HB       VAL  84   3.078  16.243   3.240
  680   HG11  VAL  84          HG11      VAL  84   3.416  13.347   2.334
  681   HG12  VAL  84          HG12      VAL  84   4.377  14.138   3.600
  682   HG13  VAL  84          HG13      VAL  84   2.649  13.890   3.825
  683   HG21  VAL  84          HG21      VAL  84   5.258  15.943   2.211
  684   HG22  VAL  84          HG22      VAL  84   4.536  15.113   0.824
  685   HG23  VAL  84          HG23      VAL  84   4.217  16.835   1.095
  686    H    ARG  85           H        ARG  85   1.008  13.234   1.341
  687    HA   ARG  85           HA       ARG  85  -1.449  13.743   2.861
  688    HB2  ARG  85           HB2      ARG  85  -1.264  12.571   0.513
  689    HB3  ARG  85           HB3      ARG  85  -0.760  11.154   1.443
  690    HG2  ARG  85           HG2      ARG  85  -3.082  10.901   1.383
  691    HG3  ARG  85           HG3      ARG  85  -2.826  11.705   2.938
  692    HD2  ARG  85           HD2      ARG  85  -4.558  13.003   2.096
  693    HD3  ARG  85           HD3      ARG  85  -3.162  13.936   1.483
  694    HE   ARG  85           HE       ARG  85  -3.866  11.878  -0.342
  695   HH11  ARG  85          HH21      ARG  85  -5.128  14.994   0.815
  696   HH12  ARG  85          HH22      ARG  85  -5.972  15.365  -0.644
  697   HH21  ARG  85          HH11      ARG  85  -4.969  12.398  -2.326
  698   HH22  ARG  85          HH12      ARG  85  -5.877  13.858  -2.463
  699    H    TRP  86           H        TRP  86  -0.950  13.763   4.981
  700    HA   TRP  86           HA       TRP  86   0.787  11.736   6.157
  701    HB2  TRP  86           HB2      TRP  86  -0.853  13.940   7.430
  702    HB3  TRP  86           HB3      TRP  86   0.376  12.970   8.232
  703    HD1  TRP  86           HD1      TRP  86  -0.037  15.975   5.991
  704    HE1  TRP  86           HE1      TRP  86   2.209  17.011   5.363
  705    HE3  TRP  86           HE3      TRP  86   3.071  12.444   8.019
  706    HZ2  TRP  86           HZ2      TRP  86   5.013  16.407   5.716
  707    HZ3  TRP  86           HZ3      TRP  86   5.530  12.686   7.832
  708    HH2  TRP  86           HH2      TRP  86   6.517  14.652   6.677
  709    H    ASP  87           H        ASP  87  -2.361  11.540   5.032
  710    HA   ASP  87           HA       ASP  87  -3.592  10.284   7.386
  711    HB2  ASP  87           HB2      ASP  87  -4.957  11.623   5.857
  712    HB3  ASP  87           HB3      ASP  87  -4.491  10.595   4.499
  713    H    THR  88           H        THR  88  -1.770   9.376   4.485
  714    HA   THR  88           HA       THR  88  -2.696   6.639   4.486
  715    HB   THR  88           HB       THR  88  -0.809   6.764   2.585
  716    HG1  THR  88           HG1      THR  88  -0.835   8.913   1.718
  717   HG21  THR  88          HG21      THR  88  -3.476   8.235   2.384
  718   HG22  THR  88          HG22      THR  88  -2.544   7.567   1.023
  719   HG23  THR  88          HG23      THR  88  -3.267   6.477   2.216
  720    H    LYS  89           H        LYS  89  -1.118   4.866   4.476
  721    HA   LYS  89           HA       LYS  89   1.327   5.328   6.081
  722    HB2  LYS  89           HB2      LYS  89  -0.751   3.217   6.766
  723    HB3  LYS  89           HB3      LYS  89   0.866   3.325   7.466
  724    HG2  LYS  89           HG2      LYS  89  -1.281   5.461   7.688
  725    HG3  LYS  89           HG3      LYS  89  -0.953   4.249   8.919
  726    HD2  LYS  89           HD2      LYS  89   1.204   5.142   9.420
  727    HD3  LYS  89           HD3      LYS  89   1.212   6.206   8.020
  728    HE2  LYS  89           HE2      LYS  89  -0.642   6.461  10.422
  729    HE3  LYS  89           HE3      LYS  89   0.795   7.434  10.096
  730    HZ1  LYS  89           HZ1      LYS  89  -1.005   8.709   9.322
  731    HZ2  LYS  89           HZ2      LYS  89  -0.374   8.079   7.940
  732    HZ3  LYS  89           HZ3      LYS  89  -1.748   7.452   8.585
  733    HA   PRO  90           HA       PRO  90   3.440   5.029   5.608
  734    HB2  PRO  90           HB2      PRO  90   5.081   5.468   3.456
  735    HB3  PRO  90           HB3      PRO  90   5.236   4.060   4.552
  736    HG2  PRO  90           HG2      PRO  90   3.805   4.192   1.884
  737    HG3  PRO  90           HG3      PRO  90   4.983   2.960   2.435
  738    HD2  PRO  90           HD2      PRO  90   2.316   2.519   2.592
  739    HD3  PRO  90           HD3      PRO  90   3.397   1.995   3.917
  740    H    VAL  91           H        VAL  91   3.730   7.323   5.267
  741    HA   VAL  91           HA       VAL  91   1.444   8.665   4.188
  742    HB   VAL  91           HB       VAL  91   2.679  10.725   4.797
  743   HG11  VAL  91          HG11      VAL  91   2.645  10.361   7.216
  744   HG12  VAL  91          HG12      VAL  91   1.290   9.527   6.445
  745   HG13  VAL  91          HG13      VAL  91   2.701   8.600   6.992
  746   HG21  VAL  91          HG21      VAL  91   4.777  10.686   6.019
  747   HG22  VAL  91          HG22      VAL  91   4.950   8.936   5.774
  748   HG23  VAL  91          HG23      VAL  91   5.025  10.056   4.393
  749    H    CYS  92           H        CYS  92   1.267   9.870   2.309
  750    HA   CYS  92           HA       CYS  92   3.146   8.854   0.249
  751    HB2  CYS  92           HB2      CYS  92   0.806   8.231   0.101
  752    HB3  CYS  92           HB3      CYS  92   0.362   9.950  -0.147
  753    HG   CYS  92           HG       CYS  92   2.580   8.181  -1.903
  754    H    ILE  93           H        ILE  93   4.592  10.118  -0.574
  755    HA   ILE  93           HA       ILE  93   4.468  13.018   0.047
  756    HB   ILE  93           HB       ILE  93   6.880  12.959   0.095
  757   HG12  ILE  93          HG12      ILE  93   6.622  10.048  -0.753
  758   HG13  ILE  93          HG13      ILE  93   7.402  11.354  -1.636
  759   HG21  ILE  93          HG21      ILE  93   5.523  12.338   2.121
  760   HG22  ILE  93          HG22      ILE  93   5.819  10.625   1.742
  761   HG23  ILE  93          HG23      ILE  93   7.166  11.712   2.134
  762   HD11  ILE  93          HD11      ILE  93   9.108  11.503   0.210
  763   HD12  ILE  93          HD12      ILE  93   8.356  10.059   0.942
  764   HD13  ILE  93          HD13      ILE  93   9.091   9.950  -0.658
  765    H    GLY  94           H        GLY  94   4.161  10.985  -2.701
  766    HA2  GLY  94           HA2      GLY  94   4.078  13.184  -4.492
  767    HA3  GLY  94           HA3      GLY  94   5.645  12.383  -4.638
  768    H    GLN  95           H        GLN  95   4.048  12.440  -6.784
  769    HA   GLN  95           HA       GLN  95   2.611   9.827  -6.975
  770    HB2  GLN  95           HB2      GLN  95   2.554  12.432  -8.561
  771    HB3  GLN  95           HB3      GLN  95   1.922  10.931  -9.196
  772    HG2  GLN  95           HG2      GLN  95   0.114  12.201  -8.508
  773    HG3  GLN  95           HG3      GLN  95   0.235  10.781  -7.486
  774   HE21  GLN  95          HE22      GLN  95  -1.452  12.364  -6.410
  775   HE22  GLN  95          HE21      GLN  95  -0.789  13.393  -5.159
  776    H    LYS  96           H        LYS  96   3.726   8.219  -8.009
  777    HA   LYS  96           HA       LYS  96   6.107   8.871  -9.710
  778    HB2  LYS  96           HB2      LYS  96   6.605   7.015  -8.313
  779    HB3  LYS  96           HB3      LYS  96   4.988   6.349  -8.395
  780    HG2  LYS  96           HG2      LYS  96   5.335   5.673 -10.760
  781    HG3  LYS  96           HG3      LYS  96   6.954   6.403 -10.740
  782    HD2  LYS  96           HD2      LYS  96   7.723   4.807  -9.108
  783    HD3  LYS  96           HD3      LYS  96   6.080   4.159  -8.893
  784    HE2  LYS  96           HE2      LYS  96   6.048   3.380 -11.262
  785    HE3  LYS  96           HE3      LYS  96   7.649   4.077 -11.529
  786    HZ1  LYS  96           HZ1      LYS  96   8.574   2.491  -9.968
  787    HZ2  LYS  96           HZ2      LYS  96   7.100   1.896  -9.572
  788    HZ3  LYS  96           HZ3      LYS  96   7.705   1.666 -11.083
  789    H    GLN  97           H        GLN  97   5.577   9.278 -11.892
  790    HA   GLN  97           HA       GLN  97   3.069   8.044 -12.899
  791    HB2  GLN  97           HB2      GLN  97   2.885  10.600 -14.001
  792    HB3  GLN  97           HB3      GLN  97   1.821   9.803 -12.904
  793    HG2  GLN  97           HG2      GLN  97   2.150  11.857 -11.901
  794    HG3  GLN  97           HG3      GLN  97   3.201  10.808 -10.981
  795   HE21  GLN  97          HE22      GLN  97   4.964  12.039 -10.367
  796   HE22  GLN  97          HE21      GLN  97   5.744  13.216 -11.416
  797    H    LYS  98           H        LYS  98   3.344   7.077 -14.767
  798    HA   LYS  98           HA       LYS  98   5.347   8.236 -16.682
  799    HB2  LYS  98           HB2      LYS  98   5.731   5.867 -16.273
  800    HB3  LYS  98           HB3      LYS  98   4.023   5.494 -16.558
  801    HG2  LYS  98           HG2      LYS  98   4.295   6.216 -18.941
  802    HG3  LYS  98           HG3      LYS  98   6.019   6.518 -18.628
  803    HD2  LYS  98           HD2      LYS  98   6.348   4.130 -18.028
  804    HD3  LYS  98           HD3      LYS  98   4.608   3.859 -18.154
  805    HE2  LYS  98           HE2      LYS  98   5.517   2.981 -20.160
  806    HE3  LYS  98           HE3      LYS  98   4.708   4.483 -20.593
  807    HZ1  LYS  98           HZ1      LYS  98   7.031   5.527 -20.502
  808    HZ2  LYS  98           HZ2      LYS  98   7.635   4.000 -20.386
  809    HZ3  LYS  98           HZ3      LYS  98   6.758   4.466 -21.702
  810    H    TRP  99           H        TRP  99   4.416   9.322 -18.431
  811    HA   TRP  99           HA       TRP  99   1.444   9.410 -18.359
  812    HB2  TRP  99           HB2      TRP  99   3.434  11.378 -19.471
  813    HB3  TRP  99           HB3      TRP  99   1.689  11.484 -19.668
  814    HD1  TRP  99           HD1      TRP  99   4.246  11.384 -16.747
  815    HE1  TRP  99           HE1      TRP  99   3.420  12.891 -14.875
  816    HE3  TRP  99           HE3      TRP  99  -0.290  12.674 -18.712
  817    HZ2  TRP  99           HZ2      TRP  99   1.070  14.534 -14.315
  818    HZ3  TRP  99           HZ3      TRP  99  -1.780  14.239 -17.531
  819    HH2  TRP  99           HH2      TRP  99  -1.151  15.125 -15.294
  820    H    PHE 100           H        PHE 100   0.264   9.167 -20.297
  821    HA   PHE 100           HA       PHE 100   1.786   7.888 -22.545
  822    HB2  PHE 100           HB2      PHE 100  -0.863   7.146 -21.317
  823    HB3  PHE 100           HB3      PHE 100  -0.427   6.705 -22.959
  824    HD1  PHE 100           HD2      PHE 100   0.809   6.366 -19.400
  825    HD2  PHE 100           HD1      PHE 100   0.844   4.776 -23.418
  826    HE1  PHE 100           HE2      PHE 100   2.008   4.356 -18.606
  827    HE2  PHE 100           HE1      PHE 100   2.018   2.756 -22.603
  828    HZ   PHE 100           HZ       PHE 100   2.592   2.528 -20.200
  829    H    LEU 101           H        LEU 101   1.553   8.797 -24.425
  830    HA   LEU 101           HA       LEU 101  -0.172  11.162 -24.732
  831    HB2  LEU 101           HB2      LEU 101   2.116  11.427 -25.479
  832    HB3  LEU 101           HB3      LEU 101   2.031   9.924 -26.409
  833    HG   LEU 101           HG       LEU 101   0.294  10.925 -27.873
  834   HD11  LEU 101          HD11      LEU 101  -0.726  12.540 -26.393
  835   HD12  LEU 101          HD12      LEU 101   0.816  13.407 -26.188
  836   HD13  LEU 101          HD13      LEU 101  -0.026  13.394 -27.755
  837   HD21  LEU 101          HD21      LEU 101   1.787  12.469 -29.084
  838   HD22  LEU 101          HD22      LEU 101   2.884  12.506 -27.688
  839   HD23  LEU 101          HD23      LEU 101   2.612  10.993 -28.580
  840    H    LEU 102           H        LEU 102  -2.151  10.646 -25.252
  841    HA   LEU 102           HA       LEU 102  -2.666   8.330 -27.017
  842    HB2  LEU 102           HB2      LEU 102  -4.246   9.815 -24.883
  843    HB3  LEU 102           HB3      LEU 102  -5.074   8.836 -26.113
  844    HG   LEU 102           HG       LEU 102  -3.015   7.824 -24.107
  845   HD11  LEU 102          HD11      LEU 102  -5.146   8.315 -23.097
  846   HD12  LEU 102          HD12      LEU 102  -6.029   7.539 -24.409
  847   HD13  LEU 102          HD13      LEU 102  -5.044   6.558 -23.293
  848   HD21  LEU 102          HD21      LEU 102  -4.194   6.633 -26.613
  849   HD22  LEU 102          HD22      LEU 102  -2.613   6.437 -25.859
  850   HD23  LEU 102          HD23      LEU 102  -3.991   5.565 -25.176
  851    H    GLN 103           H        GLN 103  -3.407   8.580 -28.936
  852    HA   GLN 103           HA       GLN 103  -4.301  11.271 -29.860
  853    HB2  GLN 103           HB2      GLN 103  -3.294   8.747 -31.165
  854    HB3  GLN 103           HB3      GLN 103  -4.475   9.701 -32.058
  855    HG2  GLN 103           HG2      GLN 103  -1.977  10.191 -32.472
  856    HG3  GLN 103           HG3      GLN 103  -3.092  11.539 -32.289
  857   HE21  GLN 103          HE22      GLN 103  -1.874  13.201 -31.369
  858   HE22  GLN 103          HE21      GLN 103  -0.736  12.924 -30.042
  859    H    LEU 104           H        LEU 104  -6.405  11.677 -30.256
  860    HA   LEU 104           HA       LEU 104  -8.352   9.988 -28.961
  861    HB2  LEU 104           HB2      LEU 104  -8.290  12.492 -29.042
  862    HB3  LEU 104           HB3      LEU 104  -8.668  12.428 -30.760
  863    HG   LEU 104           HG       LEU 104 -10.889  11.514 -30.268
  864   HD11  LEU 104          HD11      LEU 104 -10.500  10.186 -28.225
  865   HD12  LEU 104          HD12      LEU 104 -10.070  11.664 -27.327
  866   HD13  LEU 104          HD13      LEU 104 -11.726  11.410 -27.913
  867   HD21  LEU 104          HD21      LEU 104 -10.101  13.959 -28.610
  868   HD22  LEU 104          HD22      LEU 104 -10.558  13.926 -30.337
  869   HD23  LEU 104          HD23      LEU 104 -11.758  13.560 -29.089
  870    H    VAL 105           H        VAL 105  -9.674   8.400 -29.894
  871    HA   VAL 105           HA       VAL 105  -9.699   8.178 -32.877
  872    HB   VAL 105           HB       VAL 105  -9.785   5.965 -30.805
  873   HG11  VAL 105          HG11      VAL 105  -9.967   5.755 -33.825
  874   HG12  VAL 105          HG12      VAL 105  -9.741   4.398 -32.698
  875   HG13  VAL 105          HG13      VAL 105 -11.233   5.332 -32.640
  876   HG21  VAL 105          HG21      VAL 105  -7.672   5.227 -31.790
  877   HG22  VAL 105          HG22      VAL 105  -7.680   6.601 -32.914
  878   HG23  VAL 105          HG23      VAL 105  -7.487   6.872 -31.172
  879    H    SER 106           H        SER 106 -11.578   7.835 -29.812
  880    HA   SER 106           HA       SER 106 -14.105   8.035 -31.316
  881    HB2  SER 106           HB2      SER 106 -13.566   7.945 -28.331
  882    HB3  SER 106           HB3      SER 106 -15.149   7.847 -29.132
  883    HG   SER 106           HG       SER 106 -14.275   5.761 -28.655
  884    H    GLY 107           H        GLY 107 -14.844  10.013 -28.773
  885    HA2  GLY 107           HA2      GLY 107 -13.573  12.470 -29.474
  886    HA3  GLY 107           HA3      GLY 107 -15.093  12.301 -30.360
  887    H    ASP 108           H        ASP 108 -14.938  14.383 -28.624
  888    HA   ASP 108           HA       ASP 108 -15.636  14.128 -25.973
  889    HB2  ASP 108           HB2      ASP 108 -15.150  16.237 -27.028
  890    HB3  ASP 108           HB3      ASP 108 -16.612  16.123 -28.019
  891    H    ALA 109           H        ALA 109 -17.770  13.660 -28.796
  892    HA   ALA 109           HA       ALA 109 -20.252  13.641 -27.384
  893    HB1  ALA 109           HB1      ALA 109 -21.128  12.573 -29.417
  894    HB2  ALA 109           HB2      ALA 109 -20.057  13.924 -29.839
  895    HB3  ALA 109           HB3      ALA 109 -19.479  12.241 -29.985
  896    H    GLU 110           H        GLU 110 -17.756  11.172 -27.759
  897    HA   GLU 110           HA       GLU 110 -19.534   9.039 -26.773
  898    HB2  GLU 110           HB2      GLU 110 -16.840   8.975 -28.159
  899    HB3  GLU 110           HB3      GLU 110 -17.676   7.543 -27.539
  900    HG2  GLU 110           HG2      GLU 110 -19.597   7.988 -29.023
  901    HG3  GLU 110           HG3      GLU 110 -18.813   9.438 -29.645
  902    H    ILE 111           H        ILE 111 -16.836  11.058 -25.908
  903    HA   ILE 111           HA       ILE 111 -15.849   9.708 -23.574
  904    HB   ILE 111           HB       ILE 111 -15.871  12.462 -24.741
  905   HG12  ILE 111          HG12      ILE 111 -13.645  10.663 -23.862
  906   HG13  ILE 111          HG13      ILE 111 -14.224  10.886 -25.516
  907   HG21  ILE 111          HG21      ILE 111 -14.687  13.498 -22.906
  908   HG22  ILE 111          HG22      ILE 111 -16.237  12.949 -22.327
  909   HG23  ILE 111          HG23      ILE 111 -14.774  12.000 -21.944
  910   HD11  ILE 111          HD11      ILE 111 -13.518  13.297 -25.374
  911   HD12  ILE 111          HD12      ILE 111 -12.712  12.906 -23.828
  912   HD13  ILE 111          HD13      ILE 111 -12.197  12.116 -25.319
  913    H    ASN 112           H        ASN 112 -16.564   9.785 -21.488
  914    HA   ASN 112           HA       ASN 112 -19.242  11.069 -21.005
  915    HB2  ASN 112           HB2      ASN 112 -19.390   8.606 -21.297
  916    HB3  ASN 112           HB3      ASN 112 -18.251   8.390 -19.972
  917   HD21  ASN 112          HD22      ASN 112 -20.081   7.079 -18.987
  918   HD22  ASN 112          HD21      ASN 112 -21.323   7.942 -18.121
  919    H    MET 113           H        MET 113 -16.092  10.140 -19.620
  920    HA   MET 113           HA       MET 113 -14.999  10.585 -17.755
  921    HB2  MET 113           HB2      MET 113 -16.453  13.241 -17.602
  922    HB3  MET 113           HB3      MET 113 -14.873  12.800 -16.948
  923    HG2  MET 113           HG2      MET 113 -14.158  12.320 -19.350
  924    HG3  MET 113           HG3      MET 113 -15.649  13.130 -19.850
  925    HE1  MET 113           HE1      MET 113 -12.985  14.107 -21.042
  926    HE2  MET 113           HE2      MET 113 -14.468  15.067 -21.292
  927    HE3  MET 113           HE3      MET 113 -12.986  15.868 -20.754
  928    H    GLN 114           H        GLN 114 -18.444  10.400 -17.289
  929    HA   GLN 114           HA       GLN 114 -18.064  10.312 -14.352
  930    HB2  GLN 114           HB2      GLN 114 -20.548  10.825 -16.030
  931    HB3  GLN 114           HB3      GLN 114 -20.521  10.718 -14.262
  932    HG2  GLN 114           HG2      GLN 114 -18.956  12.646 -14.161
  933    HG3  GLN 114           HG3      GLN 114 -18.995  12.779 -15.918
  934   HE21  GLN 114          HE22      GLN 114 -21.136  12.892 -12.989
  935   HE22  GLN 114          HE21      GLN 114 -22.302  13.984 -13.701
  936    H    THR 115           H        THR 115 -17.278   8.156 -16.092
  937    HA   THR 115           HA       THR 115 -19.147   5.987 -15.917
  938    HB   THR 115           HB       THR 115 -16.843   4.747 -16.370
  939    HG1  THR 115           HG1      THR 115 -15.287   6.237 -15.985
  940   HG21  THR 115          HG21      THR 115 -17.840   6.895 -18.280
  941   HG22  THR 115          HG22      THR 115 -16.872   5.464 -18.716
  942   HG23  THR 115          HG23      THR 115 -18.534   5.254 -18.130
  943    H    SER 116           H        SER 116 -16.460   7.152 -13.878
  944    HA   SER 116           HA       SER 116 -16.553   4.826 -12.173
  945    HB2  SER 116           HB2      SER 116 -14.911   7.346 -11.899
  946    HB3  SER 116           HB3      SER 116 -14.512   5.723 -11.290
  947    HG   SER 116           HG       SER 116 -14.341   5.026 -13.469
  948    H    SER 117           H        SER 117 -18.640   7.246 -12.149
  949    HA   SER 117           HA       SER 117 -20.163   8.090 -10.792
  950    HB2  SER 117           HB2      SER 117 -19.227   6.139  -8.678
  951    HB3  SER 117           HB3      SER 117 -20.792   6.962  -8.770
  952    HG   SER 117           HG       SER 117 -20.889   4.814  -9.627
  953    H    THR 118           H        THR 118 -17.010   7.913  -9.119
  954    HA   THR 118           HA       THR 118 -17.386  10.767  -8.333
  955    HB   THR 118           HB       THR 118 -15.881  10.165  -6.346
  956    HG1  THR 118           HG1      THR 118 -15.263   8.068  -6.877
  957   HG21  THR 118          HG21      THR 118 -17.769   9.467  -4.962
  958   HG22  THR 118          HG22      THR 118 -18.297  10.680  -6.136
  959   HG23  THR 118          HG23      THR 118 -18.692   8.971  -6.397
  960    HA   PRO 119           HA       PRO 119 -13.681  10.116 -11.110
  961    HB2  PRO 119           HB2      PRO 119 -14.371  11.620 -13.233
  962    HB3  PRO 119           HB3      PRO 119 -15.199  10.064 -12.952
  963    HG2  PRO 119           HG2      PRO 119 -16.133  12.827 -12.034
  964    HG3  PRO 119           HG3      PRO 119 -17.030  11.684 -13.072
  965    HD2  PRO 119           HD2      PRO 119 -17.397  11.711 -10.390
  966    HD3  PRO 119           HD3      PRO 119 -17.366  10.170 -11.298
  967    H    GLU 120           H        GLU 120 -12.499  12.234 -12.276
  968    HA   GLU 120           HA       GLU 120 -12.660  14.527 -10.361
  969    HB2  GLU 120           HB2      GLU 120 -10.311  13.576 -12.043
  970    HB3  GLU 120           HB3      GLU 120 -10.387  15.105 -11.173
  971    HG2  GLU 120           HG2      GLU 120 -11.135  13.410  -9.151
  972    HG3  GLU 120           HG3      GLU 120 -10.080  12.338 -10.068
  973    H    PHE 121           H        PHE 121 -13.567  13.665 -13.592
  974    HA   PHE 121           HA       PHE 121 -13.307  16.530 -14.393
  975    HB2  PHE 121           HB2      PHE 121 -12.812  14.073 -16.062
  976    HB3  PHE 121           HB3      PHE 121 -12.934  15.722 -16.661
  977    HD1  PHE 121           HD2      PHE 121 -11.429  17.464 -15.039
  978    HD2  PHE 121           HD1      PHE 121 -10.538  13.381 -16.113
  979    HE1  PHE 121           HE2      PHE 121  -9.016  17.939 -14.865
  980    HE2  PHE 121           HE1      PHE 121  -8.121  13.861 -15.903
  981    HZ   PHE 121           HZ       PHE 121  -7.350  16.131 -15.281
  982    H    ASP 122           H        ASP 122 -14.654  17.514 -15.508
  983    HA   ASP 122           HA       ASP 122 -17.262  16.352 -16.312
  984    HB2  ASP 122           HB2      ASP 122 -17.738  17.786 -14.461
  985    HB3  ASP 122           HB3      ASP 122 -16.531  18.971 -14.959
  986    H    GLY 123           H        GLY 123 -17.164  16.271 -18.423
  987    HA2  GLY 123           HA2      GLY 123 -15.084  17.100 -20.011
  988    HA3  GLY 123           HA3      GLY 123 -16.669  16.646 -20.649
  989    H    TRP 124           H        TRP 124 -14.674  18.662 -21.555
  990    HA   TRP 124           HA       TRP 124 -16.372  21.053 -21.669
  991    HB2  TRP 124           HB2      TRP 124 -14.967  21.166 -19.597
  992    HB3  TRP 124           HB3      TRP 124 -13.537  21.187 -20.595
  993    HD1  TRP 124           HD1      TRP 124 -13.511  23.401 -18.832
  994    HE1  TRP 124           HE1      TRP 124 -14.014  25.840 -19.336
  995    HE3  TRP 124           HE3      TRP 124 -16.485  22.816 -23.022
  996    HZ2  TRP 124           HZ2      TRP 124 -15.466  27.364 -21.293
  997    HZ3  TRP 124           HZ3      TRP 124 -17.413  24.789 -24.138
  998    HH2  TRP 124           HH2      TRP 124 -16.919  27.076 -23.292
  999    H    ARG 125           H        ARG 125 -13.058  21.641 -22.467
 1000    HA   ARG 125           HA       ARG 125 -13.464  20.980 -25.324
 1001    HB2  ARG 125           HB2      ARG 125 -12.988  23.263 -26.015
 1002    HB3  ARG 125           HB3      ARG 125 -14.408  23.245 -24.975
 1003    HG2  ARG 125           HG2      ARG 125 -12.950  23.991 -23.046
 1004    HG3  ARG 125           HG3      ARG 125 -11.585  24.105 -24.176
 1005    HD2  ARG 125           HD2      ARG 125 -12.847  25.765 -25.523
 1006    HD3  ARG 125           HD3      ARG 125 -14.195  25.644 -24.372
 1007    HE   ARG 125           HE       ARG 125 -11.697  26.274 -23.055
 1008   HH11  ARG 125          HH11      ARG 125 -14.278  27.782 -24.981
 1009   HH12  ARG 125          HH12      ARG 125 -14.078  29.352 -24.291
 1010   HH21  ARG 125          HH21      ARG 125 -11.432  28.376 -22.124
 1011   HH22  ARG 125          HH22      ARG 125 -12.415  29.693 -22.645
 1012    H    TRP 126           H        TRP 126 -11.415  21.053 -26.575
 1013    HA   TRP 126           HA       TRP 126  -9.111  20.435 -24.878
 1014    HB2  TRP 126           HB2      TRP 126  -9.163  20.618 -27.893
 1015    HB3  TRP 126           HB3      TRP 126  -8.060  19.694 -26.869
 1016    HD1  TRP 126           HD1      TRP 126 -10.754  19.072 -29.107
 1017    HE1  TRP 126           HE1      TRP 126 -12.266  17.108 -28.525
 1018    HE3  TRP 126           HE3      TRP 126  -9.286  18.340 -24.263
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.836  15.452 -26.219
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.450  16.674 -22.840
 1021    HH2  TRP 126           HH2      TRP 126 -12.254  15.254 -23.800
 1022    H    VAL 127           H        VAL 127  -7.085  21.592 -24.959
 1023    HA   VAL 127           HA       VAL 127  -7.449  24.508 -25.520
 1024    HB   VAL 127           HB       VAL 127  -6.324  24.976 -23.420
 1025   HG11  VAL 127          HG11      VAL 127  -8.805  24.797 -23.465
 1026   HG12  VAL 127          HG12      VAL 127  -8.676  23.110 -22.907
 1027   HG13  VAL 127          HG13      VAL 127  -8.104  24.434 -21.880
 1028   HG21  VAL 127          HG21      VAL 127  -5.944  23.207 -21.726
 1029   HG22  VAL 127          HG22      VAL 127  -6.376  21.964 -22.915
 1030   HG23  VAL 127          HG23      VAL 127  -4.933  22.968 -23.158
 1031    H    SER 128           H        SER 128  -5.366  25.732 -25.695
 1032    HA   SER 128           HA       SER 128  -3.695  24.670 -27.621
 1033    HB2  SER 128           HB2      SER 128  -2.883  26.750 -25.562
 1034    HB3  SER 128           HB3      SER 128  -2.211  26.533 -27.186
 1035    HG   SER 128           HG       SER 128  -3.798  28.216 -27.153
 1036    H    TYR 129           H        TYR 129  -1.538  23.893 -27.625
 1037    HA   TYR 129           HA       TYR 129  -0.774  22.110 -25.529
 1038    HB2  TYR 129           HB2      TYR 129  -0.036  22.526 -28.154
 1039    HB3  TYR 129           HB3      TYR 129   1.359  23.198 -27.304
 1040    HD1  TYR 129           HD2      TYR 129   2.727  21.649 -25.797
 1041    HD2  TYR 129           HD1      TYR 129  -0.590  20.244 -28.188
 1042    HE1  TYR 129           HE2      TYR 129   3.373  19.295 -25.338
 1043    HE2  TYR 129           HE1      TYR 129   0.024  17.913 -27.669
 1044    HH   TYR 129           HH       TYR 129   1.411  16.502 -26.436
 1045    H    TRP 130           H        TRP 130   0.931  22.419 -23.987
 1046    HA   TRP 130           HA       TRP 130   1.936  23.423 -22.284
 1047    HB2  TRP 130           HB2      TRP 130   2.105  26.083 -23.669
 1048    HB3  TRP 130           HB3      TRP 130   3.210  25.351 -22.522
 1049    HD1  TRP 130           HD1      TRP 130   2.489  25.688 -26.168
 1050    HE1  TRP 130           HE1      TRP 130   4.101  24.375 -27.589
 1051    HE3  TRP 130           HE3      TRP 130   4.829  23.118 -22.427
 1052    HZ2  TRP 130           HZ2      TRP 130   6.374  22.527 -27.123
 1053    HZ3  TRP 130           HZ3      TRP 130   6.739  21.610 -22.929
 1054    HH2  TRP 130           HH2      TRP 130   7.512  21.321 -25.261
 1055    H    TYR 131           H        TYR 131  -1.121  24.824 -23.313
 1056    HA   TYR 131           HA       TYR 131  -1.327  26.864 -21.390
 1057    HB2  TYR 131           HB2      TYR 131  -2.907  26.703 -23.167
 1058    HB3  TYR 131           HB3      TYR 131  -3.513  25.158 -22.622
 1059    HD1  TYR 131           HD1      TYR 131  -4.960  24.950 -20.629
 1060    HD2  TYR 131           HD2      TYR 131  -3.586  28.792 -22.043
 1061    HE1  TYR 131           HE1      TYR 131  -6.673  26.065 -19.248
 1062    HE2  TYR 131           HE2      TYR 131  -5.300  29.915 -20.660
 1063    HH   TYR 131           HH       TYR 131  -7.100  29.642 -19.176
 1064    HA   PRO 132           HA       PRO 132  -2.977  23.727 -18.142
 1065    HB2  PRO 132           HB2      PRO 132  -1.565  21.221 -19.012
 1066    HB3  PRO 132           HB3      PRO 132  -3.094  21.426 -18.128
 1067    HG2  PRO 132           HG2      PRO 132  -3.167  20.870 -20.754
 1068    HG3  PRO 132           HG3      PRO 132  -4.229  22.170 -20.124
 1069    HD2  PRO 132           HD2      PRO 132  -1.497  22.483 -21.432
 1070    HD3  PRO 132           HD3      PRO 132  -3.025  23.318 -21.804
 1071    H    VAL 133           H        VAL 133   0.362  23.660 -19.414
 1072    HA   VAL 133           HA       VAL 133   1.710  23.009 -16.969
 1073    HB   VAL 133           HB       VAL 133   2.631  24.757 -19.302
 1074   HG11  VAL 133          HG11      VAL 133   4.267  23.296 -17.208
 1075   HG12  VAL 133          HG12      VAL 133   4.905  24.115 -18.661
 1076   HG13  VAL 133          HG13      VAL 133   4.113  25.062 -17.411
 1077   HG21  VAL 133          HG21      VAL 133   2.965  21.757 -18.851
 1078   HG22  VAL 133          HG22      VAL 133   1.985  22.522 -20.119
 1079   HG23  VAL 133          HG23      VAL 133   3.735  22.699 -20.152
 1080    H    ARG 134           H        ARG 134   0.322  26.048 -18.292
 1081    HA   ARG 134           HA       ARG 134   1.262  27.558 -15.951
 1082    HB2  ARG 134           HB2      ARG 134  -0.376  28.226 -18.419
 1083    HB3  ARG 134           HB3      ARG 134  -0.185  29.387 -17.117
 1084    HG2  ARG 134           HG2      ARG 134   2.318  28.121 -18.260
 1085    HG3  ARG 134           HG3      ARG 134   1.473  29.335 -19.207
 1086    HD2  ARG 134           HD2      ARG 134   3.314  30.272 -17.834
 1087    HD3  ARG 134           HD3      ARG 134   1.756  31.020 -17.553
 1088    HE   ARG 134           HE       ARG 134   3.118  29.042 -15.746
 1089   HH11  ARG 134          HH11      ARG 134   0.901  31.814 -16.108
 1090   HH12  ARG 134          HH12      ARG 134   0.608  31.981 -14.417
 1091   HH21  ARG 134          HH21      ARG 134   2.709  29.282 -13.470
 1092   HH22  ARG 134          HH22      ARG 134   1.667  30.528 -12.904
 1093    H    GLN 135           H        GLN 135  -1.504  25.522 -16.604
 1094    HA   GLN 135           HA       GLN 135  -3.138  27.028 -14.662
 1095    HB2  GLN 135           HB2      GLN 135  -3.749  24.386 -16.006
 1096    HB3  GLN 135           HB3      GLN 135  -4.840  25.368 -15.039
 1097    HG2  GLN 135           HG2      GLN 135  -3.992  25.707 -17.868
 1098    HG3  GLN 135           HG3      GLN 135  -5.552  25.955 -17.121
 1099   HE21  GLN 135          HE22      GLN 135  -2.877  27.506 -18.486
 1100   HE22  GLN 135          HE21      GLN 135  -3.205  29.140 -17.925
 1101    H    VAL 136           H        VAL 136  -1.071  24.072 -14.659
 1102    HA   VAL 136           HA       VAL 136  -2.068  23.168 -12.148
 1103    HB   VAL 136           HB       VAL 136  -0.080  21.760 -12.098
 1104   HG11  VAL 136          HG11      VAL 136  -1.511  21.722 -14.767
 1105   HG12  VAL 136          HG12      VAL 136  -0.646  20.371 -14.000
 1106   HG13  VAL 136          HG13      VAL 136  -2.089  21.032 -13.229
 1107   HG21  VAL 136          HG21      VAL 136   1.540  23.322 -13.200
 1108   HG22  VAL 136          HG22      VAL 136   1.549  21.682 -13.866
 1109   HG23  VAL 136          HG23      VAL 136   0.739  22.999 -14.744
 1110    H    VAL 137           H        VAL 137  -0.692  22.940 -10.179
 1111    HA   VAL 137           HA       VAL 137   0.027  25.489  -9.113
 1112    HB   VAL 137           HB       VAL 137   0.751  24.089  -7.128
 1113   HG11  VAL 137          HG11      VAL 137  -1.517  25.046  -7.344
 1114   HG12  VAL 137          HG12      VAL 137  -2.065  23.588  -8.198
 1115   HG13  VAL 137          HG13      VAL 137  -1.539  23.488  -6.504
 1116   HG21  VAL 137          HG21      VAL 137  -0.338  21.737  -8.775
 1117   HG22  VAL 137          HG22      VAL 137   1.348  21.968  -8.243
 1118   HG23  VAL 137          HG23      VAL 137   0.057  21.721  -7.058
 1119    H    SER 138           H        SER 138   2.004  26.263  -8.343
 1120    HA   SER 138           HA       SER 138   3.923  26.354 -10.262
 1121    HB2  SER 138           HB2      SER 138   4.383  26.973  -7.322
 1122    HB3  SER 138           HB3      SER 138   5.110  27.775  -8.730
 1123    HG   SER 138           HG       SER 138   3.357  28.994  -7.842
 1124    H    PHE 139           H        PHE 139   4.009  24.158  -7.376
 1125    HA   PHE 139           HA       PHE 139   6.776  23.473  -7.830
 1126    HB2  PHE 139           HB2      PHE 139   6.512  21.806  -6.173
 1127    HB3  PHE 139           HB3      PHE 139   5.627  23.218  -5.648
 1128    HD1  PHE 139           HD2      PHE 139   5.350  19.743  -6.923
 1129    HD2  PHE 139           HD1      PHE 139   3.202  23.109  -5.286
 1130    HE1  PHE 139           HE2      PHE 139   3.378  18.302  -6.550
 1131    HE2  PHE 139           HE1      PHE 139   1.232  21.661  -4.901
 1132    HZ   PHE 139           HZ       PHE 139   1.296  19.259  -5.552
 1133    H    LYS 140           H        LYS 140   3.797  22.390  -9.290
 1134    HA   LYS 140           HA       LYS 140   5.013  19.902 -10.326
 1135    HB2  LYS 140           HB2      LYS 140   2.752  20.121  -9.206
 1136    HB3  LYS 140           HB3      LYS 140   2.156  20.924 -10.667
 1137    HG2  LYS 140           HG2      LYS 140   2.679  18.937 -12.016
 1138    HG3  LYS 140           HG3      LYS 140   3.458  18.160 -10.634
 1139    HD2  LYS 140           HD2      LYS 140   0.490  18.825 -10.891
 1140    HD3  LYS 140           HD3      LYS 140   1.241  17.227 -11.013
 1141    HE2  LYS 140           HE2      LYS 140   2.137  17.614  -8.613
 1142    HE3  LYS 140           HE3      LYS 140   1.056  19.014  -8.531
 1143    HZ1  LYS 140           HZ1      LYS 140   0.200  16.193  -8.971
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.011  17.062  -7.596
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.822  17.491  -8.955
 1146    H    ARG 141           H        ARG 141   3.962  23.054 -11.510
 1147    HA   ARG 141           HA       ARG 141   3.736  22.973 -14.194
 1148    HB2  ARG 141           HB2      ARG 141   3.853  25.044 -12.833
 1149    HB3  ARG 141           HB3      ARG 141   5.565  24.778 -12.514
 1150    HG2  ARG 141           HG2      ARG 141   6.033  25.125 -14.983
 1151    HG3  ARG 141           HG3      ARG 141   4.322  25.550 -15.175
 1152    HD2  ARG 141           HD2      ARG 141   4.601  27.387 -13.544
 1153    HD3  ARG 141           HD3      ARG 141   6.307  26.934 -13.335
 1154    HE   ARG 141           HE       ARG 141   5.783  27.371 -16.106
 1155   HH11  ARG 141          HH11      ARG 141   6.241  29.211 -13.085
 1156   HH12  ARG 141          HH12      ARG 141   6.813  30.631 -13.881
 1157   HH21  ARG 141          HH21      ARG 141   6.544  29.282 -17.157
 1158   HH22  ARG 141          HH22      ARG 141   6.977  30.671 -16.237
 1159    H    ASP 142           H        ASP 142   7.025  22.854 -12.674
 1160    HA   ASP 142           HA       ASP 142   8.285  22.834 -15.248
 1161    HB2  ASP 142           HB2      ASP 142   9.462  23.627 -13.270
 1162    HB3  ASP 142           HB3      ASP 142   9.385  22.022 -12.529
 1163    H    VAL 143           H        VAL 143   7.262  20.182 -13.069
 1164    HA   VAL 143           HA       VAL 143   8.518  18.166 -14.771
 1165    HB   VAL 143           HB       VAL 143   6.572  17.962 -12.439
 1166   HG11  VAL 143          HG11      VAL 143   7.221  15.459 -12.568
 1167   HG12  VAL 143          HG12      VAL 143   6.027  16.040 -13.747
 1168   HG13  VAL 143          HG13      VAL 143   7.708  15.797 -14.241
 1169   HG21  VAL 143          HG21      VAL 143   9.536  17.284 -12.804
 1170   HG22  VAL 143          HG22      VAL 143   8.872  18.626 -11.848
 1171   HG23  VAL 143          HG23      VAL 143   8.591  16.960 -11.345
 1172    H    TYR 144           H        TYR 144   5.259  19.690 -14.546
 1173    HA   TYR 144           HA       TYR 144   4.203  17.911 -16.487
 1174    HB2  TYR 144           HB2      TYR 144   2.907  19.337 -14.871
 1175    HB3  TYR 144           HB3      TYR 144   3.190  20.713 -15.924
 1176    HD1  TYR 144           HD2      TYR 144   2.536  17.328 -17.474
 1177    HD2  TYR 144           HD1      TYR 144   0.727  20.958 -15.976
 1178    HE1  TYR 144           HE2      TYR 144   0.398  16.610 -18.354
 1179    HE2  TYR 144           HE1      TYR 144  -1.449  20.216 -16.830
 1180    HH   TYR 144           HH       TYR 144  -1.874  17.151 -18.691
 1181    H    ARG 145           H        ARG 145   5.950  21.066 -16.863
 1182    HA   ARG 145           HA       ARG 145   5.817  21.300 -19.629
 1183    HB2  ARG 145           HB2      ARG 145   6.745  22.898 -17.846
 1184    HB3  ARG 145           HB3      ARG 145   8.191  21.886 -17.774
 1185    HG2  ARG 145           HG2      ARG 145   8.626  22.271 -20.128
 1186    HG3  ARG 145           HG3      ARG 145   7.086  23.143 -20.269
 1187    HD2  ARG 145           HD2      ARG 145   9.013  24.684 -20.222
 1188    HD3  ARG 145           HD3      ARG 145   7.913  24.954 -18.860
 1189    HE   ARG 145           HE       ARG 145   9.797  23.213 -17.831
 1190   HH11  ARG 145          HH21      ARG 145  10.107  26.326 -19.525
 1191   HH12  ARG 145          HH22      ARG 145  11.473  26.844 -18.601
 1192   HH21  ARG 145          HH11      ARG 145  11.483  23.987 -16.477
 1193   HH22  ARG 145          HH12      ARG 145  12.331  25.443 -16.895
 1194    H    ARG 146           H        ARG 146   7.931  19.170 -17.623
 1195    HA   ARG 146           HA       ARG 146   9.565  18.298 -19.835
 1196    HB2  ARG 146           HB2      ARG 146   9.007  16.970 -17.145
 1197    HB3  ARG 146           HB3      ARG 146  10.150  16.351 -18.325
 1198    HG2  ARG 146           HG2      ARG 146  11.551  18.304 -18.181
 1199    HG3  ARG 146           HG3      ARG 146  10.334  19.195 -17.279
 1200    HD2  ARG 146           HD2      ARG 146  10.581  17.415 -15.438
 1201    HD3  ARG 146           HD3      ARG 146  12.035  16.885 -16.282
 1202    HE   ARG 146           HE       ARG 146  11.503  19.501 -14.929
 1203   HH11  ARG 146          HH11      ARG 146  13.980  17.528 -16.610
 1204   HH12  ARG 146          HH12      ARG 146  15.273  18.549 -16.098
 1205   HH21  ARG 146          HH21      ARG 146  13.088  20.749 -14.311
 1206   HH22  ARG 146          HH22      ARG 146  14.776  20.461 -14.713
 1207    H    VAL 147           H        VAL 147   6.602  16.839 -18.325
 1208    HA   VAL 147           HA       VAL 147   6.340  14.697 -20.160
 1209    HB   VAL 147           HB       VAL 147   4.163  16.360 -18.826
 1210   HG11  VAL 147          HG11      VAL 147   3.203  15.041 -20.658
 1211   HG12  VAL 147          HG12      VAL 147   4.015  13.582 -20.053
 1212   HG13  VAL 147          HG13      VAL 147   2.728  14.363 -19.103
 1213   HG21  VAL 147          HG21      VAL 147   5.415  13.736 -17.914
 1214   HG22  VAL 147          HG22      VAL 147   5.732  15.318 -17.177
 1215   HG23  VAL 147          HG23      VAL 147   4.116  14.640 -17.103
 1216    H    MET 148           H        MET 148   5.132  18.110 -20.428
 1217    HA   MET 148           HA       MET 148   3.860  17.650 -22.904
 1218    HB2  MET 148           HB2      MET 148   4.889  20.247 -21.702
 1219    HB3  MET 148           HB3      MET 148   3.902  20.139 -23.160
 1220    HG2  MET 148           HG2      MET 148   2.591  18.540 -21.174
 1221    HG3  MET 148           HG3      MET 148   3.069  20.029 -20.388
 1222    HE1  MET 148           HE1      MET 148  -0.761  20.388 -21.015
 1223    HE2  MET 148           HE2      MET 148   0.229  19.022 -20.478
 1224    HE3  MET 148           HE3      MET 148   0.533  20.646 -19.819
 1225    H    LYS 149           H        LYS 149   7.303  18.813 -22.312
 1226    HA   LYS 149           HA       LYS 149   7.655  19.093 -25.152
 1227    HB2  LYS 149           HB2      LYS 149   9.920  19.560 -24.803
 1228    HB3  LYS 149           HB3      LYS 149   9.022  20.293 -23.492
 1229    HG2  LYS 149           HG2      LYS 149  10.928  19.481 -22.489
 1230    HG3  LYS 149           HG3      LYS 149   9.705  18.301 -22.053
 1231    HD2  LYS 149           HD2      LYS 149  10.641  16.672 -23.665
 1232    HD3  LYS 149           HD3      LYS 149  11.694  17.920 -24.344
 1233    HE2  LYS 149           HE2      LYS 149  12.893  18.099 -22.187
 1234    HE3  LYS 149           HE3      LYS 149  11.771  16.938 -21.449
 1235    HZ1  LYS 149           HZ1      LYS 149  12.579  15.254 -23.011
 1236    HZ2  LYS 149           HZ2      LYS 149  13.646  16.327 -23.672
 1237    HZ3  LYS 149           HZ3      LYS 149  13.819  15.852 -22.116
 1238    H    GLU 150           H        GLU 150   7.813  16.248 -23.098
 1239    HA   GLU 150           HA       GLU 150   9.324  14.620 -24.930
 1240    HB2  GLU 150           HB2      GLU 150   7.283  13.946 -22.770
 1241    HB3  GLU 150           HB3      GLU 150   8.082  12.717 -23.730
 1242    HG2  GLU 150           HG2      GLU 150   9.601  14.754 -22.051
 1243    HG3  GLU 150           HG3      GLU 150   9.100  13.167 -21.467
 1244    H    PHE 151           H        PHE 151   6.026  15.821 -24.971
 1245    HA   PHE 151           HA       PHE 151   5.281  13.916 -27.142
 1246    HB2  PHE 151           HB2      PHE 151   3.633  15.447 -25.112
 1247    HB3  PHE 151           HB3      PHE 151   2.966  14.424 -26.377
 1248    HD1  PHE 151           HD1      PHE 151   5.248  12.169 -25.958
 1249    HD2  PHE 151           HD2      PHE 151   2.522  14.274 -23.348
 1250    HE1  PHE 151           HE1      PHE 151   5.286  10.287 -24.406
 1251    HE2  PHE 151           HE2      PHE 151   2.532  12.332 -21.805
 1252    HZ   PHE 151           HZ       PHE 151   3.906  10.343 -22.320
 1253    H    ALA 152           H        ALA 152   5.648  17.346 -26.435
 1254    HA   ALA 152           HA       ALA 152   3.886  18.537 -28.094
 1255    HB1  ALA 152           HB1      ALA 152   5.568  20.380 -28.315
 1256    HB2  ALA 152           HB2      ALA 152   5.395  19.799 -26.650
 1257    HB3  ALA 152           HB3      ALA 152   6.801  19.315 -27.627
 1258    H    SER 153           H        SER 153   7.263  17.736 -29.260
 1259    HA   SER 153           HA       SER 153   6.567  18.372 -31.909
 1260    HB2  SER 153           HB2      SER 153   8.734  16.393 -31.171
 1261    HB3  SER 153           HB3      SER 153   8.670  17.517 -32.544
 1262    HG   SER 153           HG       SER 153  10.033  18.312 -30.866
 1263    H    VAL 154           H        VAL 154   5.654  15.527 -30.129
 1264    HA   VAL 154           HA       VAL 154   5.605  13.734 -32.472
 1265    HB   VAL 154           HB       VAL 154   4.360  13.310 -29.719
 1266   HG11  VAL 154          HG11      VAL 154   3.543  11.762 -31.466
 1267   HG12  VAL 154          HG12      VAL 154   5.217  11.345 -31.894
 1268   HG13  VAL 154          HG13      VAL 154   4.568  10.911 -30.301
 1269   HG21  VAL 154          HG21      VAL 154   7.165  12.571 -30.669
 1270   HG22  VAL 154          HG22      VAL 154   6.755  13.707 -29.365
 1271   HG23  VAL 154          HG23      VAL 154   6.401  11.991 -29.171
 1272    H    VAL 155           H        VAL 155   3.399  15.691 -30.467
 1273    HA   VAL 155           HA       VAL 155   1.037  15.043 -32.015
 1274    HB   VAL 155           HB       VAL 155   1.686  17.279 -30.035
 1275   HG11  VAL 155          HG11      VAL 155  -1.002  16.356 -31.174
 1276   HG12  VAL 155          HG12      VAL 155  -0.810  17.464 -29.795
 1277   HG13  VAL 155          HG13      VAL 155  -0.230  17.953 -31.380
 1278   HG21  VAL 155          HG21      VAL 155   1.813  14.977 -29.061
 1279   HG22  VAL 155          HG22      VAL 155   0.448  15.878 -28.438
 1280   HG23  VAL 155          HG23      VAL 155   0.179  14.655 -29.687
 1281    H    MET 156           H        MET 156   3.326  17.838 -31.911
 1282    HA   MET 156           HA       MET 156   1.932  19.336 -33.878
 1283    HB2  MET 156           HB2      MET 156   4.810  19.436 -32.909
 1284    HB3  MET 156           HB3      MET 156   4.075  20.661 -33.960
 1285    HG2  MET 156           HG2      MET 156   2.453  21.272 -32.307
 1286    HG3  MET 156           HG3      MET 156   2.819  19.875 -31.306
 1287    HE1  MET 156           HE1      MET 156   3.063  20.930 -29.110
 1288    HE2  MET 156           HE2      MET 156   3.945  22.432 -28.778
 1289    HE3  MET 156           HE3      MET 156   2.502  22.462 -29.818
 1290    H    SER 157           H        SER 157   4.068  16.579 -34.344
 1291    HA   SER 157           HA       SER 157   4.796  17.160 -37.041
 1292    HB2  SER 157           HB2      SER 157   4.420  14.512 -35.581
 1293    HB3  SER 157           HB3      SER 157   5.075  14.672 -37.220
 1294    HG   SER 157           HG       SER 157   6.177  15.740 -34.809
 1295    H    LEU 158           H        LEU 158   1.738  16.150 -35.615
 1296    HA   LEU 158           HA       LEU 158   0.484  15.317 -38.130
 1297    HB2  LEU 158           HB2      LEU 158  -0.564  16.197 -35.442
 1298    HB3  LEU 158           HB3      LEU 158  -1.639  15.899 -36.788
 1299    HG   LEU 158           HG       LEU 158  -1.132  13.544 -36.769
 1300   HD11  LEU 158          HD11      LEU 158   0.778  14.139 -34.464
 1301   HD12  LEU 158          HD12      LEU 158   0.241  12.517 -34.951
 1302   HD13  LEU 158          HD13      LEU 158   1.216  13.487 -36.065
 1303   HD21  LEU 158          HD21      LEU 158  -2.884  14.489 -35.274
 1304   HD22  LEU 158          HD22      LEU 158  -2.148  13.045 -34.565
 1305   HD23  LEU 158          HD23      LEU 158  -1.698  14.661 -33.962
 1306    H    GLN 159           H        GLN 159   0.538  18.326 -36.106
 1307    HA   GLN 159           HA       GLN 159  -1.264  19.683 -37.920
 1308    HB2  GLN 159           HB2      GLN 159   0.302  20.807 -35.543
 1309    HB3  GLN 159           HB3      GLN 159  -0.948  21.656 -36.441
 1310    HG2  GLN 159           HG2      GLN 159  -2.022  20.919 -34.627
 1311    HG3  GLN 159           HG3      GLN 159  -2.550  19.783 -35.873
 1312   HE21  GLN 159          HE22      GLN 159  -2.774  17.713 -34.908
 1313   HE22  GLN 159          HE21      GLN 159  -1.658  17.109 -33.688
 1314    H    GLU 160           H        GLU 160   2.227  19.430 -37.702
 1315    HA   GLU 160           HA       GLU 160   2.635  21.565 -39.682
 1316    HB2  GLU 160           HB2      GLU 160   3.993  21.243 -37.533
 1317    HB3  GLU 160           HB3      GLU 160   4.753  19.858 -38.314
 1318    HG2  GLU 160           HG2      GLU 160   5.519  21.399 -40.160
 1319    HG3  GLU 160           HG3      GLU 160   4.712  22.738 -39.351
 1320    H    ASN 161           H        ASN 161   1.056  19.450 -40.675
 1321    HA   ASN 161           HA       ASN 161   2.907  18.259 -42.695
 1322    HB2  ASN 161           HB2      ASN 161   2.198  16.531 -41.000
 1323    HB3  ASN 161           HB3      ASN 161   0.527  16.800 -41.507
 1324   HD21  ASN 161          HD22      ASN 161   0.403  14.535 -42.209
 1325   HD22  ASN 161          HD21      ASN 161   1.196  14.014 -43.676
 1326    H    THR 162           H        THR 162   1.497  20.702 -42.761
 1327    HA   THR 162           HA       THR 162  -0.091  21.940 -43.671
 1328    HB   THR 162           HB       THR 162  -0.253  21.632 -46.201
 1329    HG1  THR 162           HG1      THR 162   0.280  19.380 -46.278
 1330   HG21  THR 162          HG21      THR 162   2.504  21.790 -44.908
 1331   HG22  THR 162          HG22      THR 162   2.046  22.385 -46.519
 1332   HG23  THR 162          HG23      THR 162   1.351  23.130 -45.077
 1333    HA   PRO 163           HA       PRO 163  -3.943  19.299 -43.671
 1334    HB2  PRO 163           HB2      PRO 163  -4.787  19.306 -41.105
 1335    HB3  PRO 163           HB3      PRO 163  -3.664  18.045 -41.715
 1336    HG2  PRO 163           HG2      PRO 163  -2.953  20.573 -40.187
 1337    HG3  PRO 163           HG3      PRO 163  -2.447  18.888 -39.851
 1338    HD2  PRO 163           HD2      PRO 163  -0.873  20.601 -41.311
 1339    HD3  PRO 163           HD3      PRO 163  -0.985  18.845 -41.661
 1340    H    LYS 164           H        LYS 164  -2.641  22.069 -41.925
 1341    HA   LYS 164           HA       LYS 164  -3.344  24.148 -41.430
 1342    HB2  LYS 164           HB2      LYS 164  -3.108  24.214 -43.959
 1343    HB3  LYS 164           HB3      LYS 164  -4.866  24.100 -44.056
 1344    HG2  LYS 164           HG2      LYS 164  -5.032  26.210 -42.693
 1345    HG3  LYS 164           HG3      LYS 164  -3.262  26.275 -42.629
 1346    HD2  LYS 164           HD2      LYS 164  -3.181  26.450 -45.107
 1347    HD3  LYS 164           HD3      LYS 164  -4.956  26.375 -45.166
 1348    HE2  LYS 164           HE2      LYS 164  -5.081  28.436 -43.775
 1349    HE3  LYS 164           HE3      LYS 164  -3.313  28.507 -43.722
 1350    HZ1  LYS 164           HZ1      LYS 164  -3.316  28.807 -46.133
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.958  28.743 -46.186
 1352    HZ3  LYS 164           HZ3      LYS 164  -4.205  29.973 -45.422
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1  -1.908   0.645  -2.820
    2    H2   MET   1           H2       MET   1  -1.253   1.760  -1.819
    3    H3   MET   1           H3       MET   1  -1.635   2.171  -3.356
    4    HA   MET   1           HA       MET   1   0.463   0.253  -2.546
    5    HB2  MET   1           HB2      MET   1  -0.561  -0.469  -4.639
    6    HB3  MET   1           HB3      MET   1  -0.376   1.141  -5.346
    7    HG2  MET   1           HG2      MET   1   1.289  -0.438  -6.200
    8    HG3  MET   1           HG3      MET   1   2.049   0.905  -5.371
    9    HE1  MET   1           HE1      MET   1   4.377  -0.206  -5.160
   10    HE2  MET   1           HE2      MET   1   4.627  -1.893  -4.649
   11    HE3  MET   1           HE3      MET   1   3.746  -1.542  -6.148
   12    H    ILE   2           H        ILE   2   2.511   1.135  -2.195
   13    HA   ILE   2           HA       ILE   2   3.152   3.743  -3.378
   14    HB   ILE   2           HB       ILE   2   4.019   3.171  -0.541
   15   HG12  ILE   2          HG12      ILE   2   2.375   5.089   0.112
   16   HG13  ILE   2          HG13      ILE   2   1.448   4.583  -1.300
   17   HG21  ILE   2          HG21      ILE   2   3.758   5.750  -2.160
   18   HG22  ILE   2          HG22      ILE   2   4.465   5.608  -0.541
   19   HG23  ILE   2          HG23      ILE   2   5.258   4.828  -1.913
   20   HD11  ILE   2          HD11      ILE   2   0.551   3.498   0.681
   21   HD12  ILE   2          HD12      ILE   2   1.394   2.225  -0.201
   22   HD13  ILE   2          HD13      ILE   2   2.178   2.982   1.187
   23    H    ASP   3           H        ASP   3   5.226   3.699  -4.156
   24    HA   ASP   3           HA       ASP   3   6.682   1.193  -4.325
   25    HB2  ASP   3           HB2      ASP   3   6.372   3.146  -6.076
   26    HB3  ASP   3           HB3      ASP   3   7.709   3.897  -5.220
   27    H    ASP   4           H        ASP   4   9.067   1.241  -3.743
   28    HA   ASP   4           HA       ASP   4   9.214   1.242  -0.970
   29    HB2  ASP   4           HB2      ASP   4  10.629  -0.123  -2.430
   30    HB3  ASP   4           HB3      ASP   4  11.482   1.317  -2.989
   31    H    ASP   5           H        ASP   5  10.313   3.878  -3.117
   32    HA   ASP   5           HA       ASP   5  11.712   5.163  -0.941
   33    HB2  ASP   5           HB2      ASP   5  12.531   5.109  -3.303
   34    HB3  ASP   5           HB3      ASP   5  11.255   6.259  -3.715
   35    H    GLY   6           H        GLY   6   8.525   4.947  -1.392
   36    HA2  GLY   6           HA2      GLY   6   6.863   6.083  -0.234
   37    HA3  GLY   6           HA3      GLY   6   7.919   7.484  -0.022
   38    H    TYR   7           H        TYR   7   7.280   5.834  -3.165
   39    HA   TYR   7           HA       TYR   7   6.020   8.378  -4.112
   40    HB2  TYR   7           HB2      TYR   7   7.854   6.398  -5.477
   41    HB3  TYR   7           HB3      TYR   7   6.716   7.378  -6.396
   42    HD1  TYR   7           HD2      TYR   7   9.338   7.742  -3.726
   43    HD2  TYR   7           HD1      TYR   7   7.280   9.560  -7.048
   44    HE1  TYR   7           HE2      TYR   7  10.675   9.760  -3.421
   45    HE2  TYR   7           HE1      TYR   7   8.613  11.586  -6.773
   46    HH   TYR   7           HH       TYR   7  10.380  12.653  -5.584
   47    H    ARG   8           H        ARG   8   3.966   8.240  -4.983
   48    HA   ARG   8           HA       ARG   8   2.739   5.500  -4.921
   49    HB2  ARG   8           HB2      ARG   8   1.362   7.198  -4.002
   50    HB3  ARG   8           HB3      ARG   8   1.470   8.205  -5.456
   51    HG2  ARG   8           HG2      ARG   8   0.156   6.530  -6.718
   52    HG3  ARG   8           HG3      ARG   8   0.296   5.388  -5.379
   53    HD2  ARG   8           HD2      ARG   8  -1.895   6.242  -5.323
   54    HD3  ARG   8           HD3      ARG   8  -1.044   6.969  -3.946
   55    HE   ARG   8           HE       ARG   8  -0.747   8.828  -5.983
   56   HH11  ARG   8          HH11      ARG   8  -3.497   7.418  -4.218
   57   HH12  ARG   8          HH12      ARG   8  -4.610   8.649  -4.692
   58   HH21  ARG   8          HH21      ARG   8  -2.264  10.385  -6.722
   59   HH22  ARG   8          HH22      ARG   8  -3.863  10.429  -6.058
   60    HA   PRO   9           HA       PRO   9   3.850   5.413  -9.332
   61    HB2  PRO   9           HB2      PRO   9   3.044   2.886  -9.987
   62    HB3  PRO   9           HB3      PRO   9   4.487   3.200  -8.992
   63    HG2  PRO   9           HG2      PRO   9   1.711   2.436  -8.039
   64    HG3  PRO   9           HG3      PRO   9   3.289   1.754  -7.532
   65    HD2  PRO   9           HD2      PRO   9   1.958   3.704  -6.128
   66    HD3  PRO   9           HD3      PRO   9   3.745   3.593  -6.166
   67    H    ASN  10           H        ASN  10   2.644   6.344 -10.974
   68    HA   ASN  10           HA       ASN  10  -0.302   5.946 -11.047
   69    HB2  ASN  10           HB2      ASN  10   1.161   8.624 -11.261
   70    HB3  ASN  10           HB3      ASN  10  -0.547   8.388 -11.558
   71   HD21  ASN  10          HD22      ASN  10   1.951   8.165  -9.021
   72   HD22  ASN  10          HD21      ASN  10   0.847   8.697  -7.756
   73    H    VAL  11           H        VAL  11  -1.249   6.638 -13.007
   74    HA   VAL  11           HA       VAL  11   0.507   6.891 -15.386
   75    HB   VAL  11           HB       VAL  11  -1.480   5.927 -16.631
   76   HG11  VAL  11          HG11      VAL  11   0.554   4.564 -16.046
   77   HG12  VAL  11          HG12      VAL  11  -0.267   4.035 -14.571
   78   HG13  VAL  11          HG13      VAL  11  -0.930   3.602 -16.154
   79   HG21  VAL  11          HG21      VAL  11  -3.177   6.274 -14.787
   80   HG22  VAL  11          HG22      VAL  11  -3.156   4.627 -15.408
   81   HG23  VAL  11          HG23      VAL  11  -2.401   4.971 -13.864
   82    H    GLY  12           H        GLY  12  -0.107   8.662 -16.769
   83    HA2  GLY  12           HA2      GLY  12  -2.544  10.222 -15.995
   84    HA3  GLY  12           HA3      GLY  12  -1.012  11.030 -16.350
   85    H    ILE  13           H        ILE  13  -3.861  10.610 -17.821
   86    HA   ILE  13           HA       ILE  13  -2.762   9.705 -20.442
   87    HB   ILE  13           HB       ILE  13  -5.616  10.025 -19.416
   88   HG12  ILE  13          HG12      ILE  13  -5.820   7.734 -20.492
   89   HG13  ILE  13          HG13      ILE  13  -4.075   7.727 -20.712
   90   HG21  ILE  13          HG21      ILE  13  -5.600  11.082 -21.588
   91   HG22  ILE  13          HG22      ILE  13  -4.669   9.743 -22.297
   92   HG23  ILE  13          HG23      ILE  13  -6.343   9.497 -21.748
   93   HD11  ILE  13          HD11      ILE  13  -3.762   7.692 -18.278
   94   HD12  ILE  13          HD12      ILE  13  -5.517   7.943 -18.031
   95   HD13  ILE  13          HD13      ILE  13  -4.916   6.439 -18.755
   96    H    VAL  14           H        VAL  14  -2.160  11.237 -21.857
   97    HA   VAL  14           HA       VAL  14  -3.183  14.018 -21.511
   98    HB   VAL  14           HB       VAL  14  -0.919  12.999 -23.294
   99   HG11  VAL  14          HG11      VAL  14  -0.391  15.386 -23.596
  100   HG12  VAL  14          HG12      VAL  14  -2.025  15.032 -24.161
  101   HG13  VAL  14          HG13      VAL  14  -1.792  15.839 -22.597
  102   HG21  VAL  14          HG21      VAL  14  -0.099  12.783 -21.083
  103   HG22  VAL  14          HG22      VAL  14   0.577  14.265 -21.745
  104   HG23  VAL  14          HG23      VAL  14  -0.776  14.375 -20.604
  105    H    ILE  15           H        ILE  15  -5.356  13.502 -22.347
  106    HA   ILE  15           HA       ILE  15  -5.576  12.251 -24.979
  107    HB   ILE  15           HB       ILE  15  -7.513  14.196 -23.633
  108   HG12  ILE  15          HG12      ILE  15  -7.362  12.103 -22.404
  109   HG13  ILE  15          HG13      ILE  15  -8.923  12.360 -23.147
  110   HG21  ILE  15          HG21      ILE  15  -7.949  14.383 -25.966
  111   HG22  ILE  15          HG22      ILE  15  -7.856  12.624 -26.209
  112   HG23  ILE  15          HG23      ILE  15  -9.198  13.349 -25.283
  113   HD11  ILE  15          HD11      ILE  15  -8.416  10.753 -24.945
  114   HD12  ILE  15          HD12      ILE  15  -6.750  10.569 -24.370
  115   HD13  ILE  15          HD13      ILE  15  -8.099   9.981 -23.381
  116    H    CYS  16           H        CYS  16  -5.205  13.112 -26.879
  117    HA   CYS  16           HA       CYS  16  -5.043  16.097 -27.137
  118    HB2  CYS  16           HB2      CYS  16  -3.296  13.966 -28.424
  119    HB3  CYS  16           HB3      CYS  16  -3.552  15.557 -29.190
  120    HG   CYS  16           HG       CYS  16  -2.845  17.044 -27.211
  121    H    ASN  17           H        ASN  17  -6.613  16.851 -28.445
  122    HA   ASN  17           HA       ASN  17  -8.548  14.816 -29.314
  123    HB2  ASN  17           HB2      ASN  17  -8.989  17.042 -27.960
  124    HB3  ASN  17           HB3      ASN  17  -9.036  17.806 -29.545
  125   HD21  ASN  17          HD22      ASN  17 -10.433  15.367 -27.420
  126   HD22  ASN  17          HD21      ASN  17 -11.915  15.123 -28.321
  127    H    ARG  18           H        ARG  18  -6.340  14.655 -30.904
  128    HA   ARG  18           HA       ARG  18  -5.085  15.172 -32.657
  129    HB2  ARG  18           HB2      ARG  18  -6.095  14.284 -34.711
  130    HB3  ARG  18           HB3      ARG  18  -6.254  13.248 -33.278
  131    HG2  ARG  18           HG2      ARG  18  -8.546  13.953 -32.946
  132    HG3  ARG  18           HG3      ARG  18  -8.422  15.116 -34.294
  133    HD2  ARG  18           HD2      ARG  18  -9.578  13.129 -35.097
  134    HD3  ARG  18           HD3      ARG  18  -7.980  13.266 -35.855
  135    HE   ARG  18           HE       ARG  18  -8.319  11.550 -33.426
  136   HH11  ARG  18          HH11      ARG  18  -7.923  11.606 -36.968
  137   HH12  ARG  18          HH12      ARG  18  -7.354   9.977 -37.064
  138   HH21  ARG  18          HH21      ARG  18  -7.528   9.463 -33.535
  139   HH22  ARG  18          HH22      ARG  18  -7.111   8.718 -35.059
  140    H    GLN  19           H        GLN  19  -7.095  17.601 -32.029
  141    HA   GLN  19           HA       GLN  19  -6.608  19.030 -34.521
  142    HB2  GLN  19           HB2      GLN  19  -7.960  19.744 -31.899
  143    HB3  GLN  19           HB3      GLN  19  -7.847  20.880 -33.241
  144    HG2  GLN  19           HG2      GLN  19  -9.297  19.631 -34.620
  145    HG3  GLN  19           HG3      GLN  19  -9.153  18.168 -33.646
  146   HE21  GLN  19          HE22      GLN  19 -10.257  18.031 -31.585
  147   HE22  GLN  19          HE21      GLN  19 -11.413  19.238 -31.054
  148    H    GLY  20           H        GLY  20  -4.399  18.277 -32.233
  149    HA2  GLY  20           HA2      GLY  20  -2.405  19.246 -31.644
  150    HA3  GLY  20           HA3      GLY  20  -2.862  20.761 -32.417
  151    H    GLN  21           H        GLN  21  -5.020  19.260 -30.095
  152    HA   GLN  21           HA       GLN  21  -4.579  21.523 -28.212
  153    HB2  GLN  21           HB2      GLN  21  -7.316  20.454 -28.957
  154    HB3  GLN  21           HB3      GLN  21  -6.928  21.914 -28.067
  155    HG2  GLN  21           HG2      GLN  21  -6.613  21.383 -31.027
  156    HG3  GLN  21           HG3      GLN  21  -7.698  22.516 -30.257
  157   HE21  GLN  21          HE22      GLN  21  -5.062  22.557 -32.267
  158   HE22  GLN  21          HE21      GLN  21  -4.260  23.980 -31.666
  159    H    VAL  22           H        VAL  22  -5.200  20.985 -26.040
  160    HA   VAL  22           HA       VAL  22  -4.713  18.076 -25.514
  161    HB   VAL  22           HB       VAL  22  -3.674  19.010 -23.339
  162   HG11  VAL  22          HG11      VAL  22  -2.340  17.951 -25.046
  163   HG12  VAL  22          HG12      VAL  22  -2.380  19.417 -26.055
  164   HG13  VAL  22          HG13      VAL  22  -1.501  19.411 -24.510
  165   HG21  VAL  22          HG21      VAL  22  -2.739  21.233 -23.401
  166   HG22  VAL  22          HG22      VAL  22  -3.398  21.549 -25.007
  167   HG23  VAL  22          HG23      VAL  22  -4.497  21.371 -23.625
  168    H    MET  23           H        MET  23  -5.423  17.130 -23.576
  169    HA   MET  23           HA       MET  23  -8.107  17.392 -22.900
  170    HB2  MET  23           HB2      MET  23  -6.389  15.487 -22.404
  171    HB3  MET  23           HB3      MET  23  -6.049  16.366 -20.924
  172    HG2  MET  23           HG2      MET  23  -8.451  16.321 -20.328
  173    HG3  MET  23           HG3      MET  23  -8.818  15.477 -21.839
  174    HE1  MET  23           HE1      MET  23 -10.261  13.790 -20.301
  175    HE2  MET  23           HE2      MET  23  -9.575  13.026 -18.843
  176    HE3  MET  23           HE3      MET  23  -9.736  14.788 -18.917
  177    H    TRP  24           H        TRP  24  -9.202  18.792 -21.438
  178    HA   TRP  24           HA       TRP  24  -7.889  19.635 -19.040
  179    HB2  TRP  24           HB2      TRP  24  -7.382  21.396 -20.933
  180    HB3  TRP  24           HB3      TRP  24  -9.050  21.876 -20.714
  181    HD1  TRP  24           HD1      TRP  24  -8.679  24.180 -19.817
  182    HE1  TRP  24           HE1      TRP  24  -7.457  25.294 -17.881
  183    HE3  TRP  24           HE3      TRP  24  -6.240  20.067 -17.872
  184    HZ2  TRP  24           HZ2      TRP  24  -5.600  24.538 -15.800
  185    HZ3  TRP  24           HZ3      TRP  24  -4.794  20.320 -15.903
  186    HH2  TRP  24           HH2      TRP  24  -4.456  22.545 -14.856
  187    H    ALA  25           H        ALA  25  -9.493  19.701 -17.427
  188    HA   ALA  25           HA       ALA  25 -12.301  19.803 -18.254
  189    HB1  ALA  25           HB1      ALA  25 -12.810  17.616 -17.205
  190    HB2  ALA  25           HB2      ALA  25 -11.807  17.446 -18.653
  191    HB3  ALA  25           HB3      ALA  25 -11.070  17.299 -17.039
  192    H    ARG  26           H        ARG  26 -13.711  20.215 -16.623
  193    HA   ARG  26           HA       ARG  26 -12.550  21.792 -14.456
  194    HB2  ARG  26           HB2      ARG  26 -14.419  22.559 -15.960
  195    HB3  ARG  26           HB3      ARG  26 -15.465  21.330 -15.231
  196    HG2  ARG  26           HG2      ARG  26 -15.209  22.422 -13.017
  197    HG3  ARG  26           HG3      ARG  26 -14.040  23.557 -13.716
  198    HD2  ARG  26           HD2      ARG  26 -16.162  24.687 -13.503
  199    HD3  ARG  26           HD3      ARG  26 -15.783  24.459 -15.218
  200    HE   ARG  26           HE       ARG  26 -17.410  22.285 -14.253
  201   HH11  ARG  26          HH11      ARG  26 -17.687  25.721 -15.143
  202   HH12  ARG  26          HH12      ARG  26 -19.359  25.605 -15.564
  203   HH21  ARG  26          HH21      ARG  26 -19.572  22.123 -14.805
  204   HH22  ARG  26          HH22      ARG  26 -20.470  23.511 -15.363
  205    H    ARG  27           H        ARG  27 -12.544  21.182 -12.278
  206    HA   ARG  27           HA       ARG  27 -13.093  18.329 -11.837
  207    HB2  ARG  27           HB2      ARG  27 -10.883  19.555 -11.453
  208    HB3  ARG  27           HB3      ARG  27 -11.600  20.257 -10.023
  209    HG2  ARG  27           HG2      ARG  27 -11.179  17.300 -10.583
  210    HG3  ARG  27           HG3      ARG  27 -10.163  18.309  -9.571
  211    HD2  ARG  27           HD2      ARG  27 -12.123  18.702  -8.046
  212    HD3  ARG  27           HD3      ARG  27 -13.019  17.476  -8.995
  213    HE   ARG  27           HE       ARG  27 -10.826  16.091  -8.357
  214   HH11  ARG  27          HH11      ARG  27 -13.318  17.795  -6.424
  215   HH12  ARG  27          HH12      ARG  27 -13.158  16.702  -5.087
  216   HH21  ARG  27          HH21      ARG  27 -10.741  14.679  -6.791
  217   HH22  ARG  27          HH22      ARG  27 -11.616  14.826  -5.274
  218    H    PHE  28           H        PHE  28 -14.635  17.555 -10.458
  219    HA   PHE  28           HA       PHE  28 -16.874  18.935  -9.536
  220    HB2  PHE  28           HB2      PHE  28 -15.415  16.528  -8.340
  221    HB3  PHE  28           HB3      PHE  28 -16.997  17.070  -7.802
  222    HD1  PHE  28           HD2      PHE  28 -18.766  17.480  -9.724
  223    HD2  PHE  28           HD1      PHE  28 -15.394  14.814  -9.932
  224    HE1  PHE  28           HE2      PHE  28 -19.941  16.150 -11.478
  225    HE2  PHE  28           HE1      PHE  28 -16.572  13.478 -11.707
  226    HZ   PHE  28           HZ       PHE  28 -18.826  14.176 -12.477
  227    H    GLY  29           H        GLY  29 -17.320  20.270  -7.869
  228    HA2  GLY  29           HA2      GLY  29 -17.254  21.286  -5.821
  229    HA3  GLY  29           HA3      GLY  29 -16.034  20.114  -5.307
  230    H    GLN  30           H        GLN  30 -14.263  20.965  -7.644
  231    HA   GLN  30           HA       GLN  30 -12.927  23.225  -6.356
  232    HB2  GLN  30           HB2      GLN  30 -11.942  21.149  -7.716
  233    HB3  GLN  30           HB3      GLN  30 -12.240  22.203  -9.107
  234    HG2  GLN  30           HG2      GLN  30 -10.870  23.978  -7.828
  235    HG3  GLN  30           HG3      GLN  30 -10.413  22.687  -6.721
  236   HE21  GLN  30          HE22      GLN  30  -9.866  24.113  -9.838
  237   HE22  GLN  30          HE21      GLN  30  -8.710  22.950 -10.470
  238    H    HIS  31           H        HIS  31 -14.932  22.593  -9.232
  239    HA   HIS  31           HA       HIS  31 -15.897  23.841 -10.792
  240    HB2  HIS  31           HB2      HIS  31 -15.995  26.065  -8.736
  241    HB3  HIS  31           HB3      HIS  31 -16.964  25.940 -10.201
  242    HD1  HIS  31           HD1      HIS  31 -18.801  23.808 -10.219
  243    HD2  HIS  31           HD2      HIS  31 -16.908  24.822  -6.592
  244    HE1  HIS  31           HE1      HIS  31 -20.131  22.670  -8.375
  245    H    SER  32           H        SER  32 -13.002  23.737 -10.694
  246    HA   SER  32           HA       SER  32 -12.491  25.637 -12.815
  247    HB2  SER  32           HB2      SER  32 -10.296  26.352 -11.743
  248    HB3  SER  32           HB3      SER  32 -11.767  27.056 -11.071
  249    HG   SER  32           HG       SER  32 -10.610  26.436  -9.333
  250    H    TRP  33           H        TRP  33 -10.059  24.998 -13.582
  251    HA   TRP  33           HA       TRP  33 -10.477  22.283 -14.399
  252    HB2  TRP  33           HB2      TRP  33  -8.157  24.099 -15.045
  253    HB3  TRP  33           HB3      TRP  33  -8.788  22.748 -15.998
  254    HD1  TRP  33           HD1      TRP  33  -9.312  26.446 -15.306
  255    HE1  TRP  33           HE1      TRP  33 -11.176  27.406 -16.752
  256    HE3  TRP  33           HE3      TRP  33 -10.889  22.140 -17.514
  257    HZ2  TRP  33           HZ2      TRP  33 -13.189  26.407 -18.603
  258    HZ3  TRP  33           HZ3      TRP  33 -12.803  22.142 -19.110
  259    HH2  TRP  33           HH2      TRP  33 -13.967  24.275 -19.643
  260    H    GLN  34           H        GLN  34  -8.935  20.498 -14.349
  261    HA   GLN  34           HA       GLN  34  -6.561  20.779 -12.704
  262    HB2  GLN  34           HB2      GLN  34  -8.566  20.012 -11.166
  263    HB3  GLN  34           HB3      GLN  34  -8.348  18.446 -11.962
  264    HG2  GLN  34           HG2      GLN  34  -5.906  18.532 -11.218
  265    HG3  GLN  34           HG3      GLN  34  -6.278  20.023 -10.358
  266   HE21  GLN  34          HE22      GLN  34  -8.029  19.838  -8.571
  267   HE22  GLN  34          HE21      GLN  34  -8.036  18.329  -7.685
  268    H    PHE  35           H        PHE  35  -5.219  18.787 -12.886
  269    HA   PHE  35           HA       PHE  35  -5.105  17.891 -15.648
  270    HB2  PHE  35           HB2      PHE  35  -2.882  16.939 -14.713
  271    HB3  PHE  35           HB3      PHE  35  -3.051  18.683 -14.852
  272    HD1  PHE  35           HD1      PHE  35  -3.213  20.102 -12.909
  273    HD2  PHE  35           HD2      PHE  35  -3.054  15.831 -12.424
  274    HE1  PHE  35           HE1      PHE  35  -2.918  20.396 -10.451
  275    HE2  PHE  35           HE2      PHE  35  -2.793  16.129  -9.968
  276    HZ   PHE  35           HZ       PHE  35  -2.722  18.406  -8.985
  277    HA   PRO  36           HA       PRO  36  -6.451  13.742 -14.533
  278    HB2  PRO  36           HB2      PRO  36  -4.592  12.836 -16.724
  279    HB3  PRO  36           HB3      PRO  36  -6.307  12.396 -16.463
  280    HG2  PRO  36           HG2      PRO  36  -5.620  14.203 -18.375
  281    HG3  PRO  36           HG3      PRO  36  -7.051  14.498 -17.330
  282    HD2  PRO  36           HD2      PRO  36  -4.242  15.622 -17.060
  283    HD3  PRO  36           HD3      PRO  36  -5.824  16.458 -16.969
  284    H    GLN  37           H        GLN  37  -5.630  11.798 -13.577
  285    HA   GLN  37           HA       GLN  37  -2.998  10.785 -13.572
  286    HB2  GLN  37           HB2      GLN  37  -2.264  11.103 -11.292
  287    HB3  GLN  37           HB3      GLN  37  -2.139  12.527 -12.287
  288    HG2  GLN  37           HG2      GLN  37  -4.229  13.442 -11.194
  289    HG3  GLN  37           HG3      GLN  37  -4.291  11.995 -10.181
  290   HE21  GLN  37          HE22      GLN  37  -4.210  13.554  -8.349
  291   HE22  GLN  37          HE21      GLN  37  -2.663  14.191  -7.854
  292    H    GLY  38           H        GLY  38  -3.064   8.648 -12.596
  293    HA2  GLY  38           HA2      GLY  38  -5.069   8.115 -10.515
  294    HA3  GLY  38           HA3      GLY  38  -5.289   7.203 -12.017
  295    H    GLY  39           H        GLY  39  -4.447   6.351  -9.198
  296    HA2  GLY  39           HA2      GLY  39  -1.677   5.638  -9.247
  297    HA3  GLY  39           HA3      GLY  39  -2.901   5.111  -8.093
  298    H    ILE  40           H        ILE  40  -0.873   3.518  -9.274
  299    HA   ILE  40           HA       ILE  40  -2.168   1.775 -11.259
  300    HB   ILE  40           HB       ILE  40   0.604   1.928 -10.050
  301   HG12  ILE  40          HG12      ILE  40  -0.601   2.472 -12.787
  302   HG13  ILE  40          HG13      ILE  40   0.136   3.627 -11.698
  303   HG21  ILE  40          HG21      ILE  40   1.328   0.098 -11.502
  304   HG22  ILE  40          HG22      ILE  40   0.131  -0.460 -10.363
  305   HG23  ILE  40          HG23      ILE  40  -0.343  -0.164 -12.052
  306   HD11  ILE  40          HD11      ILE  40   2.358   2.475 -12.083
  307   HD12  ILE  40          HD12      ILE  40   1.550   1.492 -13.328
  308   HD13  ILE  40          HD13      ILE  40   1.638   3.247 -13.509
  309    H    ASN  41           H        ASN  41  -3.060  -0.158 -10.866
  310    HA   ASN  41           HA       ASN  41  -3.668  -1.117  -8.208
  311    HB2  ASN  41           HB2      ASN  41  -5.212  -1.568 -10.037
  312    HB3  ASN  41           HB3      ASN  41  -3.929  -2.253 -11.021
  313   HD21  ASN  41          HD22      ASN  41  -4.975  -4.319 -11.349
  314   HD22  ASN  41          HD21      ASN  41  -5.220  -5.419 -10.007
  315    HA   PRO  42           HA       PRO  42   0.362  -2.767  -7.578
  316    HB2  PRO  42           HB2      PRO  42  -0.126  -4.662  -5.569
  317    HB3  PRO  42           HB3      PRO  42   0.113  -2.909  -5.323
  318    HG2  PRO  42           HG2      PRO  42  -2.495  -4.423  -5.582
  319    HG3  PRO  42           HG3      PRO  42  -2.056  -3.154  -4.389
  320    HD2  PRO  42           HD2      PRO  42  -3.523  -2.519  -6.538
  321    HD3  PRO  42           HD3      PRO  42  -2.197  -1.436  -6.045
  322    H    GLY  43           H        GLY  43   1.212  -3.867  -9.072
  323    HA2  GLY  43           HA2      GLY  43   2.149  -5.852  -9.946
  324    HA3  GLY  43           HA3      GLY  43   0.750  -6.781  -9.378
  325    H    GLU  44           H        GLU  44  -0.472  -4.003 -10.802
  326    HA   GLU  44           HA       GLU  44  -1.023  -5.264 -13.430
  327    HB2  GLU  44           HB2      GLU  44  -2.727  -4.125 -11.959
  328    HB3  GLU  44           HB3      GLU  44  -1.938  -2.585 -12.332
  329    HG2  GLU  44           HG2      GLU  44  -2.519  -2.678 -14.593
  330    HG3  GLU  44           HG3      GLU  44  -2.794  -4.428 -14.570
  331    H    SER  45           H        SER  45   0.081  -4.721 -15.231
  332    HA   SER  45           HA       SER  45   2.427  -3.103 -15.042
  333    HB2  SER  45           HB2      SER  45   2.326  -3.692 -17.636
  334    HB3  SER  45           HB3      SER  45   2.808  -4.850 -16.391
  335    HG   SER  45           HG       SER  45   1.309  -6.002 -17.379
  336    H    ALA  46           H        ALA  46   2.937  -1.386 -16.485
  337    HA   ALA  46           HA       ALA  46   1.529   0.857 -15.792
  338    HB1  ALA  46           HB1      ALA  46   3.293   0.471 -18.257
  339    HB2  ALA  46           HB2      ALA  46   2.973   2.017 -17.415
  340    HB3  ALA  46           HB3      ALA  46   3.897   0.734 -16.605
  341    H    GLU  47           H        GLU  47   1.306  -0.875 -18.953
  342    HA   GLU  47           HA       GLU  47  -0.456   1.131 -20.073
  343    HB2  GLU  47           HB2      GLU  47   0.267  -1.698 -20.923
  344    HB3  GLU  47           HB3      GLU  47  -0.866  -0.681 -21.821
  345    HG2  GLU  47           HG2      GLU  47   0.806   1.007 -22.220
  346    HG3  GLU  47           HG3      GLU  47   1.982   0.173 -21.193
  347    H    GLN  48           H        GLN  48  -0.896  -2.001 -18.425
  348    HA   GLN  48           HA       GLN  48  -3.686  -2.282 -18.893
  349    HB2  GLN  48           HB2      GLN  48  -1.792  -3.478 -16.802
  350    HB3  GLN  48           HB3      GLN  48  -3.500  -3.837 -16.847
  351    HG2  GLN  48           HG2      GLN  48  -2.011  -5.502 -18.032
  352    HG3  GLN  48           HG3      GLN  48  -3.403  -4.919 -18.928
  353   HE21  GLN  48          HE22      GLN  48   0.161  -4.308 -18.565
  354   HE22  GLN  48          HE21      GLN  48   0.400  -3.801 -20.226
  355    H    ALA  49           H        ALA  49  -1.871  -0.754 -16.161
  356    HA   ALA  49           HA       ALA  49  -4.225   0.194 -14.812
  357    HB1  ALA  49           HB1      ALA  49  -1.378   1.254 -14.771
  358    HB2  ALA  49           HB2      ALA  49  -2.680   1.723 -13.657
  359    HB3  ALA  49           HB3      ALA  49  -2.076   0.046 -13.660
  360    H    MET  50           H        MET  50  -2.301   1.505 -17.547
  361    HA   MET  50           HA       MET  50  -3.378   4.123 -17.407
  362    HB2  MET  50           HB2      MET  50  -1.293   3.580 -18.546
  363    HB3  MET  50           HB3      MET  50  -2.170   2.702 -19.799
  364    HG2  MET  50           HG2      MET  50  -2.698   5.617 -19.147
  365    HG3  MET  50           HG3      MET  50  -1.469   5.105 -20.283
  366    HE1  MET  50           HE1      MET  50  -3.227   3.858 -23.385
  367    HE2  MET  50           HE2      MET  50  -1.730   4.486 -22.665
  368    HE3  MET  50           HE3      MET  50  -2.402   2.927 -22.119
  369    H    TYR  51           H        TYR  51  -4.603   1.267 -19.278
  370    HA   TYR  51           HA       TYR  51  -6.869   2.700 -20.176
  371    HB2  TYR  51           HB2      TYR  51  -6.609  -0.269 -19.679
  372    HB3  TYR  51           HB3      TYR  51  -7.851   0.528 -20.634
  373    HD1  TYR  51           HD2      TYR  51  -7.061   1.969 -22.680
  374    HD2  TYR  51           HD1      TYR  51  -4.509  -0.801 -20.634
  375    HE1  TYR  51           HE2      TYR  51  -5.652   1.816 -24.709
  376    HE2  TYR  51           HE1      TYR  51  -3.004  -0.904 -22.591
  377    HH   TYR  51           HH       TYR  51  -3.774   0.789 -25.698
  378    H    ARG  52           H        ARG  52  -6.364   1.140 -16.967
  379    HA   ARG  52           HA       ARG  52  -9.090   1.412 -16.076
  380    HB2  ARG  52           HB2      ARG  52  -6.630   1.966 -14.357
  381    HB3  ARG  52           HB3      ARG  52  -8.245   1.594 -13.804
  382    HG2  ARG  52           HG2      ARG  52  -6.395  -0.297 -15.273
  383    HG3  ARG  52           HG3      ARG  52  -6.624  -0.208 -13.527
  384    HD2  ARG  52           HD2      ARG  52  -9.028  -0.837 -13.845
  385    HD3  ARG  52           HD3      ARG  52  -8.692  -1.085 -15.580
  386    HE   ARG  52           HE       ARG  52  -6.703  -2.443 -14.133
  387   HH11  ARG  52          HH11      ARG  52 -10.229  -2.799 -14.586
  388   HH12  ARG  52          HH12      ARG  52 -10.237  -4.491 -14.231
  389   HH21  ARG  52          HH21      ARG  52  -6.715  -4.598 -13.584
  390   HH22  ARG  52          HH22      ARG  52  -8.162  -5.574 -13.676
  391    H    ALA  53           H        ALA  53  -6.293   3.718 -15.941
  392    HA   ALA  53           HA       ALA  53  -7.890   5.786 -14.776
  393    HB1  ALA  53           HB1      ALA  53  -5.478   5.762 -14.537
  394    HB2  ALA  53           HB2      ALA  53  -5.272   5.931 -16.305
  395    HB3  ALA  53           HB3      ALA  53  -5.984   7.258 -15.361
  396    H    LEU  54           H        LEU  54  -7.358   4.819 -18.146
  397    HA   LEU  54           HA       LEU  54  -8.231   7.224 -19.418
  398    HB2  LEU  54           HB2      LEU  54  -7.050   5.302 -20.465
  399    HB3  LEU  54           HB3      LEU  54  -8.438   4.285 -20.082
  400    HG   LEU  54           HG       LEU  54  -9.837   5.528 -21.682
  401   HD11  LEU  54          HD11      LEU  54  -8.621   7.684 -21.725
  402   HD12  LEU  54          HD12      LEU  54  -7.200   6.874 -22.433
  403   HD13  LEU  54          HD13      LEU  54  -8.731   6.981 -23.346
  404   HD21  LEU  54          HD21      LEU  54  -8.749   3.442 -22.136
  405   HD22  LEU  54          HD22      LEU  54  -8.802   4.442 -23.592
  406   HD23  LEU  54          HD23      LEU  54  -7.265   4.282 -22.684
  407    H    PHE  55           H        PHE  55  -9.808   4.269 -18.300
  408    HA   PHE  55           HA       PHE  55 -12.489   5.006 -18.916
  409    HB2  PHE  55           HB2      PHE  55 -12.187   2.752 -18.743
  410    HB3  PHE  55           HB3      PHE  55 -11.109   2.857 -17.376
  411    HD1  PHE  55           HD2      PHE  55 -14.685   2.904 -18.380
  412    HD2  PHE  55           HD1      PHE  55 -11.852   2.813 -15.133
  413    HE1  PHE  55           HE2      PHE  55 -16.513   2.297 -16.805
  414    HE2  PHE  55           HE1      PHE  55 -13.679   2.185 -13.555
  415    HZ   PHE  55           HZ       PHE  55 -16.016   1.946 -14.393
  416    H    GLU  56           H        GLU  56 -10.668   5.317 -15.771
  417    HA   GLU  56           HA       GLU  56 -12.855   6.472 -14.405
  418    HB2  GLU  56           HB2      GLU  56  -9.843   6.709 -13.965
  419    HB3  GLU  56           HB3      GLU  56 -11.044   7.320 -12.833
  420    HG2  GLU  56           HG2      GLU  56 -11.857   5.119 -12.332
  421    HG3  GLU  56           HG3      GLU  56 -10.906   4.383 -13.613
  422    H    GLU  57           H        GLU  57 -10.045   8.076 -16.008
  423    HA   GLU  57           HA       GLU  57 -10.905  10.688 -15.157
  424    HB2  GLU  57           HB2      GLU  57  -8.714   9.852 -17.103
  425    HB3  GLU  57           HB3      GLU  57  -8.869  11.413 -16.310
  426    HG2  GLU  57           HG2      GLU  57  -8.460   8.806 -14.772
  427    HG3  GLU  57           HG3      GLU  57  -7.151   9.828 -15.337
  428    H    VAL  58           H        VAL  58 -11.141   8.806 -18.155
  429    HA   VAL  58           HA       VAL  58 -12.166  11.206 -19.564
  430    HB   VAL  58           HB       VAL  58 -10.944   8.888 -21.014
  431   HG11  VAL  58          HG11      VAL  58 -10.337  10.575 -22.594
  432   HG12  VAL  58          HG12      VAL  58 -12.004  10.870 -22.114
  433   HG13  VAL  58          HG13      VAL  58 -10.718  11.886 -21.449
  434   HG21  VAL  58          HG21      VAL  58  -8.666   9.975 -20.884
  435   HG22  VAL  58          HG22      VAL  58  -9.255  10.991 -19.561
  436   HG23  VAL  58          HG23      VAL  58  -9.164   9.245 -19.356
  437    H    GLY  59           H        GLY  59 -13.009   8.034 -18.425
  438    HA2  GLY  59           HA2      GLY  59 -15.005   6.880 -18.685
  439    HA3  GLY  59           HA3      GLY  59 -15.590   8.166 -19.736
  440    H    LEU  60           H        LEU  60 -12.527   6.941 -20.698
  441    HA   LEU  60           HA       LEU  60 -13.859   5.757 -23.098
  442    HB2  LEU  60           HB2      LEU  60 -11.128   7.019 -22.708
  443    HB3  LEU  60           HB3      LEU  60 -11.637   6.180 -24.163
  444    HG   LEU  60           HG       LEU  60 -12.774   8.723 -22.969
  445   HD11  LEU  60          HD11      LEU  60 -10.640   8.887 -24.295
  446   HD12  LEU  60          HD12      LEU  60 -11.527   8.258 -25.708
  447   HD13  LEU  60          HD13      LEU  60 -11.984   9.810 -24.989
  448   HD21  LEU  60          HD21      LEU  60 -14.254   8.858 -25.003
  449   HD22  LEU  60          HD22      LEU  60 -13.839   7.174 -25.369
  450   HD23  LEU  60          HD23      LEU  60 -14.703   7.593 -23.872
  451    H    SER  61           H        SER  61 -13.072   3.844 -23.977
  452    HA   SER  61           HA       SER  61 -11.916   2.005 -21.934
  453    HB2  SER  61           HB2      SER  61 -13.624   1.540 -24.402
  454    HB3  SER  61           HB3      SER  61 -13.015   0.263 -23.319
  455    HG   SER  61           HG       SER  61 -15.181   0.932 -22.786
  456    H    ARG  62           H        ARG  62 -10.683   0.153 -23.080
  457    HA   ARG  62           HA       ARG  62  -8.353   1.337 -24.218
  458    HB2  ARG  62           HB2      ARG  62  -7.377  -0.889 -24.010
  459    HB3  ARG  62           HB3      ARG  62  -8.312  -0.467 -22.580
  460    HG2  ARG  62           HG2      ARG  62 -10.193  -1.913 -23.413
  461    HG3  ARG  62           HG3      ARG  62  -9.173  -2.385 -24.773
  462    HD2  ARG  62           HD2      ARG  62  -8.921  -4.109 -23.123
  463    HD3  ARG  62           HD3      ARG  62  -7.431  -3.186 -23.139
  464    HE   ARG  62           HE       ARG  62  -7.815  -2.447 -20.986
  465   HH11  ARG  62          HH11      ARG  62 -10.779  -4.034 -22.165
  466   HH12  ARG  62          HH12      ARG  62 -11.526  -4.109 -20.612
  467   HH21  ARG  62          HH21      ARG  62  -8.801  -2.595 -18.903
  468   HH22  ARG  62          HH22      ARG  62 -10.375  -3.279 -18.725
  469    H    LYS  63           H        LYS  63 -10.352   1.852 -25.955
  470    HA   LYS  63           HA       LYS  63  -9.465   0.657 -28.493
  471    HB2  LYS  63           HB2      LYS  63 -11.682  -0.164 -29.038
  472    HB3  LYS  63           HB3      LYS  63 -11.105  -0.882 -27.517
  473    HG2  LYS  63           HG2      LYS  63 -12.580   0.539 -26.197
  474    HG3  LYS  63           HG3      LYS  63 -13.044   1.483 -27.610
  475    HD2  LYS  63           HD2      LYS  63 -14.827  -0.036 -27.041
  476    HD3  LYS  63           HD3      LYS  63 -14.144  -0.467 -28.618
  477    HE2  LYS  63           HE2      LYS  63 -12.847  -2.311 -27.559
  478    HE3  LYS  63           HE3      LYS  63 -13.489  -1.859 -25.971
  479    HZ1  LYS  63           HZ1      LYS  63 -14.723  -3.703 -26.936
  480    HZ2  LYS  63           HZ2      LYS  63 -15.721  -2.416 -26.805
  481    HZ3  LYS  63           HZ3      LYS  63 -15.109  -2.844 -28.266
  482    H    ASP  64           H        ASP  64 -10.664   3.323 -26.683
  483    HA   ASP  64           HA       ASP  64 -11.957   4.644 -29.017
  484    HB2  ASP  64           HB2      ASP  64 -11.745   5.363 -26.088
  485    HB3  ASP  64           HB3      ASP  64 -12.612   6.319 -27.278
  486    H    VAL  65           H        VAL  65  -8.845   4.306 -28.057
  487    HA   VAL  65           HA       VAL  65  -8.017   6.970 -28.917
  488    HB   VAL  65           HB       VAL  65  -6.614   7.287 -26.930
  489   HG11  VAL  65          HG11      VAL  65  -8.889   8.339 -27.091
  490   HG12  VAL  65          HG12      VAL  65  -9.498   7.042 -26.046
  491   HG13  VAL  65          HG13      VAL  65  -8.252   8.156 -25.443
  492   HG21  VAL  65          HG21      VAL  65  -8.185   4.984 -25.683
  493   HG22  VAL  65          HG22      VAL  65  -6.478   4.898 -26.157
  494   HG23  VAL  65          HG23      VAL  65  -6.975   6.000 -24.867
  495    H    ARG  66           H        ARG  66  -5.508   6.956 -28.909
  496    HA   ARG  66           HA       ARG  66  -4.394   4.341 -29.822
  497    HB2  ARG  66           HB2      ARG  66  -5.306   5.367 -31.803
  498    HB3  ARG  66           HB3      ARG  66  -4.893   6.982 -31.263
  499    HG2  ARG  66           HG2      ARG  66  -3.472   6.506 -33.039
  500    HG3  ARG  66           HG3      ARG  66  -2.495   6.495 -31.579
  501    HD2  ARG  66           HD2      ARG  66  -3.616   3.848 -32.494
  502    HD3  ARG  66           HD3      ARG  66  -2.417   4.588 -33.559
  503    HE   ARG  66           HE       ARG  66  -1.106   4.787 -31.227
  504   HH11  ARG  66          HH11      ARG  66  -2.656   1.978 -32.777
  505   HH12  ARG  66          HH12      ARG  66  -1.501   0.851 -32.160
  506   HH21  ARG  66          HH21      ARG  66   0.398   3.336 -30.449
  507   HH22  ARG  66          HH22      ARG  66   0.284   1.638 -30.792
  508    H    ILE  67           H        ILE  67  -2.397   4.179 -28.665
  509    HA   ILE  67           HA       ILE  67  -1.331   6.539 -27.329
  510    HB   ILE  67           HB       ILE  67  -0.195   3.740 -27.706
  511   HG12  ILE  67          HG12      ILE  67  -1.540   4.850 -25.206
  512   HG13  ILE  67          HG13      ILE  67  -2.470   3.999 -26.429
  513   HG21  ILE  67          HG21      ILE  67   1.256   4.337 -25.757
  514   HG22  ILE  67          HG22      ILE  67   1.569   5.352 -27.150
  515   HG23  ILE  67          HG23      ILE  67   0.606   5.989 -25.793
  516   HD11  ILE  67          HD11      ILE  67  -0.977   2.015 -26.186
  517   HD12  ILE  67          HD12      ILE  67  -0.126   2.842 -24.855
  518   HD13  ILE  67          HD13      ILE  67  -1.835   2.432 -24.694
  519    H    LEU  68           H        LEU  68   0.110   7.948 -28.121
  520    HA   LEU  68           HA       LEU  68   1.417   7.269 -30.749
  521    HB2  LEU  68           HB2      LEU  68   0.034   9.679 -29.795
  522    HB3  LEU  68           HB3      LEU  68   1.675  10.041 -30.285
  523    HG   LEU  68           HG       LEU  68   0.031  10.390 -32.069
  524   HD11  LEU  68          HD11      LEU  68   1.243   9.287 -33.883
  525   HD12  LEU  68          HD12      LEU  68   2.387   9.880 -32.674
  526   HD13  LEU  68          HD13      LEU  68   1.997   8.147 -32.755
  527   HD21  LEU  68          HD21      LEU  68  -1.124   8.584 -33.161
  528   HD22  LEU  68          HD22      LEU  68  -0.308   7.363 -32.175
  529   HD23  LEU  68          HD23      LEU  68  -1.468   8.479 -31.417
  530    H    ALA  69           H        ALA  69   1.967   8.387 -27.413
  531    HA   ALA  69           HA       ALA  69   4.748   7.603 -27.564
  532    HB1  ALA  69           HB1      ALA  69   3.984  10.551 -27.174
  533    HB2  ALA  69           HB2      ALA  69   5.586   9.862 -26.816
  534    HB3  ALA  69           HB3      ALA  69   4.992   9.876 -28.472
  535    H    SER  70           H        SER  70   5.700   7.852 -25.323
  536    HA   SER  70           HA       SER  70   3.827   8.437 -23.139
  537    HB2  SER  70           HB2      SER  70   5.542   5.944 -23.033
  538    HB3  SER  70           HB3      SER  70   4.235   6.445 -21.937
  539    HG   SER  70           HG       SER  70   3.688   4.728 -23.460
  540    H    THR  71           H        THR  71   5.161   8.996 -21.112
  541    HA   THR  71           HA       THR  71   7.462  10.498 -21.863
  542    HB   THR  71           HB       THR  71   7.849  10.557 -19.313
  543    HG1  THR  71           HG1      THR  71   6.733   8.815 -18.593
  544   HG21  THR  71          HG21      THR  71   5.910  12.038 -18.962
  545   HG22  THR  71          HG22      THR  71   6.662  12.333 -20.546
  546   HG23  THR  71          HG23      THR  71   5.155  11.404 -20.448
  547    H    ARG  72           H        ARG  72   9.650  10.074 -21.822
  548    HA   ARG  72           HA       ARG  72  10.307   7.447 -22.594
  549    HB2  ARG  72           HB2      ARG  72  12.014   9.855 -21.846
  550    HB3  ARG  72           HB3      ARG  72  12.729   8.334 -22.395
  551    HG2  ARG  72           HG2      ARG  72  11.454   8.401 -24.484
  552    HG3  ARG  72           HG3      ARG  72  10.659   9.902 -24.003
  553    HD2  ARG  72           HD2      ARG  72  13.675   9.606 -24.285
  554    HD3  ARG  72           HD3      ARG  72  12.614  10.130 -25.609
  555    HE   ARG  72           HE       ARG  72  11.876  11.889 -23.707
  556   HH11  ARG  72          HH22      ARG  72  15.167  11.017 -24.824
  557   HH12  ARG  72          HH21      ARG  72  15.808  12.588 -24.487
  558   HH21  ARG  72          HH11      ARG  72  12.648  13.823 -23.342
  559   HH22  ARG  72          HH12      ARG  72  14.334  14.279 -23.572
  560    H    ASN  73           H        ASN  73  10.217   8.755 -19.394
  561    HA   ASN  73           HA       ASN  73  10.619   6.144 -18.320
  562    HB2  ASN  73           HB2      ASN  73  12.309   6.525 -16.743
  563    HB3  ASN  73           HB3      ASN  73  12.992   7.127 -18.243
  564   HD21  ASN  73          HD22      ASN  73  12.651   9.673 -18.564
  565   HD22  ASN  73          HD21      ASN  73  12.865  10.622 -17.113
  566    H    TRP  74           H        TRP  74  10.087   6.453 -15.769
  567    HA   TRP  74           HA       TRP  74   7.508   7.688 -15.637
  568    HB2  TRP  74           HB2      TRP  74   9.408   6.814 -13.405
  569    HB3  TRP  74           HB3      TRP  74   7.701   7.214 -13.226
  570    HD1  TRP  74           HD1      TRP  74  10.012   4.473 -14.588
  571    HE1  TRP  74           HE1      TRP  74   8.675   2.369 -15.099
  572    HE3  TRP  74           HE3      TRP  74   5.328   6.204 -13.488
  573    HZ2  TRP  74           HZ2      TRP  74   5.912   1.597 -15.284
  574    HZ3  TRP  74           HZ3      TRP  74   3.343   4.767 -13.913
  575    HH2  TRP  74           HH2      TRP  74   3.588   2.527 -14.883
  576    H    LEU  75           H        LEU  75   7.010   9.879 -15.241
  577    HA   LEU  75           HA       LEU  75   9.177  11.747 -14.681
  578    HB2  LEU  75           HB2      LEU  75   6.593  11.992 -15.752
  579    HB3  LEU  75           HB3      LEU  75   6.394  12.634 -14.139
  580    HG   LEU  75           HG       LEU  75   6.830  14.412 -15.667
  581   HD11  LEU  75          HD11      LEU  75   9.426  14.077 -14.114
  582   HD12  LEU  75          HD12      LEU  75   8.637  15.572 -14.615
  583   HD13  LEU  75          HD13      LEU  75   7.884  14.567 -13.376
  584   HD21  LEU  75          HD21      LEU  75   9.456  13.059 -16.441
  585   HD22  LEU  75          HD22      LEU  75   7.995  13.137 -17.438
  586   HD23  LEU  75          HD23      LEU  75   8.858  14.623 -17.016
  587    H    ARG  76           H        ARG  76   9.831  12.377 -12.612
  588    HA   ARG  76           HA       ARG  76   8.358  11.155 -10.289
  589    HB2  ARG  76           HB2      ARG  76  11.278  11.244 -10.964
  590    HB3  ARG  76           HB3      ARG  76  10.886  11.777  -9.341
  591    HG2  ARG  76           HG2      ARG  76  11.397   9.456  -9.247
  592    HG3  ARG  76           HG3      ARG  76   9.698   9.678  -8.870
  593    HD2  ARG  76           HD2      ARG  76   9.929   7.716 -10.278
  594    HD3  ARG  76           HD3      ARG  76   9.085   8.969 -11.178
  595    HE   ARG  76           HE       ARG  76  10.778   9.055 -12.703
  596   HH11  ARG  76          HH22      ARG  76  12.103   7.340  -9.860
  597   HH12  ARG  76          HH21      ARG  76  13.547   6.861 -10.672
  598   HH21  ARG  76          HH12      ARG  76  12.660   8.385 -13.772
  599   HH22  ARG  76          HH11      ARG  76  13.874   7.479 -12.935
  600    H    TYR  77           H        TYR  77   7.602  12.582  -8.785
  601    HA   TYR  77           HA       TYR  77   8.800  15.272  -8.670
  602    HB2  TYR  77           HB2      TYR  77   6.810  15.342 -10.263
  603    HB3  TYR  77           HB3      TYR  77   5.779  14.875  -8.908
  604    HD1  TYR  77           HD2      TYR  77   8.326  17.405 -10.004
  605    HD2  TYR  77           HD1      TYR  77   5.006  16.545  -7.386
  606    HE1  TYR  77           HE2      TYR  77   8.431  19.710  -9.139
  607    HE2  TYR  77           HE1      TYR  77   5.145  18.813  -6.460
  608    HH   TYR  77           HH       TYR  77   6.416  20.827  -6.380
  609    H    LYS  78           H        LYS  78   8.993  15.962  -6.607
  610    HA   LYS  78           HA       LYS  78   8.005  14.212  -4.432
  611    HB2  LYS  78           HB2      LYS  78  10.399  15.076  -4.657
  612    HB3  LYS  78           HB3      LYS  78   9.797  16.677  -4.270
  613    HG2  LYS  78           HG2      LYS  78   9.549  14.205  -2.488
  614    HG3  LYS  78           HG3      LYS  78  10.826  15.413  -2.386
  615    HD2  LYS  78           HD2      LYS  78   8.956  17.161  -1.989
  616    HD3  LYS  78           HD3      LYS  78   7.879  15.773  -1.793
  617    HE2  LYS  78           HE2      LYS  78   8.507  16.414   0.395
  618    HE3  LYS  78           HE3      LYS  78   9.368  14.907   0.047
  619    HZ1  LYS  78           HZ1      LYS  78  11.381  16.241  -0.364
  620    HZ2  LYS  78           HZ2      LYS  78  10.561  17.637  -0.091
  621    HZ3  LYS  78           HZ3      LYS  78  10.789  16.566   1.116
  622    H    LEU  79           H        LEU  79   6.122  14.724  -3.474
  623    HA   LEU  79           HA       LEU  79   4.410  16.737  -4.560
  624    HB2  LEU  79           HB2      LEU  79   4.254  14.872  -2.146
  625    HB3  LEU  79           HB3      LEU  79   2.965  16.012  -2.485
  626    HG   LEU  79           HG       LEU  79   3.897  13.994  -4.559
  627   HD11  LEU  79          HD11      LEU  79   1.584  13.677  -2.607
  628   HD12  LEU  79          HD12      LEU  79   2.031  12.560  -3.910
  629   HD13  LEU  79          HD13      LEU  79   3.116  12.781  -2.531
  630   HD21  LEU  79          HD21      LEU  79   1.349  15.636  -4.251
  631   HD22  LEU  79          HD22      LEU  79   2.607  15.868  -5.490
  632   HD23  LEU  79          HD23      LEU  79   1.615  14.405  -5.491
  633    HA   PRO  80           HA       PRO  80   5.393  20.177  -1.842
  634    HB2  PRO  80           HB2      PRO  80   3.002  21.520  -1.719
  635    HB3  PRO  80           HB3      PRO  80   4.036  21.508  -3.182
  636    HG2  PRO  80           HG2      PRO  80   1.665  19.723  -2.563
  637    HG3  PRO  80           HG3      PRO  80   1.959  20.675  -4.055
  638    HD2  PRO  80           HD2      PRO  80   2.585  18.040  -3.935
  639    HD3  PRO  80           HD3      PRO  80   3.653  19.189  -4.779
  640    H    LYS  81           H        LYS  81   5.142  20.625   0.447
  641    HA   LYS  81           HA       LYS  81   4.847  18.482   2.007
  642    HB2  LYS  81           HB2      LYS  81   5.592  21.051   2.397
  643    HB3  LYS  81           HB3      LYS  81   4.077  21.112   3.290
  644    HG2  LYS  81           HG2      LYS  81   6.431  19.256   3.710
  645    HG3  LYS  81           HG3      LYS  81   5.948  20.619   4.725
  646    HD2  LYS  81           HD2      LYS  81   3.771  19.350   5.227
  647    HD3  LYS  81           HD3      LYS  81   4.467  17.971   4.369
  648    HE2  LYS  81           HE2      LYS  81   4.825  17.597   6.703
  649    HE3  LYS  81           HE3      LYS  81   6.396  17.961   5.982
  650    HZ1  LYS  81           HZ1      LYS  81   6.217  20.212   6.915
  651    HZ2  LYS  81           HZ2      LYS  81   4.731  19.884   7.531
  652    HZ3  LYS  81           HZ3      LYS  81   6.047  19.105   8.097
  653    H    ARG  82           H        ARG  82   2.245  20.853   1.572
  654    HA   ARG  82           HA       ARG  82   0.407  19.668   3.378
  655    HB2  ARG  82           HB2      ARG  82  -1.200  21.243   2.442
  656    HB3  ARG  82           HB3      ARG  82   0.357  21.997   2.690
  657    HG2  ARG  82           HG2      ARG  82   0.662  21.311   0.056
  658    HG3  ARG  82           HG3      ARG  82  -1.095  21.346   0.132
  659    HD2  ARG  82           HD2      ARG  82  -0.320  23.515  -0.570
  660    HD3  ARG  82           HD3      ARG  82  -0.947  23.674   1.083
  661    HE   ARG  82           HE       ARG  82   1.896  23.157   1.110
  662   HH11  ARG  82          HH11      ARG  82  -0.429  25.756   0.397
  663   HH12  ARG  82          HH12      ARG  82   0.668  27.034   0.778
  664   HH21  ARG  82          HH22      ARG  82   3.360  24.878   1.633
  665   HH22  ARG  82          HH21      ARG  82   2.861  26.520   1.491
  666    H    LEU  83           H        LEU  83   1.312  18.581   0.237
  667    HA   LEU  83           HA       LEU  83  -1.166  16.992  -0.045
  668    HB2  LEU  83           HB2      LEU  83  -0.457  18.677  -1.833
  669    HB3  LEU  83           HB3      LEU  83   0.909  17.604  -2.164
  670    HG   LEU  83           HG       LEU  83  -0.606  15.838  -2.921
  671   HD11  LEU  83          HD11      LEU  83  -3.073  16.317  -3.148
  672   HD12  LEU  83          HD12      LEU  83  -2.553  16.104  -1.477
  673   HD13  LEU  83          HD13      LEU  83  -2.848  17.745  -2.110
  674   HD21  LEU  83          HD21      LEU  83  -1.389  18.550  -4.075
  675   HD22  LEU  83          HD22      LEU  83   0.089  17.663  -4.487
  676   HD23  LEU  83          HD23      LEU  83  -1.489  16.978  -4.905
  677    H    VAL  84           H        VAL  84   1.989  16.624   1.214
  678    HA   VAL  84           HA       VAL  84   2.593  13.994   0.206
  679    HB   VAL  84           HB       VAL  84   3.229  15.413   2.826
  680   HG11  VAL  84          HG11      VAL  84   4.894  13.662   3.286
  681   HG12  VAL  84          HG12      VAL  84   3.273  12.969   3.264
  682   HG13  VAL  84          HG13      VAL  84   4.348  12.737   1.884
  683   HG21  VAL  84          HG21      VAL  84   4.321  16.396   0.853
  684   HG22  VAL  84          HG22      VAL  84   5.511  15.591   1.888
  685   HG23  VAL  84          HG23      VAL  84   4.959  14.811   0.388
  686    H    ARG  85           H        ARG  85   1.797  12.051   0.923
  687    HA   ARG  85           HA       ARG  85  -0.738  12.241   2.489
  688    HB2  ARG  85           HB2      ARG  85   0.179   9.675   1.212
  689    HB3  ARG  85           HB3      ARG  85  -1.427  10.151   1.722
  690    HG2  ARG  85           HG2      ARG  85   0.126  11.373  -0.575
  691    HG3  ARG  85           HG3      ARG  85  -1.156  10.173  -0.728
  692    HD2  ARG  85           HD2      ARG  85  -1.550  12.969   0.426
  693    HD3  ARG  85           HD3      ARG  85  -1.833  12.551  -1.262
  694    HE   ARG  85           HE       ARG  85  -3.401  10.764  -0.372
  695   HH11  ARG  85          HH11      ARG  85  -3.069  13.981   1.132
  696   HH12  ARG  85          HH12      ARG  85  -4.652  13.972   1.822
  697   HH21  ARG  85          HH22      ARG  85  -5.501  10.762   0.555
  698   HH22  ARG  85          HH21      ARG  85  -6.074  12.113   1.461
  699    H    TRP  86           H        TRP  86  -0.789  11.700   4.416
  700    HA   TRP  86           HA       TRP  86   1.560  10.390   5.749
  701    HB2  TRP  86           HB2      TRP  86  -0.438  12.387   6.866
  702    HB3  TRP  86           HB3      TRP  86   0.871  11.638   7.770
  703    HD1  TRP  86           HD1      TRP  86   0.188  14.431   5.321
  704    HE1  TRP  86           HE1      TRP  86   2.291  15.795   4.885
  705    HE3  TRP  86           HE3      TRP  86   3.564  11.470   7.767
  706    HZ2  TRP  86           HZ2      TRP  86   5.146  15.563   5.416
  707    HZ3  TRP  86           HZ3      TRP  86   5.979  12.055   7.773
  708    HH2  TRP  86           HH2      TRP  86   6.778  14.090   6.589
  709    H    ASP  87           H        ASP  87  -1.444   9.583   4.657
  710    HA   ASP  87           HA       ASP  87  -2.273   7.952   6.987
  711    HB2  ASP  87           HB2      ASP  87  -3.987   9.109   5.625
  712    HB3  ASP  87           HB3      ASP  87  -3.411   8.263   4.184
  713    H    THR  88           H        THR  88  -0.131   7.790   4.213
  714    HA   THR  88           HA       THR  88  -0.602   4.940   3.775
  715    HB   THR  88           HB       THR  88   0.877   5.377   1.849
  716    HG1  THR  88           HG1      THR  88   2.123   6.982   2.221
  717   HG21  THR  88          HG21      THR  88  -1.394   7.399   1.992
  718   HG22  THR  88          HG22      THR  88  -0.631   6.756   0.529
  719   HG23  THR  88          HG23      THR  88  -1.576   5.680   1.576
  720    H    LYS  89           H        LYS  89   1.187   3.458   3.783
  721    HA   LYS  89           HA       LYS  89   3.627   4.277   5.274
  722    HB2  LYS  89           HB2      LYS  89   1.965   1.782   5.785
  723    HB3  LYS  89           HB3      LYS  89   3.615   1.999   6.357
  724    HG2  LYS  89           HG2      LYS  89   1.299   3.840   7.099
  725    HG3  LYS  89           HG3      LYS  89   1.834   2.453   8.050
  726    HD2  LYS  89           HD2      LYS  89   4.078   3.497   8.316
  727    HD3  LYS  89           HD3      LYS  89   3.499   4.933   7.431
  728    HE2  LYS  89           HE2      LYS  89   1.726   5.280   9.119
  729    HE3  LYS  89           HE3      LYS  89   2.241   3.829   9.987
  730    HZ1  LYS  89           HZ1      LYS  89   3.139   5.814  11.012
  731    HZ2  LYS  89           HZ2      LYS  89   4.370   4.919  10.428
  732    HZ3  LYS  89           HZ3      LYS  89   3.891   6.273   9.636
  733    HA   PRO  90           HA       PRO  90   5.726   4.489   4.578
  734    HB2  PRO  90           HB2      PRO  90   7.032   5.510   2.374
  735    HB3  PRO  90           HB3      PRO  90   7.555   4.054   3.269
  736    HG2  PRO  90           HG2      PRO  90   5.864   4.177   0.756
  737    HG3  PRO  90           HG3      PRO  90   7.314   3.167   1.058
  738    HD2  PRO  90           HD2      PRO  90   4.829   2.149   1.370
  739    HD3  PRO  90           HD3      PRO  90   6.114   1.752   2.544
  740    H    VAL  91           H        VAL  91   5.622   6.811   4.541
  741    HA   VAL  91           HA       VAL  91   3.152   7.997   3.753
  742    HB   VAL  91           HB       VAL  91   4.196  10.099   4.478
  743   HG11  VAL  91          HG11      VAL  91   4.570   7.802   6.452
  744   HG12  VAL  91          HG12      VAL  91   4.360   9.513   6.850
  745   HG13  VAL  91          HG13      VAL  91   3.041   8.618   6.077
  746   HG21  VAL  91          HG21      VAL  91   6.686   8.475   5.171
  747   HG22  VAL  91          HG22      VAL  91   6.573   9.708   3.897
  748   HG23  VAL  91          HG23      VAL  91   6.362  10.167   5.586
  749    H    CYS  92           H        CYS  92   2.710   9.177   1.945
  750    HA   CYS  92           HA       CYS  92   4.483   8.458  -0.306
  751    HB2  CYS  92           HB2      CYS  92   2.154   7.784  -0.360
  752    HB3  CYS  92           HB3      CYS  92   1.655   9.495  -0.263
  753    HG   CYS  92           HG       CYS  92   1.367   8.867  -2.734
  754    H    ILE  93           H        ILE  93   6.062   9.842  -0.452
  755    HA   ILE  93           HA       ILE  93   5.678  12.733  -0.037
  756    HB   ILE  93           HB       ILE  93   8.114  12.841  -0.115
  757   HG12  ILE  93          HG12      ILE  93   8.128   9.803  -0.418
  758   HG13  ILE  93          HG13      ILE  93   8.501  10.942  -1.716
  759   HG21  ILE  93          HG21      ILE  93   6.881  12.375   2.020
  760   HG22  ILE  93          HG22      ILE  93   7.213  10.642   1.787
  761   HG23  ILE  93          HG23      ILE  93   8.542  11.787   2.024
  762   HD11  ILE  93          HD11      ILE  93  10.568  10.164  -0.821
  763   HD12  ILE  93          HD12      ILE  93  10.376  11.842  -0.285
  764   HD13  ILE  93          HD13      ILE  93  10.061  10.501   0.847
  765    H    GLY  94           H        GLY  94   5.429  10.604  -2.726
  766    HA2  GLY  94           HA2      GLY  94   5.820  12.908  -4.523
  767    HA3  GLY  94           HA3      GLY  94   6.949  11.583  -4.690
  768    H    GLN  95           H        GLN  95   5.178  12.532  -6.705
  769    HA   GLN  95           HA       GLN  95   3.169  10.320  -6.960
  770    HB2  GLN  95           HB2      GLN  95   2.598  12.957  -6.955
  771    HB3  GLN  95           HB3      GLN  95   3.094  12.860  -8.610
  772    HG2  GLN  95           HG2      GLN  95   0.726  12.618  -8.637
  773    HG3  GLN  95           HG3      GLN  95   1.308  11.006  -8.924
  774   HE21  GLN  95          HE22      GLN  95  -0.184  13.188  -6.438
  775   HE22  GLN  95          HE21      GLN  95  -0.628  11.900  -5.340
  776    H    LYS  96           H        LYS  96   4.530   8.737  -7.850
  777    HA   LYS  96           HA       LYS  96   6.453   9.385 -10.027
  778    HB2  LYS  96           HB2      LYS  96   7.175   7.591  -8.674
  779    HB3  LYS  96           HB3      LYS  96   5.569   6.882  -8.546
  780    HG2  LYS  96           HG2      LYS  96   5.683   6.087 -10.866
  781    HG3  LYS  96           HG3      LYS  96   7.274   6.854 -11.061
  782    HD2  LYS  96           HD2      LYS  96   8.262   5.404  -9.405
  783    HD3  LYS  96           HD3      LYS  96   6.683   4.755  -8.931
  784    HE2  LYS  96           HE2      LYS  96   6.408   3.621 -11.078
  785    HE3  LYS  96           HE3      LYS  96   7.866   4.381 -11.721
  786    HZ1  LYS  96           HZ1      LYS  96   9.219   3.123 -10.239
  787    HZ2  LYS  96           HZ2      LYS  96   7.981   2.595  -9.326
  788    HZ3  LYS  96           HZ3      LYS  96   8.168   2.046 -10.867
  789    H    GLN  97           H        GLN  97   5.702   9.561 -12.140
  790    HA   GLN  97           HA       GLN  97   2.980   8.531 -12.742
  791    HB2  GLN  97           HB2      GLN  97   2.188  10.759 -13.383
  792    HB3  GLN  97           HB3      GLN  97   2.622  10.660 -11.679
  793    HG2  GLN  97           HG2      GLN  97   4.925  11.682 -12.425
  794    HG3  GLN  97           HG3      GLN  97   4.073  12.116 -13.902
  795   HE21  GLN  97          HE22      GLN  97   4.656  12.881 -10.561
  796   HE22  GLN  97          HE21      GLN  97   3.714  14.367 -10.552
  797    H    LYS  98           H        LYS  98   3.250   7.355 -14.637
  798    HA   LYS  98           HA       LYS  98   5.133   8.469 -16.694
  799    HB2  LYS  98           HB2      LYS  98   5.367   6.078 -16.338
  800    HB3  LYS  98           HB3      LYS  98   3.632   5.810 -16.578
  801    HG2  LYS  98           HG2      LYS  98   3.835   6.548 -18.920
  802    HG3  LYS  98           HG3      LYS  98   5.536   6.937 -18.691
  803    HD2  LYS  98           HD2      LYS  98   4.381   4.140 -18.344
  804    HD3  LYS  98           HD3      LYS  98   5.049   4.757 -19.863
  805    HE2  LYS  98           HE2      LYS  98   7.238   5.192 -18.710
  806    HE3  LYS  98           HE3      LYS  98   6.587   4.468 -17.231
  807    HZ1  LYS  98           HZ1      LYS  98   7.877   2.863 -18.519
  808    HZ2  LYS  98           HZ2      LYS  98   6.318   2.366 -18.479
  809    HZ3  LYS  98           HZ3      LYS  98   6.938   3.058 -19.836
  810    H    TRP  99           H        TRP  99   4.248   9.689 -18.312
  811    HA   TRP  99           HA       TRP  99   1.275   9.888 -18.343
  812    HB2  TRP  99           HB2      TRP  99   3.411  11.864 -19.077
  813    HB3  TRP  99           HB3      TRP  99   1.769  11.996 -19.675
  814    HD1  TRP  99           HD1      TRP  99   3.700  12.110 -16.344
  815    HE1  TRP  99           HE1      TRP  99   2.388  13.600 -14.702
  816    HE3  TRP  99           HE3      TRP  99  -0.653  12.593 -18.975
  817    HZ2  TRP  99           HZ2      TRP  99  -0.081  15.131 -14.750
  818    HZ3  TRP  99           HZ3      TRP  99  -2.460  14.073 -18.176
  819    HH2  TRP  99           HH2      TRP  99  -2.164  15.366 -16.064
  820    H    PHE 100           H        PHE 100   0.215   9.610 -20.300
  821    HA   PHE 100           HA       PHE 100   1.795   8.378 -22.521
  822    HB2  PHE 100           HB2      PHE 100  -0.940   7.642 -21.419
  823    HB3  PHE 100           HB3      PHE 100  -0.259   7.032 -22.916
  824    HD1  PHE 100           HD2      PHE 100   0.448   7.157 -19.201
  825    HD2  PHE 100           HD1      PHE 100   1.002   5.063 -22.941
  826    HE1  PHE 100           HE2      PHE 100   1.452   5.241 -17.996
  827    HE2  PHE 100           HE1      PHE 100   1.952   3.136 -21.715
  828    HZ   PHE 100           HZ       PHE 100   2.155   3.204 -19.242
  829    H    LEU 101           H        LEU 101   1.524   9.403 -24.435
  830    HA   LEU 101           HA       LEU 101  -0.486  11.528 -24.748
  831    HB2  LEU 101           HB2      LEU 101   1.653  12.013 -25.713
  832    HB3  LEU 101           HB3      LEU 101   1.724  10.440 -26.510
  833    HG   LEU 101           HG       LEU 101  -0.164  11.067 -27.983
  834   HD11  LEU 101          HD11      LEU 101  -0.995  13.343 -28.073
  835   HD12  LEU 101          HD12      LEU 101  -1.361  12.661 -26.503
  836   HD13  LEU 101          HD13      LEU 101  -0.003  13.799 -26.665
  837   HD21  LEU 101          HD21      LEU 101   2.065  13.132 -27.965
  838   HD22  LEU 101          HD22      LEU 101   2.202  11.507 -28.622
  839   HD23  LEU 101          HD23      LEU 101   1.071  12.655 -29.357
  840    H    LEU 102           H        LEU 102  -2.489  10.805 -25.084
  841    HA   LEU 102           HA       LEU 102  -2.923   8.469 -26.866
  842    HB2  LEU 102           HB2      LEU 102  -4.502   9.685 -24.575
  843    HB3  LEU 102           HB3      LEU 102  -5.358   8.875 -25.865
  844    HG   LEU 102           HG       LEU 102  -5.052   7.322 -24.092
  845   HD11  LEU 102          HD11      LEU 102  -4.290   5.508 -25.379
  846   HD12  LEU 102          HD12      LEU 102  -4.553   6.735 -26.667
  847   HD13  LEU 102          HD13      LEU 102  -2.952   6.438 -26.064
  848   HD21  LEU 102          HD21      LEU 102  -2.892   6.583 -23.262
  849   HD22  LEU 102          HD22      LEU 102  -2.033   7.692 -24.334
  850   HD23  LEU 102          HD23      LEU 102  -3.033   8.325 -23.014
  851    H    GLN 103           H        GLN 103  -3.618   8.870 -28.844
  852    HA   GLN 103           HA       GLN 103  -4.682  11.605 -29.420
  853    HB2  GLN 103           HB2      GLN 103  -3.959   9.302 -31.265
  854    HB3  GLN 103           HB3      GLN 103  -4.803  10.757 -31.795
  855    HG2  GLN 103           HG2      GLN 103  -2.042  10.698 -30.506
  856    HG3  GLN 103           HG3      GLN 103  -2.366  10.866 -32.236
  857   HE21  GLN 103          HE22      GLN 103  -0.749  12.760 -31.079
  858   HE22  GLN 103          HE21      GLN 103  -1.646  14.262 -30.952
  859    H    LEU 104           H        LEU 104  -6.811  11.918 -29.676
  860    HA   LEU 104           HA       LEU 104  -8.674   9.969 -28.680
  861    HB2  LEU 104           HB2      LEU 104  -8.901  12.573 -28.886
  862    HB3  LEU 104           HB3      LEU 104  -9.363  12.257 -30.561
  863    HG   LEU 104           HG       LEU 104 -11.055  10.525 -29.275
  864   HD11  LEU 104          HD11      LEU 104 -10.126  11.266 -27.032
  865   HD12  LEU 104          HD12      LEU 104 -10.835  12.872 -27.329
  866   HD13  LEU 104          HD13      LEU 104 -11.865  11.447 -27.185
  867   HD21  LEU 104          HD21      LEU 104 -11.444  13.483 -29.860
  868   HD22  LEU 104          HD22      LEU 104 -11.853  12.099 -30.880
  869   HD23  LEU 104          HD23      LEU 104 -12.781  12.399 -29.400
  870    H    VAL 105           H        VAL 105  -9.960   8.426 -29.802
  871    HA   VAL 105           HA       VAL 105  -9.756   8.403 -32.784
  872    HB   VAL 105           HB       VAL 105  -9.863   6.021 -30.893
  873   HG11  VAL 105          HG11      VAL 105  -9.904   6.065 -33.926
  874   HG12  VAL 105          HG12      VAL 105  -9.714   4.623 -32.901
  875   HG13  VAL 105          HG13      VAL 105 -11.219   5.537 -32.842
  876   HG21  VAL 105          HG21      VAL 105  -7.692   6.839 -32.867
  877   HG22  VAL 105          HG22      VAL 105  -7.573   7.039 -31.107
  878   HG23  VAL 105          HG23      VAL 105  -7.691   5.419 -31.804
  879    H    SER 106           H        SER 106 -11.640   7.722 -29.800
  880    HA   SER 106           HA       SER 106 -14.066   8.689 -31.196
  881    HB2  SER 106           HB2      SER 106 -13.966   6.298 -29.321
  882    HB3  SER 106           HB3      SER 106 -15.394   6.947 -30.147
  883    HG   SER 106           HG       SER 106 -14.553   5.102 -31.244
  884    H    GLY 107           H        GLY 107 -15.288  10.050 -29.819
  885    HA2  GLY 107           HA2      GLY 107 -15.017  10.127 -26.995
  886    HA3  GLY 107           HA3      GLY 107 -13.877  11.269 -27.701
  887    H    ASP 108           H        ASP 108 -15.192  12.696 -26.421
  888    HA   ASP 108           HA       ASP 108 -16.561  14.262 -25.872
  889    HB2  ASP 108           HB2      ASP 108 -16.044  15.303 -27.984
  890    HB3  ASP 108           HB3      ASP 108 -17.361  14.417 -28.776
  891    H    ALA 109           H        ALA 109 -18.305  12.235 -28.167
  892    HA   ALA 109           HA       ALA 109 -20.725  12.213 -26.472
  893    HB1  ALA 109           HB1      ALA 109 -21.689  10.831 -28.276
  894    HB2  ALA 109           HB2      ALA 109 -20.995  12.329 -28.919
  895    HB3  ALA 109           HB3      ALA 109 -20.120  10.787 -29.105
  896    H    GLU 110           H        GLU 110 -18.020  10.066 -27.414
  897    HA   GLU 110           HA       GLU 110 -19.072   7.850 -25.853
  898    HB2  GLU 110           HB2      GLU 110 -16.405   8.166 -27.288
  899    HB3  GLU 110           HB3      GLU 110 -16.998   6.686 -26.547
  900    HG2  GLU 110           HG2      GLU 110 -18.185   8.117 -28.956
  901    HG3  GLU 110           HG3      GLU 110 -17.346   6.578 -28.936
  902    H    ILE 111           H        ILE 111 -17.202  10.632 -25.193
  903    HA   ILE 111           HA       ILE 111 -15.653   9.578 -22.947
  904    HB   ILE 111           HB       ILE 111 -16.181  12.252 -24.197
  905   HG12  ILE 111          HG12      ILE 111 -13.760  10.695 -23.334
  906   HG13  ILE 111          HG13      ILE 111 -14.294  11.072 -24.966
  907   HG21  ILE 111          HG21      ILE 111 -15.094  12.063 -21.370
  908   HG22  ILE 111          HG22      ILE 111 -15.253  13.528 -22.375
  909   HG23  ILE 111          HG23      ILE 111 -16.691  12.715 -21.823
  910   HD11  ILE 111          HD11      ILE 111 -12.405  12.452 -24.533
  911   HD12  ILE 111          HD12      ILE 111 -13.835  13.506 -24.465
  912   HD13  ILE 111          HD13      ILE 111 -13.034  12.976 -22.964
  913    H    ASN 112           H        ASN 112 -16.279   9.531 -20.868
  914    HA   ASN 112           HA       ASN 112 -18.749  10.774 -19.951
  915    HB2  ASN 112           HB2      ASN 112 -19.749   8.710 -20.777
  916    HB3  ASN 112           HB3      ASN 112 -18.492   7.748 -19.985
  917   HD21  ASN 112          HD22      ASN 112 -20.356   6.618 -18.854
  918   HD22  ASN 112          HD21      ASN 112 -21.016   7.394 -17.431
  919    H    MET 113           H        MET 113 -17.106  11.852 -18.761
  920    HA   MET 113           HA       MET 113 -15.240  10.438 -17.109
  921    HB2  MET 113           HB2      MET 113 -16.066  13.352 -16.843
  922    HB3  MET 113           HB3      MET 113 -14.575  12.582 -16.278
  923    HG2  MET 113           HG2      MET 113 -14.049  12.021 -18.682
  924    HG3  MET 113           HG3      MET 113 -15.425  13.022 -19.162
  925    HE1  MET 113           HE1      MET 113 -12.577  13.293 -20.317
  926    HE2  MET 113           HE2      MET 113 -13.863  14.423 -20.794
  927    HE3  MET 113           HE3      MET 113 -12.283  15.048 -20.291
  928    H    GLN 114           H        GLN 114 -18.135   9.693 -16.622
  929    HA   GLN 114           HA       GLN 114 -18.045   9.887 -13.707
  930    HB2  GLN 114           HB2      GLN 114 -20.594  10.348 -15.334
  931    HB3  GLN 114           HB3      GLN 114 -20.469  10.297 -13.573
  932    HG2  GLN 114           HG2      GLN 114 -18.897  12.273 -13.695
  933    HG3  GLN 114           HG3      GLN 114 -19.256  12.404 -15.424
  934   HE21  GLN 114          HE22      GLN 114 -20.816  12.390 -12.180
  935   HE22  GLN 114          HE21      GLN 114 -22.167  13.405 -12.636
  936    H    THR 115           H        THR 115 -17.356   7.917 -15.809
  937    HA   THR 115           HA       THR 115 -18.994   5.623 -15.855
  938    HB   THR 115           HB       THR 115 -16.452   4.672 -15.841
  939    HG1  THR 115           HG1      THR 115 -14.997   6.306 -16.439
  940   HG21  THR 115          HG21      THR 115 -16.324   5.132 -18.256
  941   HG22  THR 115          HG22      THR 115 -17.968   4.668 -17.801
  942   HG23  THR 115          HG23      THR 115 -17.589   6.377 -18.099
  943    H    SER 116           H        SER 116 -16.319   6.531 -13.662
  944    HA   SER 116           HA       SER 116 -16.776   4.332 -11.890
  945    HB2  SER 116           HB2      SER 116 -15.009   6.773 -11.576
  946    HB3  SER 116           HB3      SER 116 -14.733   5.167 -10.869
  947    HG   SER 116           HG       SER 116 -14.439   4.375 -13.000
  948    H    SER 117           H        SER 117 -18.647   6.999 -12.083
  949    HA   SER 117           HA       SER 117 -19.945   8.210 -10.917
  950    HB2  SER 117           HB2      SER 117 -19.603   6.505  -8.471
  951    HB3  SER 117           HB3      SER 117 -20.832   7.740  -8.862
  952    HG   SER 117           HG       SER 117 -21.549   5.539  -9.293
  953    H    THR 118           H        THR 118 -19.655  10.007 -10.416
  954    HA   THR 118           HA       THR 118 -18.343  11.973 -10.258
  955    HB   THR 118           HB       THR 118 -18.400  12.606  -7.750
  956    HG1  THR 118           HG1      THR 118 -18.455  10.529  -6.831
  957   HG21  THR 118          HG21      THR 118 -20.833  12.829  -7.803
  958   HG22  THR 118          HG22      THR 118 -20.141  13.230  -9.377
  959   HG23  THR 118          HG23      THR 118 -20.950  11.661  -9.137
  960    HA   PRO 119           HA       PRO 119 -14.361   9.766  -9.199
  961    HB2  PRO 119           HB2      PRO 119 -12.970   9.886 -11.586
  962    HB3  PRO 119           HB3      PRO 119 -14.061   8.565 -11.101
  963    HG2  PRO 119           HG2      PRO 119 -14.656  10.952 -12.863
  964    HG3  PRO 119           HG3      PRO 119 -15.133   9.250 -13.120
  965    HD2  PRO 119           HD2      PRO 119 -16.863  11.090 -12.089
  966    HD3  PRO 119           HD3      PRO 119 -16.850   9.379 -11.555
  967    H    GLU 120           H        GLU 120 -14.351  12.484 -11.484
  968    HA   GLU 120           HA       GLU 120 -12.634  14.091  -9.729
  969    HB2  GLU 120           HB2      GLU 120 -11.207  12.286 -11.038
  970    HB3  GLU 120           HB3      GLU 120 -11.522  13.293 -12.447
  971    HG2  GLU 120           HG2      GLU 120  -9.535  14.193 -11.696
  972    HG3  GLU 120           HG3      GLU 120 -10.706  15.239 -10.890
  973    H    PHE 121           H        PHE 121 -13.969  13.709 -13.094
  974    HA   PHE 121           HA       PHE 121 -13.961  16.676 -13.271
  975    HB2  PHE 121           HB2      PHE 121 -13.766  14.599 -15.441
  976    HB3  PHE 121           HB3      PHE 121 -13.812  16.336 -15.691
  977    HD1  PHE 121           HD2      PHE 121 -12.012  17.660 -14.070
  978    HD2  PHE 121           HD1      PHE 121 -11.618  13.649 -15.598
  979    HE1  PHE 121           HE2      PHE 121  -9.560  17.815 -13.842
  980    HE2  PHE 121           HE1      PHE 121  -9.155  13.800 -15.338
  981    HZ   PHE 121           HZ       PHE 121  -8.121  15.887 -14.468
  982    H    ASP 122           H        ASP 122 -15.576  17.854 -13.811
  983    HA   ASP 122           HA       ASP 122 -18.299  16.742 -13.896
  984    HB2  ASP 122           HB2      ASP 122 -17.862  18.506 -12.296
  985    HB3  ASP 122           HB3      ASP 122 -17.107  19.509 -13.531
  986    H    GLY 123           H        GLY 123 -15.988  18.487 -16.038
  987    HA2  GLY 123           HA2      GLY 123 -17.481  17.821 -18.415
  988    HA3  GLY 123           HA3      GLY 123 -17.661  19.537 -17.998
  989    H    TRP 124           H        TRP 124 -16.417  18.556 -20.359
  990    HA   TRP 124           HA       TRP 124 -13.530  19.141 -19.931
  991    HB2  TRP 124           HB2      TRP 124 -13.201  17.650 -21.898
  992    HB3  TRP 124           HB3      TRP 124 -13.778  16.870 -20.433
  993    HD1  TRP 124           HD1      TRP 124 -14.816  17.621 -24.012
  994    HE1  TRP 124           HE1      TRP 124 -17.014  16.463 -24.597
  995    HE3  TRP 124           HE3      TRP 124 -15.986  15.798 -19.374
  996    HZ2  TRP 124           HZ2      TRP 124 -19.046  14.919 -23.199
  997    HZ3  TRP 124           HZ3      TRP 124 -18.081  14.526 -19.017
  998    HH2  TRP 124           HH2      TRP 124 -19.622  14.079 -20.925
  999    H    ARG 125           H        ARG 125 -12.449  20.301 -21.456
 1000    HA   ARG 125           HA       ARG 125 -13.786  21.377 -23.846
 1001    HB2  ARG 125           HB2      ARG 125 -14.311  23.045 -22.069
 1002    HB3  ARG 125           HB3      ARG 125 -12.590  23.168 -21.677
 1003    HG2  ARG 125           HG2      ARG 125 -12.131  24.084 -23.942
 1004    HG3  ARG 125           HG3      ARG 125 -13.850  23.936 -24.348
 1005    HD2  ARG 125           HD2      ARG 125 -14.401  25.528 -22.492
 1006    HD3  ARG 125           HD3      ARG 125 -12.689  25.624 -22.085
 1007    HE   ARG 125           HE       ARG 125 -12.263  26.976 -23.884
 1008   HH11  ARG 125          HH21      ARG 125 -15.631  25.825 -24.156
 1009   HH12  ARG 125          HH22      ARG 125 -16.041  26.917 -25.429
 1010   HH21  ARG 125          HH11      ARG 125 -12.833  28.435 -25.574
 1011   HH22  ARG 125          HH12      ARG 125 -14.425  28.428 -26.241
 1012    H    TRP 126           H        TRP 126 -12.217  21.287 -25.557
 1013    HA   TRP 126           HA       TRP 126  -9.468  20.705 -24.750
 1014    HB2  TRP 126           HB2      TRP 126 -10.507  21.007 -27.559
 1015    HB3  TRP 126           HB3      TRP 126  -9.127  20.067 -26.986
 1016    HD1  TRP 126           HD1      TRP 126 -12.227  19.372 -28.415
 1017    HE1  TRP 126           HE1      TRP 126 -13.448  17.319 -27.556
 1018    HE3  TRP 126           HE3      TRP 126  -9.727  18.739 -23.990
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.227  15.470 -25.328
 1020    HZ3  TRP 126           HZ3      TRP 126 -10.420  16.951 -22.420
 1021    HH2  TRP 126           HH2      TRP 126 -12.140  15.313 -23.055
 1022    H    VAL 127           H        VAL 127  -7.698  22.008 -25.061
 1023    HA   VAL 127           HA       VAL 127  -8.133  24.850 -25.811
 1024    HB   VAL 127           HB       VAL 127  -6.964  25.479 -23.679
 1025   HG11  VAL 127          HG11      VAL 127  -9.569  24.003 -23.134
 1026   HG12  VAL 127          HG12      VAL 127  -8.880  25.359 -22.231
 1027   HG13  VAL 127          HG13      VAL 127  -9.453  25.612 -23.883
 1028   HG21  VAL 127          HG21      VAL 127  -6.917  23.878 -21.796
 1029   HG22  VAL 127          HG22      VAL 127  -7.491  22.585 -22.856
 1030   HG23  VAL 127          HG23      VAL 127  -5.898  23.313 -23.136
 1031    H    SER 128           H        SER 128  -5.989  26.049 -25.847
 1032    HA   SER 128           HA       SER 128  -4.317  24.882 -27.686
 1033    HB2  SER 128           HB2      SER 128  -3.427  27.049 -25.770
 1034    HB3  SER 128           HB3      SER 128  -2.900  26.783 -27.430
 1035    HG   SER 128           HG       SER 128  -4.477  28.488 -27.282
 1036    H    TYR 129           H        TYR 129  -2.165  24.182 -27.692
 1037    HA   TYR 129           HA       TYR 129  -1.328  22.526 -25.503
 1038    HB2  TYR 129           HB2      TYR 129  -0.801  22.595 -28.127
 1039    HB3  TYR 129           HB3      TYR 129   0.563  23.578 -27.599
 1040    HD1  TYR 129           HD2      TYR 129   2.315  22.529 -26.169
 1041    HD2  TYR 129           HD1      TYR 129  -1.007  20.264 -27.684
 1042    HE1  TYR 129           HE2      TYR 129   3.555  20.450 -25.706
 1043    HE2  TYR 129           HE1      TYR 129   0.163  18.153 -27.071
 1044    HH   TYR 129           HH       TYR 129   3.477  18.132 -25.704
 1045    H    TRP 130           H        TRP 130   0.455  23.023 -24.046
 1046    HA   TRP 130           HA       TRP 130   1.411  24.193 -22.429
 1047    HB2  TRP 130           HB2      TRP 130   1.500  26.740 -24.001
 1048    HB3  TRP 130           HB3      TRP 130   2.615  26.131 -22.800
 1049    HD1  TRP 130           HD1      TRP 130   1.974  26.269 -26.444
 1050    HE1  TRP 130           HE1      TRP 130   3.507  24.804 -27.795
 1051    HE3  TRP 130           HE3      TRP 130   4.171  23.745 -22.581
 1052    HZ2  TRP 130           HZ2      TRP 130   5.683  22.863 -27.242
 1053    HZ3  TRP 130           HZ3      TRP 130   5.960  22.075 -23.013
 1054    HH2  TRP 130           HH2      TRP 130   6.705  21.623 -25.329
 1055    H    TYR 131           H        TYR 131  -1.703  25.402 -23.549
 1056    HA   TYR 131           HA       TYR 131  -1.923  27.491 -21.632
 1057    HB2  TYR 131           HB2      TYR 131  -3.344  27.461 -23.531
 1058    HB3  TYR 131           HB3      TYR 131  -4.060  25.934 -23.104
 1059    HD1  TYR 131           HD1      TYR 131  -5.694  25.729 -21.251
 1060    HD2  TYR 131           HD2      TYR 131  -4.061  29.539 -22.453
 1061    HE1  TYR 131           HE1      TYR 131  -7.594  26.876 -20.169
 1062    HE2  TYR 131           HE2      TYR 131  -5.945  30.698 -21.351
 1063    HH   TYR 131           HH       TYR 131  -7.959  30.459 -20.166
 1064    HA   PRO 132           HA       PRO 132  -3.857  24.330 -18.570
 1065    HB2  PRO 132           HB2      PRO 132  -2.473  21.820 -19.513
 1066    HB3  PRO 132           HB3      PRO 132  -4.010  21.996 -18.639
 1067    HG2  PRO 132           HG2      PRO 132  -4.050  21.556 -21.297
 1068    HG3  PRO 132           HG3      PRO 132  -5.128  22.801 -20.596
 1069    HD2  PRO 132           HD2      PRO 132  -2.463  23.216 -21.987
 1070    HD3  PRO 132           HD3      PRO 132  -3.993  24.093 -22.190
 1071    H    VAL 133           H        VAL 133  -0.549  24.036 -19.897
 1072    HA   VAL 133           HA       VAL 133   0.731  23.508 -17.360
 1073    HB   VAL 133           HB       VAL 133   1.483  24.023 -20.180
 1074   HG11  VAL 133          HG11      VAL 133   2.810  25.875 -19.318
 1075   HG12  VAL 133          HG12      VAL 133   3.502  24.819 -18.052
 1076   HG13  VAL 133          HG13      VAL 133   3.843  24.521 -19.773
 1077   HG21  VAL 133          HG21      VAL 133   1.456  21.826 -18.950
 1078   HG22  VAL 133          HG22      VAL 133   2.972  22.217 -19.770
 1079   HG23  VAL 133          HG23      VAL 133   2.836  22.433 -18.003
 1080    H    ARG 134           H        ARG 134  -0.163  26.529 -19.125
 1081    HA   ARG 134           HA       ARG 134   1.075  28.140 -17.008
 1082    HB2  ARG 134           HB2      ARG 134  -1.011  28.766 -19.170
 1083    HB3  ARG 134           HB3      ARG 134  -0.353  29.982 -18.090
 1084    HG2  ARG 134           HG2      ARG 134   1.361  28.341 -20.026
 1085    HG3  ARG 134           HG3      ARG 134   0.658  29.912 -20.373
 1086    HD2  ARG 134           HD2      ARG 134   2.696  30.611 -19.732
 1087    HD3  ARG 134           HD3      ARG 134   1.880  30.687 -18.165
 1088    HE   ARG 134           HE       ARG 134   3.058  28.117 -18.377
 1089   HH11  ARG 134          HH11      ARG 134   4.086  31.512 -18.113
 1090   HH12  ARG 134          HH12      ARG 134   5.706  31.141 -17.643
 1091   HH21  ARG 134          HH21      ARG 134   5.291  27.622 -17.877
 1092   HH22  ARG 134          HH22      ARG 134   6.370  28.893 -17.444
 1093    H    GLN 135           H        GLN 135  -2.187  26.786 -17.643
 1094    HA   GLN 135           HA       GLN 135  -3.342  28.422 -15.551
 1095    HB2  GLN 135           HB2      GLN 135  -4.421  26.110 -17.195
 1096    HB3  GLN 135           HB3      GLN 135  -5.394  27.001 -16.022
 1097    HG2  GLN 135           HG2      GLN 135  -4.043  28.205 -18.478
 1098    HG3  GLN 135           HG3      GLN 135  -5.743  27.799 -18.314
 1099   HE21  GLN 135          HE22      GLN 135  -4.757  30.413 -19.007
 1100   HE22  GLN 135          HE21      GLN 135  -5.241  31.506 -17.728
 1101    H    VAL 136           H        VAL 136  -1.923  25.166 -15.517
 1102    HA   VAL 136           HA       VAL 136  -3.158  24.373 -13.072
 1103    HB   VAL 136           HB       VAL 136  -2.082  22.815 -14.667
 1104   HG11  VAL 136          HG11      VAL 136   0.359  22.412 -14.515
 1105   HG12  VAL 136          HG12      VAL 136  -0.042  23.978 -15.241
 1106   HG13  VAL 136          HG13      VAL 136   0.523  23.909 -13.569
 1107   HG21  VAL 136          HG21      VAL 136  -0.838  22.570 -11.916
 1108   HG22  VAL 136          HG22      VAL 136  -2.544  22.206 -12.275
 1109   HG23  VAL 136          HG23      VAL 136  -1.249  21.283 -13.069
 1110    H    VAL 137           H        VAL 137  -2.134  24.274 -10.947
 1111    HA   VAL 137           HA       VAL 137  -0.822  26.623 -10.020
 1112    HB   VAL 137           HB       VAL 137  -0.407  25.163  -7.972
 1113   HG11  VAL 137          HG11      VAL 137  -3.277  25.352  -9.019
 1114   HG12  VAL 137          HG12      VAL 137  -2.792  25.156  -7.322
 1115   HG13  VAL 137          HG13      VAL 137  -2.376  26.640  -8.193
 1116   HG21  VAL 137          HG21      VAL 137  -0.401  22.925  -9.087
 1117   HG22  VAL 137          HG22      VAL 137  -1.577  23.043  -7.767
 1118   HG23  VAL 137          HG23      VAL 137  -2.136  23.108  -9.435
 1119    H    SER 138           H        SER 138   1.318  26.951  -9.296
 1120    HA   SER 138           HA       SER 138   3.185  26.412 -11.198
 1121    HB2  SER 138           HB2      SER 138   3.762  27.171  -8.316
 1122    HB3  SER 138           HB3      SER 138   4.688  27.619  -9.762
 1123    HG   SER 138           HG       SER 138   3.233  29.294  -9.023
 1124    H    PHE 139           H        PHE 139   2.615  24.374  -8.299
 1125    HA   PHE 139           HA       PHE 139   5.203  23.122  -8.488
 1126    HB2  PHE 139           HB2      PHE 139   4.578  21.748  -6.761
 1127    HB3  PHE 139           HB3      PHE 139   3.740  23.238  -6.434
 1128    HD1  PHE 139           HD2      PHE 139   3.374  19.724  -7.630
 1129    HD2  PHE 139           HD1      PHE 139   1.309  23.235  -6.199
 1130    HE1  PHE 139           HE2      PHE 139   1.355  18.362  -7.225
 1131    HE2  PHE 139           HE1      PHE 139  -0.730  21.865  -5.840
 1132    HZ   PHE 139           HZ       PHE 139  -0.717  19.441  -6.364
 1133    H    LYS 140           H        LYS 140   1.942  22.200  -9.715
 1134    HA   LYS 140           HA       LYS 140   3.058  19.866 -11.097
 1135    HB2  LYS 140           HB2      LYS 140   0.338  21.041 -10.692
 1136    HB3  LYS 140           HB3      LYS 140   0.571  20.138 -12.189
 1137    HG2  LYS 140           HG2      LYS 140   1.563  18.886  -9.637
 1138    HG3  LYS 140           HG3      LYS 140  -0.176  18.978  -9.888
 1139    HD2  LYS 140           HD2      LYS 140   0.069  17.815 -12.069
 1140    HD3  LYS 140           HD3      LYS 140   1.815  17.660 -11.797
 1141    HE2  LYS 140           HE2      LYS 140   1.443  16.282  -9.794
 1142    HE3  LYS 140           HE3      LYS 140  -0.280  16.619  -9.832
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.012  14.464 -10.769
 1144    HZ2  LYS 140           HZ2      LYS 140  -0.367  15.424 -12.028
 1145    HZ3  LYS 140           HZ3      LYS 140   1.185  14.925 -11.820
 1146    H    ARG 141           H        ARG 141   2.305  23.230 -12.048
 1147    HA   ARG 141           HA       ARG 141   2.613  23.208 -14.799
 1148    HB2  ARG 141           HB2      ARG 141   2.435  25.203 -13.389
 1149    HB3  ARG 141           HB3      ARG 141   4.087  24.990 -12.824
 1150    HG2  ARG 141           HG2      ARG 141   5.020  25.434 -15.012
 1151    HG3  ARG 141           HG3      ARG 141   3.438  25.478 -15.757
 1152    HD2  ARG 141           HD2      ARG 141   4.560  27.397 -13.696
 1153    HD3  ARG 141           HD3      ARG 141   4.227  27.758 -15.395
 1154    HE   ARG 141           HE       ARG 141   1.762  27.060 -14.613
 1155   HH11  ARG 141          HH11      ARG 141   4.057  29.392 -13.202
 1156   HH12  ARG 141          HH12      ARG 141   2.907  30.084 -12.118
 1157   HH21  ARG 141          HH21      ARG 141   0.246  27.952 -13.111
 1158   HH22  ARG 141          HH22      ARG 141   0.658  29.363 -12.193
 1159    H    ASP 142           H        ASP 142   5.390  22.873 -12.478
 1160    HA   ASP 142           HA       ASP 142   7.244  22.759 -14.641
 1161    HB2  ASP 142           HB2      ASP 142   7.848  23.569 -12.408
 1162    HB3  ASP 142           HB3      ASP 142   7.704  21.912 -11.781
 1163    H    VAL 143           H        VAL 143   5.339  20.231 -13.137
 1164    HA   VAL 143           HA       VAL 143   6.921  18.042 -14.310
 1165    HB   VAL 143           HB       VAL 143   4.142  18.163 -13.045
 1166   HG11  VAL 143          HG11      VAL 143   5.818  15.733 -13.803
 1167   HG12  VAL 143          HG12      VAL 143   4.310  15.710 -12.860
 1168   HG13  VAL 143          HG13      VAL 143   4.275  16.209 -14.553
 1169   HG21  VAL 143          HG21      VAL 143   6.787  17.196 -11.923
 1170   HG22  VAL 143          HG22      VAL 143   5.908  18.662 -11.423
 1171   HG23  VAL 143          HG23      VAL 143   5.196  17.084 -11.122
 1172    H    TYR 144           H        TYR 144   3.862  19.790 -14.893
 1173    HA   TYR 144           HA       TYR 144   3.091  18.166 -17.037
 1174    HB2  TYR 144           HB2      TYR 144   1.756  19.596 -15.397
 1175    HB3  TYR 144           HB3      TYR 144   2.120  20.979 -16.400
 1176    HD1  TYR 144           HD1      TYR 144   1.360  17.702 -18.090
 1177    HD2  TYR 144           HD2      TYR 144  -0.327  21.314 -16.389
 1178    HE1  TYR 144           HE1      TYR 144  -0.872  17.051 -18.884
 1179    HE2  TYR 144           HE2      TYR 144  -2.542  20.671 -17.201
 1180    HH   TYR 144           HH       TYR 144  -3.800  19.072 -18.417
 1181    H    ARG 145           H        ARG 145   4.969  21.215 -16.998
 1182    HA   ARG 145           HA       ARG 145   5.024  21.504 -19.854
 1183    HB2  ARG 145           HB2      ARG 145   6.908  22.970 -19.555
 1184    HB3  ARG 145           HB3      ARG 145   5.695  23.302 -18.322
 1185    HG2  ARG 145           HG2      ARG 145   7.020  22.050 -16.668
 1186    HG3  ARG 145           HG3      ARG 145   8.256  21.683 -17.861
 1187    HD2  ARG 145           HD2      ARG 145   7.523  24.568 -17.345
 1188    HD3  ARG 145           HD3      ARG 145   8.549  23.718 -16.205
 1189    HE   ARG 145           HE       ARG 145   9.160  24.229 -19.077
 1190   HH11  ARG 145          HH21      ARG 145  10.385  23.246 -15.819
 1191   HH12  ARG 145          HH22      ARG 145  12.032  23.317 -16.329
 1192   HH21  ARG 145          HH11      ARG 145  11.352  24.328 -19.664
 1193   HH22  ARG 145          HH12      ARG 145  12.596  23.938 -18.536
 1194    H    ARG 146           H        ARG 146   6.822  19.306 -17.727
 1195    HA   ARG 146           HA       ARG 146   8.800  18.633 -19.795
 1196    HB2  ARG 146           HB2      ARG 146   8.029  17.176 -17.208
 1197    HB3  ARG 146           HB3      ARG 146   9.370  16.733 -18.258
 1198    HG2  ARG 146           HG2      ARG 146  10.550  18.789 -17.828
 1199    HG3  ARG 146           HG3      ARG 146   9.144  19.520 -17.057
 1200    HD2  ARG 146           HD2      ARG 146   9.280  17.692 -15.293
 1201    HD3  ARG 146           HD3      ARG 146  10.869  17.279 -15.944
 1202    HE   ARG 146           HE       ARG 146   9.974  19.778 -14.589
 1203   HH11  ARG 146          HH11      ARG 146  12.763  18.120 -16.098
 1204   HH12  ARG 146          HH12      ARG 146  13.935  19.099 -15.291
 1205   HH21  ARG 146          HH21      ARG 146  11.494  20.955 -13.468
 1206   HH22  ARG 146          HH22      ARG 146  13.206  20.793 -13.783
 1207    H    VAL 147           H        VAL 147   5.761  17.189 -18.526
 1208    HA   VAL 147           HA       VAL 147   5.578  15.037 -20.353
 1209    HB   VAL 147           HB       VAL 147   3.390  16.737 -19.085
 1210   HG11  VAL 147          HG11      VAL 147   2.441  15.440 -20.915
 1211   HG12  VAL 147          HG12      VAL 147   3.251  13.972 -20.333
 1212   HG13  VAL 147          HG13      VAL 147   1.950  14.731 -19.372
 1213   HG21  VAL 147          HG21      VAL 147   4.926  15.670 -17.409
 1214   HG22  VAL 147          HG22      VAL 147   3.294  15.021 -17.363
 1215   HG23  VAL 147          HG23      VAL 147   4.598  14.098 -18.154
 1216    H    MET 148           H        MET 148   4.339  18.444 -20.714
 1217    HA   MET 148           HA       MET 148   3.341  17.983 -23.326
 1218    HB2  MET 148           HB2      MET 148   4.118  20.496 -21.821
 1219    HB3  MET 148           HB3      MET 148   3.511  20.539 -23.476
 1220    HG2  MET 148           HG2      MET 148   1.509  19.186 -22.701
 1221    HG3  MET 148           HG3      MET 148   2.067  19.444 -21.042
 1222    HE1  MET 148           HE1      MET 148  -0.887  20.308 -21.773
 1223    HE2  MET 148           HE2      MET 148  -0.076  20.553 -20.206
 1224    HE3  MET 148           HE3      MET 148  -0.888  21.917 -20.998
 1225    H    LYS 149           H        LYS 149   6.601  19.133 -22.275
 1226    HA   LYS 149           HA       LYS 149   7.582  19.655 -24.894
 1227    HB2  LYS 149           HB2      LYS 149   8.527  20.483 -22.780
 1228    HB3  LYS 149           HB3      LYS 149   9.039  18.865 -22.324
 1229    HG2  LYS 149           HG2      LYS 149  10.039  20.170 -24.881
 1230    HG3  LYS 149           HG3      LYS 149  10.718  20.598 -23.311
 1231    HD2  LYS 149           HD2      LYS 149  11.265  18.184 -22.892
 1232    HD3  LYS 149           HD3      LYS 149  10.789  17.800 -24.543
 1233    HE2  LYS 149           HE2      LYS 149  12.969  19.784 -23.746
 1234    HE3  LYS 149           HE3      LYS 149  13.247  18.108 -24.218
 1235    HZ1  LYS 149           HZ1      LYS 149  12.302  18.641 -26.416
 1236    HZ2  LYS 149           HZ2      LYS 149  12.138  20.222 -25.991
 1237    HZ3  LYS 149           HZ3      LYS 149  13.617  19.549 -26.078
 1238    H    GLU 150           H        GLU 150   7.493  16.654 -22.977
 1239    HA   GLU 150           HA       GLU 150   9.062  15.018 -24.701
 1240    HB2  GLU 150           HB2      GLU 150   6.776  14.443 -22.775
 1241    HB3  GLU 150           HB3      GLU 150   7.560  13.160 -23.667
 1242    HG2  GLU 150           HG2      GLU 150   9.249  15.059 -22.017
 1243    HG3  GLU 150           HG3      GLU 150   8.333  13.780 -21.230
 1244    H    PHE 151           H        PHE 151   5.717  16.166 -24.982
 1245    HA   PHE 151           HA       PHE 151   5.199  14.264 -27.214
 1246    HB2  PHE 151           HB2      PHE 151   3.378  15.730 -25.286
 1247    HB3  PHE 151           HB3      PHE 151   2.805  14.697 -26.576
 1248    HD1  PHE 151           HD1      PHE 151   5.218  12.550 -25.998
 1249    HD2  PHE 151           HD2      PHE 151   2.139  14.467 -23.645
 1250    HE1  PHE 151           HE1      PHE 151   5.294  10.706 -24.401
 1251    HE2  PHE 151           HE2      PHE 151   2.184  12.544 -22.070
 1252    HZ   PHE 151           HZ       PHE 151   3.770  10.682 -22.429
 1253    H    ALA 152           H        ALA 152   5.739  17.645 -26.809
 1254    HA   ALA 152           HA       ALA 152   3.794  18.779 -28.376
 1255    HB1  ALA 152           HB1      ALA 152   6.742  19.570 -28.283
 1256    HB2  ALA 152           HB2      ALA 152   5.396  20.606 -28.817
 1257    HB3  ALA 152           HB3      ALA 152   5.489  20.062 -27.127
 1258    H    SER 153           H        SER 153   7.006  17.746 -29.703
 1259    HA   SER 153           HA       SER 153   6.020  17.984 -32.375
 1260    HB2  SER 153           HB2      SER 153   8.641  16.721 -31.578
 1261    HB3  SER 153           HB3      SER 153   8.207  17.548 -33.091
 1262    HG   SER 153           HG       SER 153   9.449  18.901 -31.694
 1263    H    VAL 154           H        VAL 154   4.697  15.970 -30.592
 1264    HA   VAL 154           HA       VAL 154   4.633  13.798 -32.603
 1265    HB   VAL 154           HB       VAL 154   3.911  13.407 -29.677
 1266   HG11  VAL 154          HG11      VAL 154   3.026  11.761 -31.279
 1267   HG12  VAL 154          HG12      VAL 154   4.657  11.476 -31.924
 1268   HG13  VAL 154          HG13      VAL 154   4.251  11.009 -30.259
 1269   HG21  VAL 154          HG21      VAL 154   6.294  13.973 -29.593
 1270   HG22  VAL 154          HG22      VAL 154   6.072  12.245 -29.321
 1271   HG23  VAL 154          HG23      VAL 154   6.635  12.824 -30.909
 1272    H    VAL 155           H        VAL 155   3.051  16.300 -30.795
 1273    HA   VAL 155           HA       VAL 155   0.361  15.449 -31.695
 1274    HB   VAL 155           HB       VAL 155   1.387  17.595 -29.785
 1275   HG11  VAL 155          HG11      VAL 155  -1.478  16.914 -30.592
 1276   HG12  VAL 155          HG12      VAL 155  -1.033  17.899 -29.174
 1277   HG13  VAL 155          HG13      VAL 155  -0.609  18.462 -30.793
 1278   HG21  VAL 155          HG21      VAL 155  -0.254  15.074 -29.280
 1279   HG22  VAL 155          HG22      VAL 155   1.486  15.219 -28.960
 1280   HG23  VAL 155          HG23      VAL 155   0.356  16.202 -28.052
 1281    H    MET 156           H        MET 156   2.597  18.290 -31.899
 1282    HA   MET 156           HA       MET 156   0.967  19.594 -33.855
 1283    HB2  MET 156           HB2      MET 156   3.951  19.887 -33.247
 1284    HB3  MET 156           HB3      MET 156   2.983  21.000 -34.231
 1285    HG2  MET 156           HG2      MET 156   2.572  20.407 -31.278
 1286    HG3  MET 156           HG3      MET 156   3.251  21.876 -31.976
 1287    HE1  MET 156           HE1      MET 156  -0.178  23.029 -30.440
 1288    HE2  MET 156           HE2      MET 156   0.901  21.754 -29.823
 1289    HE3  MET 156           HE3      MET 156   1.581  23.276 -30.453
 1290    H    SER 157           H        SER 157   3.130  16.864 -34.185
 1291    HA   SER 157           HA       SER 157   3.882  16.796 -36.836
 1292    HB2  SER 157           HB2      SER 157   2.419  14.609 -35.294
 1293    HB3  SER 157           HB3      SER 157   3.690  14.380 -36.520
 1294    HG   SER 157           HG       SER 157   5.203  15.128 -35.076
 1295    H    LEU 158           H        LEU 158   0.633  16.451 -35.470
 1296    HA   LEU 158           HA       LEU 158  -0.572  15.504 -37.974
 1297    HB2  LEU 158           HB2      LEU 158  -1.838  16.413 -35.373
 1298    HB3  LEU 158           HB3      LEU 158  -2.670  15.573 -36.670
 1299    HG   LEU 158           HG       LEU 158  -0.409  14.411 -34.973
 1300   HD11  LEU 158          HD11      LEU 158  -2.178  13.150 -33.838
 1301   HD12  LEU 158          HD12      LEU 158  -2.405  14.894 -33.617
 1302   HD13  LEU 158          HD13      LEU 158  -3.425  14.006 -34.775
 1303   HD21  LEU 158          HD21      LEU 158  -1.144  12.234 -35.887
 1304   HD22  LEU 158          HD22      LEU 158  -2.322  13.065 -36.934
 1305   HD23  LEU 158          HD23      LEU 158  -0.578  13.309 -37.175
 1306    H    GLN 159           H        GLN 159  -0.125  18.585 -36.296
 1307    HA   GLN 159           HA       GLN 159  -2.105  19.956 -38.028
 1308    HB2  GLN 159           HB2      GLN 159  -0.658  20.692 -35.450
 1309    HB3  GLN 159           HB3      GLN 159  -1.497  21.911 -36.403
 1310    HG2  GLN 159           HG2      GLN 159  -2.850  21.062 -34.616
 1311    HG3  GLN 159           HG3      GLN 159  -3.602  20.826 -36.189
 1312   HE21  GLN 159          HE22      GLN 159  -4.308  18.677 -36.717
 1313   HE22  GLN 159          HE21      GLN 159  -4.121  17.366 -35.588
 1314    H    GLU 160           H        GLU 160   1.374  19.713 -37.640
 1315    HA   GLU 160           HA       GLU 160   1.859  21.750 -39.743
 1316    HB2  GLU 160           HB2      GLU 160   3.740  20.427 -37.745
 1317    HB3  GLU 160           HB3      GLU 160   4.198  21.642 -38.944
 1318    HG2  GLU 160           HG2      GLU 160   2.488  23.199 -37.865
 1319    HG3  GLU 160           HG3      GLU 160   2.367  22.035 -36.548
 1320    H    ASN 161           H        ASN 161   0.733  19.101 -40.199
 1321    HA   ASN 161           HA       ASN 161   2.740  17.199 -40.915
 1322    HB2  ASN 161           HB2      ASN 161   0.280  16.762 -40.265
 1323    HB3  ASN 161           HB3      ASN 161  -0.135  17.179 -41.928
 1324   HD21  ASN 161          HD22      ASN 161   1.894  15.040 -39.908
 1325   HD22  ASN 161          HD21      ASN 161   1.966  13.700 -41.049
 1326    H    THR 162           H        THR 162   0.922  19.604 -42.830
 1327    HA   THR 162           HA       THR 162   1.988  18.748 -45.324
 1328    HB   THR 162           HB       THR 162   1.037  21.229 -45.840
 1329    HG1  THR 162           HG1      THR 162  -0.692  21.633 -44.469
 1330   HG21  THR 162          HG21      THR 162  -1.120  20.110 -46.343
 1331   HG22  THR 162          HG22      THR 162   0.252  19.118 -46.860
 1332   HG23  THR 162          HG23      THR 162  -0.623  18.707 -45.367
 1333    HA   PRO 163           HA       PRO 163   5.012  22.375 -45.022
 1334    HB2  PRO 163           HB2      PRO 163   5.467  23.666 -42.626
 1335    HB3  PRO 163           HB3      PRO 163   4.224  24.159 -43.817
 1336    HG2  PRO 163           HG2      PRO 163   3.858  22.425 -41.355
 1337    HG3  PRO 163           HG3      PRO 163   2.874  23.833 -41.872
 1338    HD2  PRO 163           HD2      PRO 163   2.073  21.307 -42.447
 1339    HD3  PRO 163           HD3      PRO 163   1.899  22.589 -43.667
 1340    H    LYS 164           H        LYS 164   4.819  20.287 -42.143
 1341    HA   LYS 164           HA       LYS 164   6.332  19.212 -40.905
 1342    HB2  LYS 164           HB2      LYS 164   7.832  18.818 -43.522
 1343    HB3  LYS 164           HB3      LYS 164   8.095  17.927 -42.014
 1344    HG2  LYS 164           HG2      LYS 164   5.760  17.073 -42.100
 1345    HG3  LYS 164           HG3      LYS 164   5.532  17.928 -43.645
 1346    HD2  LYS 164           HD2      LYS 164   7.281  16.582 -44.709
 1347    HD3  LYS 164           HD3      LYS 164   7.657  15.803 -43.171
 1348    HE2  LYS 164           HE2      LYS 164   6.339  14.292 -44.521
 1349    HE3  LYS 164           HE3      LYS 164   5.420  14.771 -43.093
 1350    HZ1  LYS 164           HZ1      LYS 164   4.120  16.265 -44.461
 1351    HZ2  LYS 164           HZ2      LYS 164   5.038  15.940 -45.798
 1352    HZ3  LYS 164           HZ3      LYS 164   4.096  14.778 -45.143
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1  -2.000   2.011  -2.714
    2    H2   MET   1           H2       MET   1  -2.123   0.579  -1.910
    3    H3   MET   1           H3       MET   1  -1.754   1.949  -1.101
    4    HA   MET   1           HA       MET   1   0.206   0.634  -1.315
    5    HB2  MET   1           HB2      MET   1   1.152  -0.066  -3.369
    6    HB3  MET   1           HB3      MET   1  -0.524  -0.574  -3.394
    7    HG2  MET   1           HG2      MET   1  -1.057   1.404  -4.870
    8    HG3  MET   1           HG3      MET   1   0.656   1.812  -4.892
    9    HE1  MET   1           HE1      MET   1   2.207  -1.154  -6.977
   10    HE2  MET   1           HE2      MET   1   2.553   0.265  -5.967
   11    HE3  MET   1           HE3      MET   1   2.006  -1.251  -5.217
   12    H    ILE   2           H        ILE   2   2.384   1.539  -1.747
   13    HA   ILE   2           HA       ILE   2   2.537   4.229  -2.917
   14    HB   ILE   2           HB       ILE   2   3.568   3.497  -0.142
   15   HG12  ILE   2          HG12      ILE   2   1.212   4.296  -0.130
   16   HG13  ILE   2          HG13      ILE   2   2.317   5.339   0.736
   17   HG21  ILE   2          HG21      ILE   2   4.462   5.908  -0.144
   18   HG22  ILE   2          HG22      ILE   2   5.352   4.715  -1.084
   19   HG23  ILE   2          HG23      ILE   2   4.281   5.863  -1.911
   20   HD11  ILE   2          HD11      ILE   2   1.271   5.921  -2.070
   21   HD12  ILE   2          HD12      ILE   2   0.669   6.630  -0.560
   22   HD13  ILE   2          HD13      ILE   2   2.317   6.976  -1.098
   23    H    ASP   3           H        ASP   3   4.495   4.446  -3.993
   24    HA   ASP   3           HA       ASP   3   5.995   2.043  -4.709
   25    HB2  ASP   3           HB2      ASP   3   5.403   3.789  -6.393
   26    HB3  ASP   3           HB3      ASP   3   6.347   4.968  -5.497
   27    H    ASP   4           H        ASP   4   8.200   1.787  -4.218
   28    HA   ASP   4           HA       ASP   4   8.851   1.866  -1.610
   29    HB2  ASP   4           HB2      ASP   4   9.979   0.503  -3.299
   30    HB3  ASP   4           HB3      ASP   4  10.793   1.936  -3.935
   31    H    ASP   5           H        ASP   5   9.707   4.550  -3.813
   32    HA   ASP   5           HA       ASP   5  11.481   5.690  -1.840
   33    HB2  ASP   5           HB2      ASP   5  11.898   5.730  -4.318
   34    HB3  ASP   5           HB3      ASP   5  10.622   6.944  -4.449
   35    H    GLY   6           H        GLY   6   8.197   5.642  -1.878
   36    HA2  GLY   6           HA2      GLY   6   6.876   6.746  -0.294
   37    HA3  GLY   6           HA3      GLY   6   7.925   8.168  -0.357
   38    H    TYR   7           H        TYR   7   6.762   6.496  -3.331
   39    HA   TYR   7           HA       TYR   7   5.410   9.081  -4.019
   40    HB2  TYR   7           HB2      TYR   7   7.169   7.242  -5.644
   41    HB3  TYR   7           HB3      TYR   7   5.977   8.285  -6.408
   42    HD1  TYR   7           HD2      TYR   7   8.852   8.447  -3.975
   43    HD2  TYR   7           HD1      TYR   7   6.500  10.518  -6.925
   44    HE1  TYR   7           HE2      TYR   7  10.289  10.427  -3.717
   45    HE2  TYR   7           HE1      TYR   7   7.896  12.523  -6.631
   46    HH   TYR   7           HH       TYR   7  10.703  12.647  -4.378
   47    H    ARG   8           H        ARG   8   3.425   9.024  -5.182
   48    HA   ARG   8           HA       ARG   8   1.919   6.462  -4.849
   49    HB2  ARG   8           HB2      ARG   8   0.701   8.319  -4.106
   50    HB3  ARG   8           HB3      ARG   8   1.107   9.298  -5.503
   51    HG2  ARG   8           HG2      ARG   8  -1.249   8.597  -5.443
   52    HG3  ARG   8           HG3      ARG   8  -0.430   8.112  -6.908
   53    HD2  ARG   8           HD2      ARG   8  -2.009   6.389  -6.062
   54    HD3  ARG   8           HD3      ARG   8  -0.386   5.792  -6.242
   55    HE   ARG   8           HE       ARG   8  -0.325   5.304  -4.007
   56   HH11  ARG   8          HH12      ARG   8  -3.045   7.586  -4.448
   57   HH12  ARG   8          HH11      ARG   8  -3.616   7.385  -2.835
   58   HH21  ARG   8          HH21      ARG   8  -1.103   5.054  -1.905
   59   HH22  ARG   8          HH22      ARG   8  -2.485   5.946  -1.353
   60    HA   PRO   9           HA       PRO   9   3.201   5.798  -9.172
   61    HB2  PRO   9           HB2      PRO   9   2.497   3.181  -9.468
   62    HB3  PRO   9           HB3      PRO   9   3.901   3.683  -8.490
   63    HG2  PRO   9           HG2      PRO   9   1.101   3.036  -7.515
   64    HG3  PRO   9           HG3      PRO   9   2.663   2.408  -6.901
   65    HD2  PRO   9           HD2      PRO   9   1.409   4.504  -5.725
   66    HD3  PRO   9           HD3      PRO   9   3.192   4.442  -5.866
   67    H    ASN  10           H        ASN  10   2.025   6.460 -10.930
   68    HA   ASN  10           HA       ASN  10  -0.749   5.602 -11.305
   69    HB2  ASN  10           HB2      ASN  10  -1.700   7.777 -11.322
   70    HB3  ASN  10           HB3      ASN  10  -0.850   7.661  -9.810
   71   HD21  ASN  10          HD22      ASN  10   0.798   9.172  -9.456
   72   HD22  ASN  10          HD21      ASN  10   0.959  10.563 -10.570
   73    H    VAL  11           H        VAL  11  -1.615   6.605 -13.366
   74    HA   VAL  11           HA       VAL  11   0.504   7.077 -15.390
   75    HB   VAL  11           HB       VAL  11  -1.163   5.846 -16.948
   76   HG11  VAL  11          HG11      VAL  11   0.384   4.234 -14.885
   77   HG12  VAL  11          HG12      VAL  11  -0.108   3.686 -16.502
   78   HG13  VAL  11          HG13      VAL  11   1.078   4.992 -16.327
   79   HG21  VAL  11          HG21      VAL  11  -3.073   5.580 -15.376
   80   HG22  VAL  11          HG22      VAL  11  -2.424   4.000 -15.838
   81   HG23  VAL  11          HG23      VAL  11  -2.056   4.635 -14.265
   82    H    GLY  12           H        GLY  12   0.209   8.899 -16.541
   83    HA2  GLY  12           HA2      GLY  12  -2.359  10.393 -16.326
   84    HA3  GLY  12           HA3      GLY  12  -0.811  11.056 -16.833
   85    H    ILE  13           H        ILE  13  -3.778  10.370 -18.105
   86    HA   ILE  13           HA       ILE  13  -2.781   9.268 -20.664
   87    HB   ILE  13           HB       ILE  13  -5.637  10.157 -20.228
   88   HG12  ILE  13          HG12      ILE  13  -5.417   8.763 -18.277
   89   HG13  ILE  13          HG13      ILE  13  -6.382   7.970 -19.507
   90   HG21  ILE  13          HG21      ILE  13  -4.852   9.501 -22.468
   91   HG22  ILE  13          HG22      ILE  13  -4.379   7.901 -21.847
   92   HG23  ILE  13          HG23      ILE  13  -6.082   8.380 -21.843
   93   HD11  ILE  13          HD11      ILE  13  -4.565   6.462 -20.076
   94   HD12  ILE  13          HD12      ILE  13  -3.440   7.334 -19.004
   95   HD13  ILE  13          HD13      ILE  13  -4.814   6.446 -18.330
   96    H    VAL  14           H        VAL  14  -1.682  10.908 -21.805
   97    HA   VAL  14           HA       VAL  14  -2.788  13.651 -21.830
   98    HB   VAL  14           HB       VAL  14  -0.453  12.551 -23.449
   99   HG11  VAL  14          HG11      VAL  14  -1.460  14.642 -24.338
  100   HG12  VAL  14          HG12      VAL  14  -1.280  15.408 -22.748
  101   HG13  VAL  14          HG13      VAL  14   0.150  14.932 -23.685
  102   HG21  VAL  14          HG21      VAL  14   1.055  13.627 -21.879
  103   HG22  VAL  14          HG22      VAL  14  -0.310  14.060 -20.828
  104   HG23  VAL  14          HG23      VAL  14   0.135  12.342 -21.105
  105    H    ILE  15           H        ILE  15  -4.913  12.923 -22.614
  106    HA   ILE  15           HA       ILE  15  -5.110  11.670 -25.227
  107    HB   ILE  15           HB       ILE  15  -7.133  13.466 -23.856
  108   HG12  ILE  15          HG12      ILE  15  -6.710  11.337 -22.611
  109   HG13  ILE  15          HG13      ILE  15  -8.349  11.532 -23.203
  110   HG21  ILE  15          HG21      ILE  15  -7.605  13.560 -26.174
  111   HG22  ILE  15          HG22      ILE  15  -7.381  11.807 -26.364
  112   HG23  ILE  15          HG23      ILE  15  -8.771  12.456 -25.441
  113   HD11  ILE  15          HD11      ILE  15  -6.230   9.889 -24.671
  114   HD12  ILE  15          HD12      ILE  15  -7.427   9.211 -23.530
  115   HD13  ILE  15          HD13      ILE  15  -7.963   9.966 -25.033
  116    H    CYS  16           H        CYS  16  -4.771  12.504 -27.088
  117    HA   CYS  16           HA       CYS  16  -4.563  15.458 -27.463
  118    HB2  CYS  16           HB2      CYS  16  -3.246  13.170 -28.999
  119    HB3  CYS  16           HB3      CYS  16  -3.134  14.905 -29.423
  120    HG   CYS  16           HG       CYS  16  -2.353  13.405 -26.569
  121    H    ASN  17           H        ASN  17  -6.141  16.271 -28.689
  122    HA   ASN  17           HA       ASN  17  -8.285  14.405 -29.395
  123    HB2  ASN  17           HB2      ASN  17  -8.171  17.453 -29.210
  124    HB3  ASN  17           HB3      ASN  17  -9.635  16.506 -29.463
  125   HD21  ASN  17          HD22      ASN  17 -10.472  15.193 -27.748
  126   HD22  ASN  17          HD21      ASN  17  -9.881  15.350 -26.112
  127    H    ARG  18           H        ARG  18  -5.857  14.713 -31.250
  128    HA   ARG  18           HA       ARG  18  -5.272  15.057 -33.390
  129    HB2  ARG  18           HB2      ARG  18  -8.131  14.137 -33.885
  130    HB3  ARG  18           HB3      ARG  18  -6.861  14.271 -35.115
  131    HG2  ARG  18           HG2      ARG  18  -5.421  12.727 -33.777
  132    HG3  ARG  18           HG3      ARG  18  -6.784  12.446 -32.674
  133    HD2  ARG  18           HD2      ARG  18  -6.918  12.060 -35.691
  134    HD3  ARG  18           HD3      ARG  18  -6.460  10.767 -34.584
  135    HE   ARG  18           HE       ARG  18  -8.597  10.856 -33.506
  136   HH11  ARG  18          HH11      ARG  18  -8.509  12.453 -36.694
  137   HH12  ARG  18          HH12      ARG  18 -10.214  12.326 -36.954
  138   HH21  ARG  18          HH21      ARG  18 -10.841  10.679 -33.866
  139   HH22  ARG  18          HH22      ARG  18 -11.561  11.289 -35.311
  140    H    GLN  19           H        GLN  19  -7.029  17.361 -32.025
  141    HA   GLN  19           HA       GLN  19  -7.166  19.035 -34.485
  142    HB2  GLN  19           HB2      GLN  19  -8.416  19.261 -31.728
  143    HB3  GLN  19           HB3      GLN  19  -8.565  20.518 -32.955
  144    HG2  GLN  19           HG2      GLN  19  -9.910  19.231 -34.359
  145    HG3  GLN  19           HG3      GLN  19  -9.370  17.694 -33.696
  146   HE21  GLN  19          HE22      GLN  19 -10.336  16.832 -31.821
  147   HE22  GLN  19          HE21      GLN  19 -11.738  17.578 -31.048
  148    H    GLY  20           H        GLY  20  -4.654  18.368 -32.522
  149    HA2  GLY  20           HA2      GLY  20  -2.749  19.607 -31.956
  150    HA3  GLY  20           HA3      GLY  20  -3.515  21.084 -32.529
  151    H    GLN  21           H        GLN  21  -5.247  19.080 -30.246
  152    HA   GLN  21           HA       GLN  21  -4.934  21.134 -28.125
  153    HB2  GLN  21           HB2      GLN  21  -7.663  20.070 -28.889
  154    HB3  GLN  21           HB3      GLN  21  -7.273  21.449 -27.883
  155    HG2  GLN  21           HG2      GLN  21  -7.194  21.226 -30.890
  156    HG3  GLN  21           HG3      GLN  21  -8.224  22.240 -29.918
  157   HE21  GLN  21          HE22      GLN  21  -5.860  22.630 -32.140
  158   HE22  GLN  21          HE21      GLN  21  -5.020  23.999 -31.464
  159    H    VAL  22           H        VAL  22  -5.730  20.206 -26.008
  160    HA   VAL  22           HA       VAL  22  -5.409  17.234 -25.979
  161    HB   VAL  22           HB       VAL  22  -3.792  17.412 -24.176
  162   HG11  VAL  22          HG11      VAL  22  -3.069  17.319 -26.584
  163   HG12  VAL  22          HG12      VAL  22  -2.804  19.075 -26.517
  164   HG13  VAL  22          HG13      VAL  22  -1.891  17.981 -25.459
  165   HG21  VAL  22          HG21      VAL  22  -3.944  20.429 -24.585
  166   HG22  VAL  22          HG22      VAL  22  -4.402  19.519 -23.139
  167   HG23  VAL  22          HG23      VAL  22  -2.706  19.580 -23.628
  168    H    MET  23           H        MET  23  -5.710  16.249 -23.922
  169    HA   MET  23           HA       MET  23  -8.247  16.502 -22.863
  170    HB2  MET  23           HB2      MET  23  -6.160  14.736 -22.554
  171    HB3  MET  23           HB3      MET  23  -6.115  15.483 -20.992
  172    HG2  MET  23           HG2      MET  23  -8.606  14.246 -22.228
  173    HG3  MET  23           HG3      MET  23  -7.561  13.474 -21.032
  174    HE1  MET  23           HE1      MET  23  -9.891  12.988 -19.686
  175    HE2  MET  23           HE2      MET  23 -10.976  14.286 -19.141
  176    HE3  MET  23           HE3      MET  23 -10.821  13.929 -20.878
  177    H    TRP  24           H        TRP  24  -9.172  17.926 -21.438
  178    HA   TRP  24           HA       TRP  24  -7.919  18.554 -19.000
  179    HB2  TRP  24           HB2      TRP  24  -7.106  20.378 -20.798
  180    HB3  TRP  24           HB3      TRP  24  -8.692  21.061 -20.488
  181    HD1  TRP  24           HD1      TRP  24  -8.124  23.083 -19.124
  182    HE1  TRP  24           HE1      TRP  24  -6.930  23.609 -16.936
  183    HE3  TRP  24           HE3      TRP  24  -5.895  18.531 -18.303
  184    HZ2  TRP  24           HZ2      TRP  24  -5.161  22.239 -15.071
  185    HZ3  TRP  24           HZ3      TRP  24  -4.475  18.186 -16.319
  186    HH2  TRP  24           HH2      TRP  24  -4.128  20.015 -14.681
  187    H    ALA  25           H        ALA  25  -9.624  18.649 -17.536
  188    HA   ALA  25           HA       ALA  25 -12.355  19.070 -18.609
  189    HB1  ALA  25           HB1      ALA  25 -12.038  16.640 -18.684
  190    HB2  ALA  25           HB2      ALA  25 -11.457  16.650 -16.987
  191    HB3  ALA  25           HB3      ALA  25 -13.138  17.067 -17.356
  192    H    ARG  26           H        ARG  26 -13.779  19.951 -17.150
  193    HA   ARG  26           HA       ARG  26 -12.557  21.311 -14.879
  194    HB2  ARG  26           HB2      ARG  26 -14.269  22.289 -16.520
  195    HB3  ARG  26           HB3      ARG  26 -15.498  21.345 -15.658
  196    HG2  ARG  26           HG2      ARG  26 -14.891  22.497 -13.541
  197    HG3  ARG  26           HG3      ARG  26 -13.581  23.361 -14.385
  198    HD2  ARG  26           HD2      ARG  26 -16.531  23.620 -15.110
  199    HD3  ARG  26           HD3      ARG  26 -15.692  24.727 -14.031
  200    HE   ARG  26           HE       ARG  26 -15.543  24.597 -16.921
  201   HH11  ARG  26          HH22      ARG  26 -13.848  25.800 -14.001
  202   HH12  ARG  26          HH21      ARG  26 -12.966  27.009 -14.868
  203   HH21  ARG  26          HH11      ARG  26 -14.280  26.139 -18.049
  204   HH22  ARG  26          HH12      ARG  26 -13.243  27.226 -17.205
  205    H    ARG  27           H        ARG  27 -13.142  20.923 -12.666
  206    HA   ARG  27           HA       ARG  27 -13.753  18.077 -12.221
  207    HB2  ARG  27           HB2      ARG  27 -11.651  19.389 -11.462
  208    HB3  ARG  27           HB3      ARG  27 -12.661  20.134 -10.250
  209    HG2  ARG  27           HG2      ARG  27 -12.062  17.158 -10.566
  210    HG3  ARG  27           HG3      ARG  27 -11.339  18.266  -9.389
  211    HD2  ARG  27           HD2      ARG  27 -13.633  18.628  -8.421
  212    HD3  ARG  27           HD3      ARG  27 -14.216  17.295  -9.446
  213    HE   ARG  27           HE       ARG  27 -11.993  16.298  -8.097
  214   HH11  ARG  27          HH11      ARG  27 -15.154  17.668  -7.111
  215   HH12  ARG  27          HH12      ARG  27 -15.198  16.788  -5.621
  216   HH21  ARG  27          HH21      ARG  27 -12.199  14.974  -6.288
  217   HH22  ARG  27          HH22      ARG  27 -13.453  15.246  -5.106
  218    H    PHE  28           H        PHE  28 -15.731  17.458 -11.304
  219    HA   PHE  28           HA       PHE  28 -17.757  19.434 -10.946
  220    HB2  PHE  28           HB2      PHE  28 -19.127  17.616  -9.963
  221    HB3  PHE  28           HB3      PHE  28 -18.516  17.335 -11.566
  222    HD1  PHE  28           HD1      PHE  28 -17.306  16.535  -8.016
  223    HD2  PHE  28           HD2      PHE  28 -18.079  15.139 -12.032
  224    HE1  PHE  28           HE1      PHE  28 -16.821  14.236  -7.309
  225    HE2  PHE  28           HE2      PHE  28 -17.647  12.835 -11.302
  226    HZ   PHE  28           HZ       PHE  28 -17.028  12.363  -8.908
  227    H    GLY  29           H        GLY  29 -18.737  20.292  -9.148
  228    HA2  GLY  29           HA2      GLY  29 -19.037  21.002  -6.999
  229    HA3  GLY  29           HA3      GLY  29 -17.979  19.698  -6.446
  230    H    GLN  30           H        GLN  30 -15.688  20.658  -8.135
  231    HA   GLN  30           HA       GLN  30 -14.703  22.684  -6.244
  232    HB2  GLN  30           HB2      GLN  30 -13.643  20.386  -6.885
  233    HB3  GLN  30           HB3      GLN  30 -13.123  21.209  -8.362
  234    HG2  GLN  30           HG2      GLN  30 -11.957  22.904  -6.899
  235    HG3  GLN  30           HG3      GLN  30 -12.448  21.957  -5.491
  236   HE21  GLN  30          HE22      GLN  30 -10.427  21.898  -8.457
  237   HE22  GLN  30          HE21      GLN  30  -9.426  20.545  -7.966
  238    H    HIS  31           H        HIS  31 -15.490  22.286  -9.669
  239    HA   HIS  31           HA       HIS  31 -15.754  23.606 -11.371
  240    HB2  HIS  31           HB2      HIS  31 -15.726  25.949  -9.455
  241    HB3  HIS  31           HB3      HIS  31 -16.300  25.969 -11.116
  242    HD1  HIS  31           HD1      HIS  31 -18.634  24.583 -11.610
  243    HD2  HIS  31           HD2      HIS  31 -17.364  24.885  -7.602
  244    HE1  HIS  31           HE1      HIS  31 -20.604  23.848 -10.175
  245    H    SER  32           H        SER  32 -12.795  23.784  -9.712
  246    HA   SER  32           HA       SER  32 -11.438  25.245 -11.872
  247    HB2  SER  32           HB2      SER  32  -9.416  24.505 -10.467
  248    HB3  SER  32           HB3      SER  32 -10.550  25.652  -9.752
  249    HG   SER  32           HG       SER  32 -10.137  24.134  -8.226
  250    H    TRP  33           H        TRP  33  -9.300  23.743 -12.542
  251    HA   TRP  33           HA       TRP  33 -10.556  21.545 -14.075
  252    HB2  TRP  33           HB2      TRP  33  -7.799  22.791 -14.269
  253    HB3  TRP  33           HB3      TRP  33  -8.522  21.636 -15.384
  254    HD1  TRP  33           HD1      TRP  33  -8.751  25.324 -14.342
  255    HE1  TRP  33           HE1      TRP  33  -9.901  26.660 -16.187
  256    HE3  TRP  33           HE3      TRP  33 -10.189  21.457 -17.357
  257    HZ2  TRP  33           HZ2      TRP  33 -11.107  26.139 -18.751
  258    HZ3  TRP  33           HZ3      TRP  33 -11.234  21.909 -19.570
  259    HH2  TRP  33           HH2      TRP  33 -11.630  24.258 -20.299
  260    H    GLN  34           H        GLN  34  -9.364  19.449 -14.308
  261    HA   GLN  34           HA       GLN  34  -7.360  18.922 -12.230
  262    HB2  GLN  34           HB2      GLN  34  -9.716  18.188 -11.411
  263    HB3  GLN  34           HB3      GLN  34  -9.558  16.876 -12.588
  264    HG2  GLN  34           HG2      GLN  34  -7.330  16.311 -11.413
  265    HG3  GLN  34           HG3      GLN  34  -7.753  17.519 -10.208
  266   HE21  GLN  34          HE22      GLN  34  -8.236  14.231 -11.277
  267   HE22  GLN  34          HE21      GLN  34  -9.362  13.789  -9.987
  268    H    PHE  35           H        PHE  35  -5.982  17.336 -12.687
  269    HA   PHE  35           HA       PHE  35  -5.552  16.490 -15.442
  270    HB2  PHE  35           HB2      PHE  35  -3.468  15.478 -14.217
  271    HB3  PHE  35           HB3      PHE  35  -3.590  17.227 -14.301
  272    HD1  PHE  35           HD2      PHE  35  -4.160  14.299 -12.042
  273    HD2  PHE  35           HD1      PHE  35  -3.830  18.585 -12.330
  274    HE1  PHE  35           HE2      PHE  35  -4.317  14.476  -9.572
  275    HE2  PHE  35           HE1      PHE  35  -4.077  18.771  -9.875
  276    HZ   PHE  35           HZ       PHE  35  -4.322  16.708  -8.483
  277    HA   PRO  36           HA       PRO  36  -6.963  12.285 -14.566
  278    HB2  PRO  36           HB2      PRO  36  -5.323  10.752 -16.148
  279    HB3  PRO  36           HB3      PRO  36  -6.613  11.803 -16.786
  280    HG2  PRO  36           HG2      PRO  36  -3.648  12.437 -16.593
  281    HG3  PRO  36           HG3      PRO  36  -4.757  12.693 -17.975
  282    HD2  PRO  36           HD2      PRO  36  -4.102  14.680 -16.233
  283    HD3  PRO  36           HD3      PRO  36  -5.715  14.579 -16.989
  284    H    GLN  37           H        GLN  37  -3.657  11.182 -14.949
  285    HA   GLN  37           HA       GLN  37  -2.164  10.216 -13.522
  286    HB2  GLN  37           HB2      GLN  37  -2.956  12.406 -11.612
  287    HB3  GLN  37           HB3      GLN  37  -1.705  11.202 -11.354
  288    HG2  GLN  37           HG2      GLN  37  -0.619  11.993 -13.535
  289    HG3  GLN  37           HG3      GLN  37  -1.700  13.390 -13.437
  290   HE21  GLN  37          HE22      GLN  37  -1.229  15.029 -11.814
  291   HE22  GLN  37          HE21      GLN  37   0.097  14.864 -10.684
  292    H    GLY  38           H        GLY  38  -3.876   8.497 -13.816
  293    HA2  GLY  38           HA2      GLY  38  -5.620   7.902 -11.524
  294    HA3  GLY  38           HA3      GLY  38  -5.465   6.973 -13.018
  295    H    GLY  39           H        GLY  39  -4.747   6.932  -9.762
  296    HA2  GLY  39           HA2      GLY  39  -2.276   5.849  -9.370
  297    HA3  GLY  39           HA3      GLY  39  -3.704   5.482  -8.401
  298    H    ILE  40           H        ILE  40  -1.413   3.876  -9.334
  299    HA   ILE  40           HA       ILE  40  -2.490   1.952 -11.249
  300    HB   ILE  40           HB       ILE  40   0.095   2.377  -9.780
  301   HG12  ILE  40          HG12      ILE  40  -0.577   1.907 -12.714
  302   HG13  ILE  40          HG13      ILE  40  -0.627   3.495 -11.974
  303   HG21  ILE  40          HG21      ILE  40   1.046   0.294 -10.755
  304   HG22  ILE  40          HG22      ILE  40  -0.189  -0.054  -9.554
  305   HG23  ILE  40          HG23      ILE  40  -0.571  -0.195 -11.285
  306   HD11  ILE  40          HD11      ILE  40   1.877   1.765 -12.191
  307   HD12  ILE  40          HD12      ILE  40   1.441   3.124 -13.233
  308   HD13  ILE  40          HD13      ILE  40   1.783   3.421 -11.532
  309    H    ASN  41           H        ASN  41  -3.259  -0.047 -10.884
  310    HA   ASN  41           HA       ASN  41  -4.283  -0.750  -8.224
  311    HB2  ASN  41           HB2      ASN  41  -5.697  -1.108 -10.196
  312    HB3  ASN  41           HB3      ASN  41  -4.419  -2.026 -10.987
  313   HD21  ASN  41          HD22      ASN  41  -5.326  -4.085 -11.208
  314   HD22  ASN  41          HD21      ASN  41  -5.922  -5.007  -9.840
  315    HA   PRO  42           HA       PRO  42  -0.562  -2.648  -7.110
  316    HB2  PRO  42           HB2      PRO  42  -2.239  -4.717  -5.647
  317    HB3  PRO  42           HB3      PRO  42  -0.748  -3.887  -5.097
  318    HG2  PRO  42           HG2      PRO  42  -3.156  -2.971  -4.293
  319    HG3  PRO  42           HG3      PRO  42  -1.922  -1.803  -4.862
  320    HD2  PRO  42           HD2      PRO  42  -4.282  -2.918  -6.358
  321    HD3  PRO  42           HD3      PRO  42  -3.674  -1.236  -6.300
  322    H    GLY  43           H        GLY  43   0.627  -3.542  -8.515
  323    HA2  GLY  43           HA2      GLY  43   1.792  -5.312  -9.486
  324    HA3  GLY  43           HA3      GLY  43   0.455  -6.416  -9.131
  325    H    GLU  44           H        GLU  44  -0.832  -3.618 -10.534
  326    HA   GLU  44           HA       GLU  44  -1.200  -4.918 -13.160
  327    HB2  GLU  44           HB2      GLU  44  -3.007  -3.836 -11.792
  328    HB3  GLU  44           HB3      GLU  44  -2.277  -2.264 -12.168
  329    HG2  GLU  44           HG2      GLU  44  -2.712  -2.475 -14.476
  330    HG3  GLU  44           HG3      GLU  44  -2.967  -4.216 -14.375
  331    H    SER  45           H        SER  45   0.130  -4.560 -14.811
  332    HA   SER  45           HA       SER  45   2.295  -2.707 -14.631
  333    HB2  SER  45           HB2      SER  45   2.558  -3.670 -17.086
  334    HB3  SER  45           HB3      SER  45   2.925  -4.624 -15.643
  335    HG   SER  45           HG       SER  45   1.636  -5.926 -16.838
  336    H    ALA  46           H        ALA  46   2.825  -1.176 -16.277
  337    HA   ALA  46           HA       ALA  46   1.101   0.962 -16.149
  338    HB1  ALA  46           HB1      ALA  46   3.557   1.031 -16.612
  339    HB2  ALA  46           HB2      ALA  46   3.245   0.417 -18.254
  340    HB3  ALA  46           HB3      ALA  46   2.635   2.024 -17.756
  341    H    GLU  47           H        GLU  47   1.550  -1.263 -18.958
  342    HA   GLU  47           HA       GLU  47  -0.370   0.226 -20.552
  343    HB2  GLU  47           HB2      GLU  47   1.178  -2.354 -21.051
  344    HB3  GLU  47           HB3      GLU  47   0.140  -1.570 -22.249
  345    HG2  GLU  47           HG2      GLU  47   1.516   0.454 -22.197
  346    HG3  GLU  47           HG3      GLU  47   2.568  -0.255 -20.970
  347    H    GLN  48           H        GLN  48  -1.017  -1.443 -17.977
  348    HA   GLN  48           HA       GLN  48  -3.574  -2.591 -19.015
  349    HB2  GLN  48           HB2      GLN  48  -1.830  -3.470 -16.652
  350    HB3  GLN  48           HB3      GLN  48  -3.537  -3.818 -16.753
  351    HG2  GLN  48           HG2      GLN  48  -2.061  -5.674 -17.505
  352    HG3  GLN  48           HG3      GLN  48  -3.317  -5.200 -18.642
  353   HE21  GLN  48          HE22      GLN  48   0.204  -4.349 -18.020
  354   HE22  GLN  48          HE21      GLN  48   0.627  -4.335 -19.716
  355    H    ALA  49           H        ALA  49  -1.979  -0.996 -16.170
  356    HA   ALA  49           HA       ALA  49  -4.285   0.161 -15.080
  357    HB1  ALA  49           HB1      ALA  49  -1.417   1.195 -15.005
  358    HB2  ALA  49           HB2      ALA  49  -2.724   1.638 -13.890
  359    HB3  ALA  49           HB3      ALA  49  -2.106  -0.029 -13.906
  360    H    MET  50           H        MET  50  -2.158   1.422 -17.695
  361    HA   MET  50           HA       MET  50  -3.230   4.052 -17.751
  362    HB2  MET  50           HB2      MET  50  -1.136   3.339 -18.790
  363    HB3  MET  50           HB3      MET  50  -2.010   2.353 -19.967
  364    HG2  MET  50           HG2      MET  50  -2.421   5.351 -19.645
  365    HG3  MET  50           HG3      MET  50  -1.189   4.662 -20.678
  366    HE1  MET  50           HE1      MET  50  -1.969   2.518 -22.367
  367    HE2  MET  50           HE2      MET  50  -2.804   3.299 -23.731
  368    HE3  MET  50           HE3      MET  50  -1.363   4.063 -23.013
  369    H    TYR  51           H        TYR  51  -4.324   1.051 -19.406
  370    HA   TYR  51           HA       TYR  51  -6.563   2.426 -20.556
  371    HB2  TYR  51           HB2      TYR  51  -6.119  -0.537 -20.147
  372    HB3  TYR  51           HB3      TYR  51  -7.444   0.192 -21.045
  373    HD1  TYR  51           HD1      TYR  51  -3.802  -0.352 -20.982
  374    HD2  TYR  51           HD2      TYR  51  -7.097   1.178 -23.287
  375    HE1  TYR  51           HE1      TYR  51  -2.354  -0.348 -22.968
  376    HE2  TYR  51           HE2      TYR  51  -5.700   1.148 -25.310
  377    HH   TYR  51           HH       TYR  51  -2.320  -0.078 -25.341
  378    H    ARG  52           H        ARG  52  -5.980   0.807 -17.424
  379    HA   ARG  52           HA       ARG  52  -8.720   0.657 -16.619
  380    HB2  ARG  52           HB2      ARG  52  -6.700  -0.373 -15.428
  381    HB3  ARG  52           HB3      ARG  52  -6.338   1.232 -14.796
  382    HG2  ARG  52           HG2      ARG  52  -7.553   0.318 -13.048
  383    HG3  ARG  52           HG3      ARG  52  -8.771   1.265 -13.907
  384    HD2  ARG  52           HD2      ARG  52  -9.743  -0.852 -13.353
  385    HD3  ARG  52           HD3      ARG  52  -9.472  -0.874 -15.103
  386    HE   ARG  52           HE       ARG  52  -7.168  -2.010 -13.944
  387   HH11  ARG  52          HH11      ARG  52 -10.650  -2.798 -14.214
  388   HH12  ARG  52          HH12      ARG  52 -10.419  -4.490 -13.989
  389   HH21  ARG  52          HH21      ARG  52  -6.899  -4.232 -13.502
  390   HH22  ARG  52          HH22      ARG  52  -8.234  -5.337 -13.632
  391    H    ALA  53           H        ALA  53  -6.257   3.289 -16.198
  392    HA   ALA  53           HA       ALA  53  -8.108   5.086 -14.943
  393    HB1  ALA  53           HB1      ALA  53  -5.685   5.279 -14.668
  394    HB2  ALA  53           HB2      ALA  53  -5.474   5.565 -16.404
  395    HB3  ALA  53           HB3      ALA  53  -6.324   6.767 -15.407
  396    H    LEU  54           H        LEU  54  -7.328   4.428 -18.338
  397    HA   LEU  54           HA       LEU  54  -8.565   6.686 -19.596
  398    HB2  LEU  54           HB2      LEU  54  -7.024   5.120 -20.695
  399    HB3  LEU  54           HB3      LEU  54  -8.119   3.804 -20.310
  400    HG   LEU  54           HG       LEU  54  -9.809   4.730 -21.912
  401   HD11  LEU  54          HD11      LEU  54  -7.419   6.451 -22.732
  402   HD12  LEU  54          HD12      LEU  54  -8.964   6.311 -23.606
  403   HD13  LEU  54          HD13      LEU  54  -8.924   7.069 -22.009
  404   HD21  LEU  54          HD21      LEU  54  -7.096   3.855 -22.903
  405   HD22  LEU  54          HD22      LEU  54  -8.442   2.837 -22.318
  406   HD23  LEU  54          HD23      LEU  54  -8.640   3.780 -23.799
  407    H    PHE  55           H        PHE  55  -9.704   3.480 -18.563
  408    HA   PHE  55           HA       PHE  55 -12.460   3.922 -19.270
  409    HB2  PHE  55           HB2      PHE  55 -11.972   1.683 -19.296
  410    HB3  PHE  55           HB3      PHE  55 -10.855   1.780 -17.949
  411    HD1  PHE  55           HD2      PHE  55 -14.525   1.876 -18.731
  412    HD2  PHE  55           HD1      PHE  55 -11.449   1.260 -15.784
  413    HE1  PHE  55           HE2      PHE  55 -16.254   1.163 -17.091
  414    HE2  PHE  55           HE1      PHE  55 -13.178   0.489 -14.141
  415    HZ   PHE  55           HZ       PHE  55 -15.575   0.455 -14.799
  416    H    GLU  56           H        GLU  56 -10.833   3.942 -16.006
  417    HA   GLU  56           HA       GLU  56 -13.300   4.476 -14.696
  418    HB2  GLU  56           HB2      GLU  56 -10.409   4.921 -13.821
  419    HB3  GLU  56           HB3      GLU  56 -11.802   5.232 -12.782
  420    HG2  GLU  56           HG2      GLU  56 -12.533   2.848 -13.106
  421    HG3  GLU  56           HG3      GLU  56 -11.003   2.536 -13.938
  422    H    GLU  57           H        GLU  57 -10.729   6.730 -15.828
  423    HA   GLU  57           HA       GLU  57 -12.165   8.958 -14.574
  424    HB2  GLU  57           HB2      GLU  57  -9.591   9.062 -16.175
  425    HB3  GLU  57           HB3      GLU  57 -10.229  10.253 -15.032
  426    HG2  GLU  57           HG2      GLU  57 -10.090   8.434 -13.237
  427    HG3  GLU  57           HG3      GLU  57  -9.190   7.450 -14.387
  428    H    VAL  58           H        VAL  58 -11.179   8.057 -17.927
  429    HA   VAL  58           HA       VAL  58 -12.697  10.361 -18.954
  430    HB   VAL  58           HB       VAL  58 -11.226   8.403 -20.710
  431   HG11  VAL  58          HG11      VAL  58 -12.556  10.152 -21.780
  432   HG12  VAL  58          HG12      VAL  58 -11.676  11.404 -20.892
  433   HG13  VAL  58          HG13      VAL  58 -10.832  10.391 -22.086
  434   HG21  VAL  58          HG21      VAL  58  -9.503   8.922 -19.008
  435   HG22  VAL  58          HG22      VAL  58  -9.146   9.803 -20.486
  436   HG23  VAL  58          HG23      VAL  58  -9.887  10.646 -19.112
  437    H    GLY  59           H        GLY  59 -13.092   6.849 -18.668
  438    HA2  GLY  59           HA2      GLY  59 -14.896   5.516 -19.206
  439    HA3  GLY  59           HA3      GLY  59 -15.823   6.955 -19.632
  440    H    LEU  60           H        LEU  60 -12.827   5.317 -20.736
  441    HA   LEU  60           HA       LEU  60 -13.884   4.869 -23.461
  442    HB2  LEU  60           HB2      LEU  60 -11.286   6.263 -22.670
  443    HB3  LEU  60           HB3      LEU  60 -11.492   5.465 -24.222
  444    HG   LEU  60           HG       LEU  60 -12.991   7.868 -23.144
  445   HD11  LEU  60          HD11      LEU  60 -10.690   8.265 -24.000
  446   HD12  LEU  60          HD12      LEU  60 -11.120   7.473 -25.541
  447   HD13  LEU  60          HD13      LEU  60 -11.873   8.998 -25.088
  448   HD21  LEU  60          HD21      LEU  60 -14.075   8.026 -25.432
  449   HD22  LEU  60          HD22      LEU  60 -13.514   6.385 -25.762
  450   HD23  LEU  60          HD23      LEU  60 -14.668   6.691 -24.463
  451    H    SER  61           H        SER  61 -12.766   3.052 -24.461
  452    HA   SER  61           HA       SER  61 -11.672   1.179 -22.403
  453    HB2  SER  61           HB2      SER  61 -13.352   0.674 -24.882
  454    HB3  SER  61           HB3      SER  61 -12.844  -0.539 -23.690
  455    HG   SER  61           HG       SER  61 -14.990   0.247 -23.300
  456    H    ARG  62           H        ARG  62 -10.701  -0.837 -23.744
  457    HA   ARG  62           HA       ARG  62  -8.106  -0.004 -24.614
  458    HB2  ARG  62           HB2      ARG  62  -9.415  -2.761 -24.612
  459    HB3  ARG  62           HB3      ARG  62  -7.687  -2.434 -24.772
  460    HG2  ARG  62           HG2      ARG  62  -7.591  -1.515 -22.516
  461    HG3  ARG  62           HG3      ARG  62  -9.334  -1.779 -22.293
  462    HD2  ARG  62           HD2      ARG  62  -8.953  -4.225 -22.695
  463    HD3  ARG  62           HD3      ARG  62  -7.209  -3.900 -22.780
  464    HE   ARG  62           HE       ARG  62  -8.325  -2.862 -20.334
  465   HH11  ARG  62          HH11      ARG  62  -7.412  -5.955 -21.848
  466   HH12  ARG  62          HH12      ARG  62  -7.155  -6.770 -20.351
  467   HH21  ARG  62          HH21      ARG  62  -7.979  -3.963 -18.333
  468   HH22  ARG  62          HH22      ARG  62  -7.483  -5.613 -18.318
  469    H    LYS  63           H        LYS  63  -9.692   1.194 -26.409
  470    HA   LYS  63           HA       LYS  63  -8.980   0.110 -29.011
  471    HB2  LYS  63           HB2      LYS  63 -11.257  -0.343 -29.785
  472    HB3  LYS  63           HB3      LYS  63 -10.816  -1.392 -28.433
  473    HG2  LYS  63           HG2      LYS  63 -12.182  -0.052 -26.885
  474    HG3  LYS  63           HG3      LYS  63 -12.558   1.104 -28.160
  475    HD2  LYS  63           HD2      LYS  63 -14.439  -0.351 -27.835
  476    HD3  LYS  63           HD3      LYS  63 -13.741  -0.633 -29.438
  477    HE2  LYS  63           HE2      LYS  63 -12.593  -2.676 -28.576
  478    HE3  LYS  63           HE3      LYS  63 -13.265  -2.373 -26.963
  479    HZ1  LYS  63           HZ1      LYS  63 -15.487  -2.685 -27.899
  480    HZ2  LYS  63           HZ2      LYS  63 -14.869  -2.951 -29.396
  481    HZ3  LYS  63           HZ3      LYS  63 -14.565  -4.003 -28.184
  482    H    ASP  64           H        ASP  64 -10.463   2.531 -26.948
  483    HA   ASP  64           HA       ASP  64 -11.456   4.135 -29.156
  484    HB2  ASP  64           HB2      ASP  64 -11.342   4.455 -26.151
  485    HB3  ASP  64           HB3      ASP  64 -12.045   5.666 -27.217
  486    H    VAL  65           H        VAL  65  -8.363   3.743 -28.115
  487    HA   VAL  65           HA       VAL  65  -7.528   6.420 -28.914
  488    HB   VAL  65           HB       VAL  65  -6.123   6.747 -26.946
  489   HG11  VAL  65          HG11      VAL  65  -8.401   7.769 -27.081
  490   HG12  VAL  65          HG12      VAL  65  -9.022   6.429 -26.101
  491   HG13  VAL  65          HG13      VAL  65  -7.804   7.528 -25.424
  492   HG21  VAL  65          HG21      VAL  65  -7.622   4.394 -25.706
  493   HG22  VAL  65          HG22      VAL  65  -5.915   4.384 -26.164
  494   HG23  VAL  65          HG23      VAL  65  -6.478   5.463 -24.870
  495    H    ARG  66           H        ARG  66  -5.073   6.444 -29.043
  496    HA   ARG  66           HA       ARG  66  -3.928   3.833 -29.944
  497    HB2  ARG  66           HB2      ARG  66  -4.916   4.809 -31.907
  498    HB3  ARG  66           HB3      ARG  66  -4.509   6.436 -31.407
  499    HG2  ARG  66           HG2      ARG  66  -3.157   5.942 -33.235
  500    HG3  ARG  66           HG3      ARG  66  -2.108   5.996 -31.830
  501    HD2  ARG  66           HD2      ARG  66  -3.222   3.305 -32.650
  502    HD3  ARG  66           HD3      ARG  66  -2.047   4.048 -33.745
  503    HE   ARG  66           HE       ARG  66  -0.693   4.285 -31.446
  504   HH11  ARG  66          HH11      ARG  66  -2.264   1.438 -32.909
  505   HH12  ARG  66          HH12      ARG  66  -1.082   0.328 -32.310
  506   HH21  ARG  66          HH21      ARG  66   0.856   2.859 -30.709
  507   HH22  ARG  66          HH22      ARG  66   0.741   1.155 -31.012
  508    H    ILE  67           H        ILE  67  -1.917   3.697 -28.813
  509    HA   ILE  67           HA       ILE  67  -0.816   6.074 -27.569
  510    HB   ILE  67           HB       ILE  67   0.316   3.277 -27.926
  511   HG12  ILE  67          HG12      ILE  67  -0.942   4.427 -25.400
  512   HG13  ILE  67          HG13      ILE  67  -1.924   3.581 -26.588
  513   HG21  ILE  67          HG21      ILE  67   1.160   5.566 -26.081
  514   HG22  ILE  67          HG22      ILE  67   1.806   3.915 -26.007
  515   HG23  ILE  67          HG23      ILE  67   2.095   4.888 -27.437
  516   HD11  ILE  67          HD11      ILE  67  -1.216   2.008 -24.860
  517   HD12  ILE  67          HD12      ILE  67  -0.462   1.576 -26.403
  518   HD13  ILE  67          HD13      ILE  67   0.483   2.385 -25.124
  519    H    LEU  68           H        LEU  68   0.600   7.469 -28.353
  520    HA   LEU  68           HA       LEU  68   1.932   6.857 -30.971
  521    HB2  LEU  68           HB2      LEU  68   0.346   9.130 -30.077
  522    HB3  LEU  68           HB3      LEU  68   1.974   9.667 -30.426
  523    HG   LEU  68           HG       LEU  68   0.459   9.928 -32.337
  524   HD11  LEU  68          HD11      LEU  68   2.886   9.550 -32.758
  525   HD12  LEU  68          HD12      LEU  68   2.585   7.810 -32.924
  526   HD13  LEU  68          HD13      LEU  68   1.863   8.957 -34.071
  527   HD21  LEU  68          HD21      LEU  68   0.285   6.877 -32.465
  528   HD22  LEU  68          HD22      LEU  68  -0.995   7.950 -31.858
  529   HD23  LEU  68          HD23      LEU  68  -0.474   8.058 -33.548
  530    H    ALA  69           H        ALA  69   2.437   8.035 -27.638
  531    HA   ALA  69           HA       ALA  69   5.227   7.301 -27.752
  532    HB1  ALA  69           HB1      ALA  69   4.479  10.238 -27.265
  533    HB2  ALA  69           HB2      ALA  69   6.097   9.527 -27.076
  534    HB3  ALA  69           HB3      ALA  69   5.361   9.631 -28.680
  535    H    SER  70           H        SER  70   6.164   7.671 -25.457
  536    HA   SER  70           HA       SER  70   4.223   8.152 -23.315
  537    HB2  SER  70           HB2      SER  70   5.959   5.675 -23.165
  538    HB3  SER  70           HB3      SER  70   4.564   6.113 -22.156
  539    HG   SER  70           HG       SER  70   4.126   4.441 -23.720
  540    H    THR  71           H        THR  71   5.508   8.535 -21.174
  541    HA   THR  71           HA       THR  71   7.799  10.098 -21.770
  542    HB   THR  71           HB       THR  71   8.080   9.980 -19.169
  543    HG1  THR  71           HG1      THR  71   6.833   8.279 -18.617
  544   HG21  THR  71          HG21      THR  71   7.108  11.905 -20.333
  545   HG22  THR  71          HG22      THR  71   5.549  11.053 -20.470
  546   HG23  THR  71          HG23      THR  71   6.173  11.524 -18.872
  547    H    ARG  72           H        ARG  72  10.043   9.792 -21.252
  548    HA   ARG  72           HA       ARG  72  10.952   7.373 -22.371
  549    HB2  ARG  72           HB2      ARG  72  12.564   9.425 -20.796
  550    HB3  ARG  72           HB3      ARG  72  13.223   8.191 -21.879
  551    HG2  ARG  72           HG2      ARG  72  11.963   9.224 -23.792
  552    HG3  ARG  72           HG3      ARG  72  11.379  10.480 -22.692
  553    HD2  ARG  72           HD2      ARG  72  13.902  10.906 -22.169
  554    HD3  ARG  72           HD3      ARG  72  14.218  10.009 -23.657
  555    HE   ARG  72           HE       ARG  72  12.704  12.565 -23.289
  556   HH11  ARG  72          HH21      ARG  72  14.228  10.349 -25.638
  557   HH12  ARG  72          HH22      ARG  72  14.139  11.479 -26.943
  558   HH21  ARG  72          HH11      ARG  72  12.593  14.036 -24.974
  559   HH22  ARG  72          HH12      ARG  72  13.180  13.632 -26.561
  560    H    ASN  73           H        ASN  73  10.537   8.305 -19.026
  561    HA   ASN  73           HA       ASN  73  10.617   5.608 -18.134
  562    HB2  ASN  73           HB2      ASN  73  12.302   5.639 -16.531
  563    HB3  ASN  73           HB3      ASN  73  13.092   6.407 -17.889
  564   HD21  ASN  73          HD22      ASN  73  12.865   8.998 -17.839
  565   HD22  ASN  73          HD21      ASN  73  13.094   9.707 -16.260
  566    H    TRP  74           H        TRP  74  10.178   6.016 -15.428
  567    HA   TRP  74           HA       TRP  74   7.628   7.310 -15.401
  568    HB2  TRP  74           HB2      TRP  74   9.446   6.437 -13.121
  569    HB3  TRP  74           HB3      TRP  74   7.785   6.974 -12.945
  570    HD1  TRP  74           HD1      TRP  74   9.844   3.998 -14.180
  571    HE1  TRP  74           HE1      TRP  74   8.328   2.001 -14.658
  572    HE3  TRP  74           HE3      TRP  74   5.296   6.198 -13.327
  573    HZ2  TRP  74           HZ2      TRP  74   5.521   1.484 -14.924
  574    HZ3  TRP  74           HZ3      TRP  74   3.203   4.922 -13.749
  575    HH2  TRP  74           HH2      TRP  74   3.289   2.609 -14.630
  576    H    LEU  75           H        LEU  75   7.169   9.411 -15.292
  577    HA   LEU  75           HA       LEU  75   9.224  11.429 -14.719
  578    HB2  LEU  75           HB2      LEU  75   7.008  11.291 -16.411
  579    HB3  LEU  75           HB3      LEU  75   6.333  12.145 -15.053
  580    HG   LEU  75           HG       LEU  75   7.049  13.635 -16.795
  581   HD11  LEU  75          HD11      LEU  75   7.240  14.426 -14.436
  582   HD12  LEU  75          HD12      LEU  75   8.987  14.014 -14.484
  583   HD13  LEU  75          HD13      LEU  75   8.328  15.233 -15.583
  584   HD21  LEU  75          HD21      LEU  75   9.325  13.916 -17.533
  585   HD22  LEU  75          HD22      LEU  75   9.914  12.677 -16.407
  586   HD23  LEU  75          HD23      LEU  75   8.848  12.226 -17.755
  587    H    ARG  76           H        ARG  76   8.724  13.052 -12.872
  588    HA   ARG  76           HA       ARG  76   6.591  12.409 -11.079
  589    HB2  ARG  76           HB2      ARG  76   7.849  11.852  -9.057
  590    HB3  ARG  76           HB3      ARG  76   8.014  10.623 -10.283
  591    HG2  ARG  76           HG2      ARG  76  10.283  11.490 -10.873
  592    HG3  ARG  76           HG3      ARG  76  10.132  12.677  -9.553
  593    HD2  ARG  76           HD2      ARG  76   9.718  10.776  -7.971
  594    HD3  ARG  76           HD3      ARG  76  10.038   9.637  -9.291
  595    HE   ARG  76           HE       ARG  76  12.292  11.152  -9.307
  596   HH11  ARG  76          HH11      ARG  76  10.595   9.453  -6.675
  597   HH12  ARG  76          HH12      ARG  76  12.017   9.210  -5.716
  598   HH21  ARG  76          HH21      ARG  76  14.204  10.779  -8.033
  599   HH22  ARG  76          HH22      ARG  76  14.093   9.923  -6.535
  600    H    TYR  77           H        TYR  77   6.540  13.865  -9.173
  601    HA   TYR  77           HA       TYR  77   8.369  16.143  -9.202
  602    HB2  TYR  77           HB2      TYR  77   6.575  17.804  -8.964
  603    HB3  TYR  77           HB3      TYR  77   6.590  17.056 -10.541
  604    HD1  TYR  77           HD1      TYR  77   4.870  16.570  -7.193
  605    HD2  TYR  77           HD2      TYR  77   4.528  16.614 -11.500
  606    HE1  TYR  77           HE1      TYR  77   2.515  15.990  -6.995
  607    HE2  TYR  77           HE2      TYR  77   2.127  16.097 -11.314
  608    HH   TYR  77           HH       TYR  77   0.523  15.447  -8.134
  609    H    LYS  78           H        LYS  78   8.130  17.332  -7.146
  610    HA   LYS  78           HA       LYS  78   7.618  15.451  -4.883
  611    HB2  LYS  78           HB2      LYS  78   9.929  16.028  -5.033
  612    HB3  LYS  78           HB3      LYS  78   9.580  17.708  -5.405
  613    HG2  LYS  78           HG2      LYS  78  10.537  17.507  -3.239
  614    HG3  LYS  78           HG3      LYS  78   8.909  18.167  -3.126
  615    HD2  LYS  78           HD2      LYS  78   8.052  16.049  -2.296
  616    HD3  LYS  78           HD3      LYS  78   9.610  15.246  -2.548
  617    HE2  LYS  78           HE2      LYS  78   9.075  17.590  -0.649
  618    HE3  LYS  78           HE3      LYS  78   9.074  15.895  -0.158
  619    HZ1  LYS  78           HZ1      LYS  78  11.431  15.765  -0.809
  620    HZ2  LYS  78           HZ2      LYS  78  11.443  17.361  -1.205
  621    HZ3  LYS  78           HZ3      LYS  78  11.194  16.905   0.336
  622    H    LEU  79           H        LEU  79   6.002  15.998  -3.535
  623    HA   LEU  79           HA       LEU  79   4.322  18.339  -3.994
  624    HB2  LEU  79           HB2      LEU  79   4.474  16.196  -1.847
  625    HB3  LEU  79           HB3      LEU  79   3.292  17.500  -1.766
  626    HG   LEU  79           HG       LEU  79   3.462  15.490  -4.042
  627   HD11  LEU  79          HD11      LEU  79   2.922  14.359  -1.905
  628   HD12  LEU  79          HD12      LEU  79   1.602  15.516  -1.622
  629   HD13  LEU  79          HD13      LEU  79   1.532  14.378  -2.994
  630   HD21  LEU  79          HD21      LEU  79   2.323  17.563  -4.690
  631   HD22  LEU  79          HD22      LEU  79   1.163  16.245  -4.549
  632   HD23  LEU  79          HD23      LEU  79   1.271  17.461  -3.257
  633    HA   PRO  80           HA       PRO  80   6.746  20.956  -1.260
  634    HB2  PRO  80           HB2      PRO  80   4.997  22.931  -0.622
  635    HB3  PRO  80           HB3      PRO  80   5.550  22.701  -2.314
  636    HG2  PRO  80           HG2      PRO  80   3.070  21.524  -1.005
  637    HG3  PRO  80           HG3      PRO  80   3.116  22.569  -2.486
  638    HD2  PRO  80           HD2      PRO  80   3.083  19.884  -2.733
  639    HD3  PRO  80           HD3      PRO  80   4.201  20.847  -3.747
  640    H    LYS  81           H        LYS  81   6.964  21.430   1.012
  641    HA   LYS  81           HA       LYS  81   6.448  19.357   2.594
  642    HB2  LYS  81           HB2      LYS  81   7.910  21.624   2.750
  643    HB3  LYS  81           HB3      LYS  81   6.677  22.117   3.888
  644    HG2  LYS  81           HG2      LYS  81   8.355  19.597   4.057
  645    HG3  LYS  81           HG3      LYS  81   8.751  21.136   4.827
  646    HD2  LYS  81           HD2      LYS  81   6.677  21.012   6.190
  647    HD3  LYS  81           HD3      LYS  81   6.331  19.411   5.504
  648    HE2  LYS  81           HE2      LYS  81   8.498  18.560   6.386
  649    HE3  LYS  81           HE3      LYS  81   8.839  20.149   7.076
  650    HZ1  LYS  81           HZ1      LYS  81   6.901  19.880   8.515
  651    HZ2  LYS  81           HZ2      LYS  81   6.568  18.405   7.873
  652    HZ3  LYS  81           HZ3      LYS  81   7.938  18.640   8.728
  653    H    ARG  82           H        ARG  82   4.423  22.245   2.488
  654    HA   ARG  82           HA       ARG  82   2.764  21.493   4.704
  655    HB2  ARG  82           HB2      ARG  82   1.525  23.508   4.212
  656    HB3  ARG  82           HB3      ARG  82   3.249  23.812   4.095
  657    HG2  ARG  82           HG2      ARG  82   2.743  23.281   1.452
  658    HG3  ARG  82           HG3      ARG  82   1.134  23.791   1.955
  659    HD2  ARG  82           HD2      ARG  82   2.284  25.715   1.120
  660    HD3  ARG  82           HD3      ARG  82   2.154  25.899   2.882
  661    HE   ARG  82           HE       ARG  82   4.645  24.625   2.176
  662   HH11  ARG  82          HH21      ARG  82   3.071  27.816   2.053
  663   HH12  ARG  82          HH22      ARG  82   4.543  28.710   2.143
  664   HH21  ARG  82          HH11      ARG  82   6.623  25.828   2.306
  665   HH22  ARG  82          HH12      ARG  82   6.603  27.552   2.271
  666    H    LEU  83           H        LEU  83   2.627  20.673   1.304
  667    HA   LEU  83           HA       LEU  83  -0.244  19.992   1.475
  668    HB2  LEU  83           HB2      LEU  83   0.741  21.210  -0.498
  669    HB3  LEU  83           HB3      LEU  83   1.666  19.741  -0.860
  670    HG   LEU  83           HG       LEU  83  -0.406  18.495  -1.281
  671   HD11  LEU  83          HD11      LEU  83  -1.817  21.111  -0.568
  672   HD12  LEU  83          HD12      LEU  83  -2.597  19.746  -1.400
  673   HD13  LEU  83          HD13      LEU  83  -2.001  19.543   0.248
  674   HD21  LEU  83          HD21      LEU  83  -1.062  19.671  -3.328
  675   HD22  LEU  83          HD22      LEU  83  -0.372  21.193  -2.705
  676   HD23  LEU  83          HD23      LEU  83   0.687  19.817  -3.075
  677    H    VAL  84           H        VAL  84   2.930  18.491   1.604
  678    HA   VAL  84           HA       VAL  84   2.108  15.769   1.275
  679    HB   VAL  84           HB       VAL  84   4.363  17.041   2.892
  680   HG11  VAL  84          HG11      VAL  84   3.906  14.820   3.869
  681   HG12  VAL  84          HG12      VAL  84   3.934  14.083   2.251
  682   HG13  VAL  84          HG13      VAL  84   5.408  14.792   2.953
  683   HG21  VAL  84          HG21      VAL  84   5.811  16.242   1.086
  684   HG22  VAL  84          HG22      VAL  84   4.406  15.527   0.262
  685   HG23  VAL  84          HG23      VAL  84   4.557  17.289   0.422
  686    H    ARG  85           H        ARG  85   1.117  14.427   2.684
  687    HA   ARG  85           HA       ARG  85  -0.561  15.641   4.719
  688    HB2  ARG  85           HB2      ARG  85  -0.206  12.832   3.599
  689    HB3  ARG  85           HB3      ARG  85  -1.090  13.045   5.097
  690    HG2  ARG  85           HG2      ARG  85  -2.605  12.976   3.219
  691    HG3  ARG  85           HG3      ARG  85  -2.702  14.486   4.119
  692    HD2  ARG  85           HD2      ARG  85  -2.895  15.065   1.842
  693    HD3  ARG  85           HD3      ARG  85  -1.283  15.576   2.326
  694    HE   ARG  85           HE       ARG  85  -1.198  12.902   1.242
  695   HH11  ARG  85          HH12      ARG  85  -1.265  16.275   0.190
  696   HH12  ARG  85          HH11      ARG  85  -1.466  15.909  -1.497
  697   HH21  ARG  85          HH21      ARG  85  -1.315  12.385  -1.015
  698   HH22  ARG  85          HH22      ARG  85  -1.375  13.640  -2.194
  699    H    TRP  86           H        TRP  86   2.210  13.501   4.853
  700    HA   TRP  86           HA       TRP  86   3.467  12.540   6.450
  701    HB2  TRP  86           HB2      TRP  86   2.673  14.803   8.272
  702    HB3  TRP  86           HB3      TRP  86   4.103  13.785   8.387
  703    HD1  TRP  86           HD1      TRP  86   2.652  16.673   6.407
  704    HE1  TRP  86           HE1      TRP  86   4.453  17.883   5.069
  705    HE3  TRP  86           HE3      TRP  86   6.516  13.438   7.262
  706    HZ2  TRP  86           HZ2      TRP  86   7.228  17.377   4.299
  707    HZ3  TRP  86           HZ3      TRP  86   8.716  13.796   6.169
  708    HH2  TRP  86           HH2      TRP  86   9.078  15.754   4.687
  709    H    ASP  87           H        ASP  87   0.257  12.434   6.590
  710    HA   ASP  87           HA       ASP  87   0.040  10.836   9.096
  711    HB2  ASP  87           HB2      ASP  87  -1.631  12.598   8.733
  712    HB3  ASP  87           HB3      ASP  87  -2.056  11.895   7.170
  713    H    THR  88           H        THR  88   0.343  10.511   5.621
  714    HA   THR  88           HA       THR  88  -0.768   7.869   5.384
  715    HB   THR  88           HB       THR  88   0.571   8.181   3.121
  716    HG1  THR  88           HG1      THR  88   0.606  10.612   2.769
  717   HG21  THR  88          HG21      THR  88  -1.907   8.352   3.374
  718   HG22  THR  88          HG22      THR  88  -1.729  10.059   3.837
  719   HG23  THR  88          HG23      THR  88  -1.271   9.511   2.203
  720    H    LYS  89           H        LYS  89   0.462   5.981   5.171
  721    HA   LYS  89           HA       LYS  89   3.314   6.051   6.041
  722    HB2  LYS  89           HB2      LYS  89   1.124   4.293   7.199
  723    HB3  LYS  89           HB3      LYS  89   2.845   4.014   7.435
  724    HG2  LYS  89           HG2      LYS  89   1.377   6.538   8.309
  725    HG3  LYS  89           HG3      LYS  89   1.704   5.141   9.335
  726    HD2  LYS  89           HD2      LYS  89   4.145   5.480   9.031
  727    HD3  LYS  89           HD3      LYS  89   3.817   6.929   8.050
  728    HE2  LYS  89           HE2      LYS  89   2.620   7.968   9.950
  729    HE3  LYS  89           HE3      LYS  89   2.897   6.518  10.927
  730    HZ1  LYS  89           HZ1      LYS  89   4.507   8.233  11.439
  731    HZ2  LYS  89           HZ2      LYS  89   5.288   6.959  10.789
  732    HZ3  LYS  89           HZ3      LYS  89   5.026   8.315   9.894
  733    HA   PRO  90           HA       PRO  90   5.201   5.484   4.969
  734    HB2  PRO  90           HB2      PRO  90   5.489   5.486   1.973
  735    HB3  PRO  90           HB3      PRO  90   6.736   5.242   3.227
  736    HG2  PRO  90           HG2      PRO  90   5.747   3.124   1.846
  737    HG3  PRO  90           HG3      PRO  90   6.021   3.000   3.617
  738    HD2  PRO  90           HD2      PRO  90   3.421   3.557   2.155
  739    HD3  PRO  90           HD3      PRO  90   3.732   2.416   3.493
  740    H    VAL  91           H        VAL  91   5.697   7.789   4.587
  741    HA   VAL  91           HA       VAL  91   3.434   9.461   4.079
  742    HB   VAL  91           HB       VAL  91   6.415  10.114   4.288
  743   HG11  VAL  91          HG11      VAL  91   5.605  12.443   4.769
  744   HG12  VAL  91          HG12      VAL  91   5.290  11.925   3.114
  745   HG13  VAL  91          HG13      VAL  91   3.965  11.931   4.296
  746   HG21  VAL  91          HG21      VAL  91   5.548   9.158   6.388
  747   HG22  VAL  91          HG22      VAL  91   5.835  10.888   6.579
  748   HG23  VAL  91          HG23      VAL  91   4.176  10.282   6.360
  749    H    CYS  92           H        CYS  92   2.755  10.265   2.202
  750    HA   CYS  92           HA       CYS  92   4.091   9.342  -0.255
  751    HB2  CYS  92           HB2      CYS  92   1.703   8.947   0.190
  752    HB3  CYS  92           HB3      CYS  92   1.408  10.705   0.170
  753    HG   CYS  92           HG       CYS  92   0.630   9.667  -2.124
  754    H    ILE  93           H        ILE  93   5.699  10.650  -0.939
  755    HA   ILE  93           HA       ILE  93   5.521  13.567  -0.385
  756    HB   ILE  93           HB       ILE  93   7.940  13.597  -0.705
  757   HG12  ILE  93          HG12      ILE  93   7.787  10.555  -0.863
  758   HG13  ILE  93          HG13      ILE  93   8.118  11.612  -2.235
  759   HG21  ILE  93          HG21      ILE  93   7.082  11.522   1.356
  760   HG22  ILE  93          HG22      ILE  93   8.469  12.630   1.447
  761   HG23  ILE  93          HG23      ILE  93   6.833  13.278   1.524
  762   HD11  ILE  93          HD11      ILE  93  10.189  10.715  -1.407
  763   HD12  ILE  93          HD12      ILE  93  10.154  12.446  -1.004
  764   HD13  ILE  93          HD13      ILE  93   9.828  11.219   0.248
  765    H    GLY  94           H        GLY  94   4.865  11.557  -3.065
  766    HA2  GLY  94           HA2      GLY  94   4.561  13.811  -4.781
  767    HA3  GLY  94           HA3      GLY  94   6.081  13.013  -5.152
  768    H    GLN  95           H        GLN  95   4.513  12.984  -7.191
  769    HA   GLN  95           HA       GLN  95   2.879  10.465  -7.181
  770    HB2  GLN  95           HB2      GLN  95   2.649  13.129  -8.588
  771    HB3  GLN  95           HB3      GLN  95   2.134  11.679  -9.421
  772    HG2  GLN  95           HG2      GLN  95   0.214  12.683  -8.385
  773    HG3  GLN  95           HG3      GLN  95   0.534  11.123  -7.653
  774   HE21  GLN  95          HE22      GLN  95  -0.679  11.712  -5.671
  775   HE22  GLN  95          HE21      GLN  95   0.018  12.821  -4.522
  776    H    LYS  96           H        LYS  96   3.922   8.799  -8.094
  777    HA   LYS  96           HA       LYS  96   6.196   9.198  -9.988
  778    HB2  LYS  96           HB2      LYS  96   6.682   7.467  -8.462
  779    HB3  LYS  96           HB3      LYS  96   5.043   6.843  -8.432
  780    HG2  LYS  96           HG2      LYS  96   5.301   5.903 -10.688
  781    HG3  LYS  96           HG3      LYS  96   6.895   6.677 -10.857
  782    HD2  LYS  96           HD2      LYS  96   7.805   5.324  -9.060
  783    HD3  LYS  96           HD3      LYS  96   6.205   4.641  -8.708
  784    HE2  LYS  96           HE2      LYS  96   6.141   3.480 -10.862
  785    HE3  LYS  96           HE3      LYS  96   7.608   4.299 -11.408
  786    HZ1  LYS  96           HZ1      LYS  96   8.905   3.094  -9.839
  787    HZ2  LYS  96           HZ2      LYS  96   7.617   2.508  -9.030
  788    HZ3  LYS  96           HZ3      LYS  96   7.955   1.980 -10.562
  789    H    GLN  97           H        GLN  97   5.541   9.554 -12.098
  790    HA   GLN  97           HA       GLN  97   2.833   8.597 -12.903
  791    HB2  GLN  97           HB2      GLN  97   2.303  10.855 -13.704
  792    HB3  GLN  97           HB3      GLN  97   2.579  10.786 -11.966
  793    HG2  GLN  97           HG2      GLN  97   5.002  11.567 -12.515
  794    HG3  GLN  97           HG3      GLN  97   4.358  11.989 -14.087
  795   HE21  GLN  97          HE22      GLN  97   4.257  12.626 -10.594
  796   HE22  GLN  97          HE21      GLN  97   3.588  14.247 -10.748
  797    H    LYS  98           H        LYS  98   3.155   7.306 -14.672
  798    HA   LYS  98           HA       LYS  98   5.167   8.212 -16.718
  799    HB2  LYS  98           HB2      LYS  98   5.284   5.849 -16.202
  800    HB3  LYS  98           HB3      LYS  98   3.551   5.628 -16.511
  801    HG2  LYS  98           HG2      LYS  98   3.878   6.170 -18.882
  802    HG3  LYS  98           HG3      LYS  98   5.570   6.560 -18.607
  803    HD2  LYS  98           HD2      LYS  98   4.387   3.796 -18.126
  804    HD3  LYS  98           HD3      LYS  98   5.122   4.313 -19.650
  805    HE2  LYS  98           HE2      LYS  98   7.252   4.829 -18.415
  806    HE3  LYS  98           HE3      LYS  98   6.536   4.172 -16.937
  807    HZ1  LYS  98           HZ1      LYS  98   6.342   2.012 -18.085
  808    HZ2  LYS  98           HZ2      LYS  98   7.010   2.639 -19.450
  809    HZ3  LYS  98           HZ3      LYS  98   7.894   2.518 -18.085
  810    H    TRP  99           H        TRP  99   4.384   9.406 -18.431
  811    HA   TRP  99           HA       TRP  99   1.408   9.734 -18.561
  812    HB2  TRP  99           HB2      TRP  99   3.607  11.621 -19.404
  813    HB3  TRP  99           HB3      TRP  99   1.918  11.812 -19.817
  814    HD1  TRP  99           HD1      TRP  99   4.223  11.856 -16.750
  815    HE1  TRP  99           HE1      TRP  99   3.236  13.484 -15.000
  816    HE3  TRP  99           HE3      TRP  99  -0.304  12.889 -18.934
  817    HZ2  TRP  99           HZ2      TRP  99   0.868  14.999 -14.599
  818    HZ3  TRP  99           HZ3      TRP  99  -1.886  14.467 -17.864
  819    HH2  TRP  99           HH2      TRP  99  -1.291  15.553 -15.705
  820    H    PHE 100           H        PHE 100   0.413   9.037 -20.407
  821    HA   PHE 100           HA       PHE 100   2.137   7.941 -22.601
  822    HB2  PHE 100           HB2      PHE 100  -0.596   7.095 -21.599
  823    HB3  PHE 100           HB3      PHE 100   0.053   6.652 -23.166
  824    HD1  PHE 100           HD2      PHE 100   0.828   6.349 -19.493
  825    HD2  PHE 100           HD1      PHE 100   1.346   4.762 -23.474
  826    HE1  PHE 100           HE2      PHE 100   1.794   4.264 -18.548
  827    HE2  PHE 100           HE1      PHE 100   2.332   2.703 -22.528
  828    HZ   PHE 100           HZ       PHE 100   2.547   2.436 -20.071
  829    H    LEU 101           H        LEU 101   1.830   8.784 -24.590
  830    HA   LEU 101           HA       LEU 101   0.025  11.104 -24.850
  831    HB2  LEU 101           HB2      LEU 101   2.519  11.196 -25.381
  832    HB3  LEU 101           HB3      LEU 101   2.199  10.122 -26.730
  833    HG   LEU 101           HG       LEU 101   2.415  12.432 -27.410
  834   HD11  LEU 101          HD11      LEU 101   0.529  12.695 -28.829
  835   HD12  LEU 101          HD12      LEU 101   0.876  10.965 -28.700
  836   HD13  LEU 101          HD13      LEU 101  -0.501  11.669 -27.816
  837   HD21  LEU 101          HD21      LEU 101   0.898  14.187 -26.765
  838   HD22  LEU 101          HD22      LEU 101  -0.085  13.070 -25.802
  839   HD23  LEU 101          HD23      LEU 101   1.559  13.462 -25.292
  840    H    LEU 102           H        LEU 102  -1.963  10.509 -25.423
  841    HA   LEU 102           HA       LEU 102  -2.324   8.118 -27.166
  842    HB2  LEU 102           HB2      LEU 102  -3.950   9.421 -24.951
  843    HB3  LEU 102           HB3      LEU 102  -4.791   8.550 -26.214
  844    HG   LEU 102           HG       LEU 102  -4.550   7.089 -24.384
  845   HD11  LEU 102          HD11      LEU 102  -3.714   5.199 -25.498
  846   HD12  LEU 102          HD12      LEU 102  -3.969   6.327 -26.873
  847   HD13  LEU 102          HD13      LEU 102  -2.367   6.097 -26.200
  848   HD21  LEU 102          HD21      LEU 102  -2.434   6.448 -23.388
  849   HD22  LEU 102          HD22      LEU 102  -1.536   7.470 -24.534
  850   HD23  LEU 102          HD23      LEU 102  -2.576   8.213 -23.309
  851    H    GLN 103           H        GLN 103  -3.247   8.353 -29.138
  852    HA   GLN 103           HA       GLN 103  -4.345  11.055 -29.805
  853    HB2  GLN 103           HB2      GLN 103  -3.683   8.686 -31.593
  854    HB3  GLN 103           HB3      GLN 103  -4.539  10.129 -32.139
  855    HG2  GLN 103           HG2      GLN 103  -1.736  10.048 -30.962
  856    HG3  GLN 103           HG3      GLN 103  -2.130  10.252 -32.671
  857   HE21  GLN 103          HE22      GLN 103  -0.484  12.062 -31.117
  858   HE22  GLN 103          HE21      GLN 103  -1.342  13.585 -31.051
  859    H    LEU 104           H        LEU 104  -6.478  11.367 -29.956
  860    HA   LEU 104           HA       LEU 104  -8.173   9.371 -28.749
  861    HB2  LEU 104           HB2      LEU 104  -8.260  11.885 -28.471
  862    HB3  LEU 104           HB3      LEU 104  -8.892  12.010 -30.103
  863    HG   LEU 104           HG       LEU 104 -10.938  10.829 -29.455
  864   HD11  LEU 104          HD11      LEU 104 -10.216   9.224 -27.785
  865   HD12  LEU 104          HD12      LEU 104  -9.574  10.516 -26.736
  866   HD13  LEU 104          HD13      LEU 104 -11.316  10.343 -26.989
  867   HD21  LEU 104          HD21      LEU 104 -10.774  13.267 -29.098
  868   HD22  LEU 104          HD22      LEU 104 -11.754  12.553 -27.788
  869   HD23  LEU 104          HD23      LEU 104 -10.069  12.977 -27.479
  870    H    VAL 105           H        VAL 105  -9.386   7.790 -29.789
  871    HA   VAL 105           HA       VAL 105  -9.585   7.959 -32.763
  872    HB   VAL 105           HB       VAL 105  -9.622   5.492 -30.987
  873   HG11  VAL 105          HG11      VAL 105  -9.553   5.767 -34.012
  874   HG12  VAL 105          HG12      VAL 105  -9.393   4.254 -33.092
  875   HG13  VAL 105          HG13      VAL 105 -10.911   5.159 -33.031
  876   HG21  VAL 105          HG21      VAL 105  -7.316   6.517 -31.069
  877   HG22  VAL 105          HG22      VAL 105  -7.413   4.979 -31.928
  878   HG23  VAL 105          HG23      VAL 105  -7.413   6.508 -32.833
  879    H    SER 106           H        SER 106 -11.360   7.313 -29.682
  880    HA   SER 106           HA       SER 106 -13.910   7.850 -31.171
  881    HB2  SER 106           HB2      SER 106 -13.618   6.457 -28.510
  882    HB3  SER 106           HB3      SER 106 -15.042   6.557 -29.549
  883    HG   SER 106           HG       SER 106 -13.718   4.579 -29.533
  884    H    GLY 107           H        GLY 107 -14.413   9.916 -30.962
  885    HA2  GLY 107           HA2      GLY 107 -13.167  11.687 -29.153
  886    HA3  GLY 107           HA3      GLY 107 -14.463  12.071 -30.269
  887    H    ASP 108           H        ASP 108 -14.850  13.596 -28.404
  888    HA   ASP 108           HA       ASP 108 -15.898  13.204 -25.955
  889    HB2  ASP 108           HB2      ASP 108 -15.643  15.371 -27.003
  890    HB3  ASP 108           HB3      ASP 108 -16.922  14.999 -28.163
  891    H    ALA 109           H        ALA 109 -17.598  12.444 -29.016
  892    HA   ALA 109           HA       ALA 109 -20.186  12.134 -27.905
  893    HB1  ALA 109           HB1      ALA 109 -19.763  12.393 -30.323
  894    HB2  ALA 109           HB2      ALA 109 -18.951  10.806 -30.364
  895    HB3  ALA 109           HB3      ALA 109 -20.682  10.913 -29.996
  896    H    GLU 110           H        GLU 110 -17.401   9.961 -27.846
  897    HA   GLU 110           HA       GLU 110 -19.060   7.709 -26.911
  898    HB2  GLU 110           HB2      GLU 110 -16.271   7.760 -28.089
  899    HB3  GLU 110           HB3      GLU 110 -17.084   6.317 -27.489
  900    HG2  GLU 110           HG2      GLU 110 -17.904   8.019 -29.877
  901    HG3  GLU 110           HG3      GLU 110 -17.249   6.392 -29.914
  902    H    ILE 111           H        ILE 111 -16.518   9.955 -26.030
  903    HA   ILE 111           HA       ILE 111 -15.534   8.769 -23.630
  904    HB   ILE 111           HB       ILE 111 -15.920  11.533 -24.726
  905   HG12  ILE 111          HG12      ILE 111 -13.465   9.999 -23.921
  906   HG13  ILE 111          HG13      ILE 111 -14.069  10.218 -25.568
  907   HG21  ILE 111          HG21      ILE 111 -16.353  11.853 -22.316
  908   HG22  ILE 111          HG22      ILE 111 -14.802  11.058 -21.944
  909   HG23  ILE 111          HG23      ILE 111 -14.864  12.610 -22.810
  910   HD11  ILE 111          HD11      ILE 111 -13.664  12.672 -25.346
  911   HD12  ILE 111          HD12      ILE 111 -12.867  12.354 -23.778
  912   HD13  ILE 111          HD13      ILE 111 -12.200  11.676 -25.258
  913    H    ASN 112           H        ASN 112 -16.637   8.182 -21.858
  914    HA   ASN 112           HA       ASN 112 -19.486   8.976 -21.688
  915    HB2  ASN 112           HB2      ASN 112 -18.794   6.589 -21.594
  916    HB3  ASN 112           HB3      ASN 112 -17.981   6.902 -20.063
  917   HD21  ASN 112          HD22      ASN 112 -19.639   5.038 -19.543
  918   HD22  ASN 112          HD21      ASN 112 -21.186   5.574 -18.942
  919    H    MET 113           H        MET 113 -16.536   9.164 -19.624
  920    HA   MET 113           HA       MET 113 -16.216   9.896 -17.523
  921    HB2  MET 113           HB2      MET 113 -17.787  12.325 -18.459
  922    HB3  MET 113           HB3      MET 113 -16.669  12.234 -17.092
  923    HG2  MET 113           HG2      MET 113 -14.912  11.461 -18.808
  924    HG3  MET 113           HG3      MET 113 -16.049  12.062 -20.032
  925    HE1  MET 113           HE1      MET 113 -15.048  14.243 -21.121
  926    HE2  MET 113           HE2      MET 113 -13.833  15.214 -20.281
  927    HE3  MET 113           HE3      MET 113 -13.537  13.477 -20.552
  928    H    GLN 114           H        GLN 114 -18.295   8.044 -17.553
  929    HA   GLN 114           HA       GLN 114 -19.129   8.574 -14.888
  930    HB2  GLN 114           HB2      GLN 114 -20.995   9.212 -17.024
  931    HB3  GLN 114           HB3      GLN 114 -21.688   7.892 -16.116
  932    HG2  GLN 114           HG2      GLN 114 -21.961   9.133 -14.189
  933    HG3  GLN 114           HG3      GLN 114 -20.508  10.095 -14.450
  934   HE21  GLN 114          HE22      GLN 114 -20.515  11.723 -16.152
  935   HE22  GLN 114          HE21      GLN 114 -21.999  12.629 -16.460
  936    H    THR 115           H        THR 115 -17.516   6.660 -16.351
  937    HA   THR 115           HA       THR 115 -18.784   4.080 -16.223
  938    HB   THR 115           HB       THR 115 -16.089   3.631 -16.241
  939    HG1  THR 115           HG1      THR 115 -15.002   5.371 -16.965
  940   HG21  THR 115          HG21      THR 115 -17.570   4.793 -18.648
  941   HG22  THR 115          HG22      THR 115 -16.166   3.703 -18.677
  942   HG23  THR 115          HG23      THR 115 -17.722   3.102 -18.102
  943    H    SER 116           H        SER 116 -16.539   5.976 -14.166
  944    HA   SER 116           HA       SER 116 -16.420   4.060 -11.995
  945    HB2  SER 116           HB2      SER 116 -15.311   6.206 -10.959
  946    HB3  SER 116           HB3      SER 116 -14.511   5.428 -12.344
  947    HG   SER 116           HG       SER 116 -14.775   7.208 -13.381
  948    H    SER 117           H        SER 117 -18.628   6.479 -12.910
  949    HA   SER 117           HA       SER 117 -20.407   7.542 -12.037
  950    HB2  SER 117           HB2      SER 117 -20.067   5.964  -9.476
  951    HB3  SER 117           HB3      SER 117 -21.501   6.845 -10.016
  952    HG   SER 117           HG       SER 117 -21.654   4.568 -10.446
  953    H    THR 118           H        THR 118 -17.555   7.339  -9.919
  954    HA   THR 118           HA       THR 118 -17.768  10.287  -9.545
  955    HB   THR 118           HB       THR 118 -16.302   9.855  -7.504
  956    HG1  THR 118           HG1      THR 118 -15.668   7.739  -7.768
  957   HG21  THR 118          HG21      THR 118 -18.721  10.401  -7.370
  958   HG22  THR 118          HG22      THR 118 -19.119   8.674  -7.472
  959   HG23  THR 118          HG23      THR 118 -18.206   9.297  -6.084
  960    HA   PRO 119           HA       PRO 119 -14.001   9.400 -12.190
  961    HB2  PRO 119           HB2      PRO 119 -14.598  10.939 -14.391
  962    HB3  PRO 119           HB3      PRO 119 -15.184   9.269 -14.190
  963    HG2  PRO 119           HG2      PRO 119 -16.635  11.845 -13.508
  964    HG3  PRO 119           HG3      PRO 119 -17.228  10.444 -14.455
  965    HD2  PRO 119           HD2      PRO 119 -17.867  10.680 -11.859
  966    HD3  PRO 119           HD3      PRO 119 -17.442   9.093 -12.558
  967    H    GLU 120           H        GLU 120 -15.352  12.068 -10.643
  968    HA   GLU 120           HA       GLU 120 -14.763  14.127  -9.989
  969    HB2  GLU 120           HB2      GLU 120 -11.951  13.454 -10.922
  970    HB3  GLU 120           HB3      GLU 120 -12.418  14.911 -10.077
  971    HG2  GLU 120           HG2      GLU 120 -13.339  13.589  -8.195
  972    HG3  GLU 120           HG3      GLU 120 -12.809  12.095  -8.976
  973    H    PHE 121           H        PHE 121 -13.800  13.393 -13.335
  974    HA   PHE 121           HA       PHE 121 -13.917  16.129 -14.198
  975    HB2  PHE 121           HB2      PHE 121 -14.353  13.573 -15.770
  976    HB3  PHE 121           HB3      PHE 121 -14.023  15.161 -16.439
  977    HD1  PHE 121           HD2      PHE 121 -11.719  15.754 -14.213
  978    HD2  PHE 121           HD1      PHE 121 -12.558  12.589 -17.030
  979    HE1  PHE 121           HE2      PHE 121  -9.306  15.235 -14.362
  980    HE2  PHE 121           HE1      PHE 121 -10.133  12.071 -17.156
  981    HZ   PHE 121           HZ       PHE 121  -8.506  13.419 -15.843
  982    H    ASP 122           H        ASP 122 -15.636  17.385 -14.561
  983    HA   ASP 122           HA       ASP 122 -18.387  16.364 -14.422
  984    HB2  ASP 122           HB2      ASP 122 -17.696  18.498 -13.351
  985    HB3  ASP 122           HB3      ASP 122 -17.290  19.151 -14.934
  986    H    GLY 123           H        GLY 123 -16.006  16.863 -16.835
  987    HA2  GLY 123           HA2      GLY 123 -16.141  16.397 -19.133
  988    HA3  GLY 123           HA3      GLY 123 -17.902  16.541 -19.092
  989    H    TRP 124           H        TRP 124 -15.614  17.921 -20.675
  990    HA   TRP 124           HA       TRP 124 -16.745  20.591 -20.566
  991    HB2  TRP 124           HB2      TRP 124 -14.960  20.500 -18.729
  992    HB3  TRP 124           HB3      TRP 124 -13.765  20.441 -20.014
  993    HD1  TRP 124           HD1      TRP 124 -13.171  22.754 -21.087
  994    HE1  TRP 124           HE1      TRP 124 -14.019  25.161 -20.908
  995    HE3  TRP 124           HE3      TRP 124 -17.212  21.952 -18.042
  996    HZ2  TRP 124           HZ2      TRP 124 -16.188  26.571 -19.605
  997    HZ3  TRP 124           HZ3      TRP 124 -18.617  23.855 -17.308
  998    HH2  TRP 124           HH2      TRP 124 -18.119  26.166 -18.086
  999    H    ARG 125           H        ARG 125 -13.730  20.997 -21.890
 1000    HA   ARG 125           HA       ARG 125 -14.321  19.983 -24.553
 1001    HB2  ARG 125           HB2      ARG 125 -14.487  22.026 -25.681
 1002    HB3  ARG 125           HB3      ARG 125 -15.568  22.236 -24.298
 1003    HG2  ARG 125           HG2      ARG 125 -13.738  23.524 -23.144
 1004    HG3  ARG 125           HG3      ARG 125 -12.737  23.351 -24.591
 1005    HD2  ARG 125           HD2      ARG 125 -14.510  24.538 -25.899
 1006    HD3  ARG 125           HD3      ARG 125 -15.386  24.810 -24.377
 1007    HE   ARG 125           HE       ARG 125 -12.627  25.690 -24.229
 1008   HH11  ARG 125          HH11      ARG 125 -15.793  26.693 -25.517
 1009   HH12  ARG 125          HH12      ARG 125 -15.431  28.381 -25.479
 1010   HH21  ARG 125          HH21      ARG 125 -12.166  27.953 -24.147
 1011   HH22  ARG 125          HH22      ARG 125 -13.327  29.105 -24.694
 1012    H    TRP 126           H        TRP 126 -12.419  20.435 -26.016
 1013    HA   TRP 126           HA       TRP 126 -10.013  19.991 -24.467
 1014    HB2  TRP 126           HB2      TRP 126 -10.250  20.167 -27.472
 1015    HB3  TRP 126           HB3      TRP 126  -9.101  19.231 -26.503
 1016    HD1  TRP 126           HD1      TRP 126 -11.940  18.638 -28.573
 1017    HE1  TRP 126           HE1      TRP 126 -13.430  16.688 -27.885
 1018    HE3  TRP 126           HE3      TRP 126 -10.148  17.889 -23.827
 1019    HZ2  TRP 126           HZ2      TRP 126 -13.810  15.003 -25.555
 1020    HZ3  TRP 126           HZ3      TRP 126 -11.178  16.184 -22.355
 1021    HH2  TRP 126           HH2      TRP 126 -13.026  14.755 -23.192
 1022    H    VAL 127           H        VAL 127  -8.003  21.139 -24.747
 1023    HA   VAL 127           HA       VAL 127  -8.396  24.042 -25.318
 1024    HB   VAL 127           HB       VAL 127  -7.270  24.545 -23.225
 1025   HG11  VAL 127          HG11      VAL 127  -9.002  24.032 -21.648
 1026   HG12  VAL 127          HG12      VAL 127  -9.752  24.327 -23.223
 1027   HG13  VAL 127          HG13      VAL 127  -9.576  22.663 -22.616
 1028   HG21  VAL 127          HG21      VAL 127  -6.840  22.768 -21.525
 1029   HG22  VAL 127          HG22      VAL 127  -7.297  21.535 -22.712
 1030   HG23  VAL 127          HG23      VAL 127  -5.858  22.527 -22.975
 1031    H    SER 128           H        SER 128  -6.348  25.260 -25.462
 1032    HA   SER 128           HA       SER 128  -4.511  24.239 -27.269
 1033    HB2  SER 128           HB2      SER 128  -3.904  26.387 -25.206
 1034    HB3  SER 128           HB3      SER 128  -3.280  26.248 -26.858
 1035    HG   SER 128           HG       SER 128  -4.960  27.809 -26.732
 1036    H    TYR 129           H        TYR 129  -2.398  23.417 -27.094
 1037    HA   TYR 129           HA       TYR 129  -2.110  21.379 -25.278
 1038    HB2  TYR 129           HB2      TYR 129  -1.045  21.883 -27.559
 1039    HB3  TYR 129           HB3      TYR 129   0.240  22.701 -26.672
 1040    HD1  TYR 129           HD1      TYR 129  -0.328  20.079 -24.448
 1041    HD2  TYR 129           HD2      TYR 129   0.882  20.685 -28.555
 1042    HE1  TYR 129           HE1      TYR 129   0.744  17.898 -24.440
 1043    HE2  TYR 129           HE2      TYR 129   1.957  18.456 -28.536
 1044    HH   TYR 129           HH       TYR 129   1.836  16.297 -25.684
 1045    H    TRP 130           H        TRP 130  -0.723  24.677 -24.976
 1046    HA   TRP 130           HA       TRP 130   0.707  23.896 -22.541
 1047    HB2  TRP 130           HB2      TRP 130   0.555  26.581 -23.939
 1048    HB3  TRP 130           HB3      TRP 130   1.678  26.116 -22.661
 1049    HD1  TRP 130           HD1      TRP 130   1.135  25.858 -26.383
 1050    HE1  TRP 130           HE1      TRP 130   3.046  24.621 -27.521
 1051    HE3  TRP 130           HE3      TRP 130   3.624  24.227 -22.209
 1052    HZ2  TRP 130           HZ2      TRP 130   5.396  23.091 -26.729
 1053    HZ3  TRP 130           HZ3      TRP 130   5.715  22.898 -22.440
 1054    HH2  TRP 130           HH2      TRP 130   6.600  22.339 -24.687
 1055    H    TYR 131           H        TYR 131  -2.515  24.743 -23.053
 1056    HA   TYR 131           HA       TYR 131  -2.890  26.698 -20.991
 1057    HB2  TYR 131           HB2      TYR 131  -4.471  26.376 -22.824
 1058    HB3  TYR 131           HB3      TYR 131  -4.892  24.779 -22.245
 1059    HD1  TYR 131           HD1      TYR 131  -6.170  24.468 -20.125
 1060    HD2  TYR 131           HD2      TYR 131  -5.333  28.387 -21.731
 1061    HE1  TYR 131           HE1      TYR 131  -7.939  25.438 -18.693
 1062    HE2  TYR 131           HE2      TYR 131  -7.081  29.358 -20.286
 1063    HH   TYR 131           HH       TYR 131  -8.728  28.949 -18.666
 1064    HA   PRO 132           HA       PRO 132  -3.983  23.000 -18.079
 1065    HB2  PRO 132           HB2      PRO 132  -2.087  20.937 -19.170
 1066    HB3  PRO 132           HB3      PRO 132  -3.638  20.697 -18.341
 1067    HG2  PRO 132           HG2      PRO 132  -3.503  20.430 -21.027
 1068    HG3  PRO 132           HG3      PRO 132  -4.870  21.348 -20.307
 1069    HD2  PRO 132           HD2      PRO 132  -2.294  22.435 -21.470
 1070    HD3  PRO 132           HD3      PRO 132  -3.973  22.945 -21.789
 1071    H    VAL 133           H        VAL 133  -0.706  23.392 -19.485
 1072    HA   VAL 133           HA       VAL 133   0.768  22.950 -17.089
 1073    HB   VAL 133           HB       VAL 133   1.485  24.789 -19.416
 1074   HG11  VAL 133          HG11      VAL 133   3.022  25.077 -17.542
 1075   HG12  VAL 133          HG12      VAL 133   3.235  23.319 -17.409
 1076   HG13  VAL 133          HG13      VAL 133   3.830  24.203 -18.837
 1077   HG21  VAL 133          HG21      VAL 133   2.688  22.819 -20.345
 1078   HG22  VAL 133          HG22      VAL 133   1.937  21.798 -19.092
 1079   HG23  VAL 133          HG23      VAL 133   0.941  22.601 -20.333
 1080    H    ARG 134           H        ARG 134  -0.969  25.817 -18.352
 1081    HA   ARG 134           HA       ARG 134   0.113  27.459 -16.155
 1082    HB2  ARG 134           HB2      ARG 134  -1.931  28.094 -18.330
 1083    HB3  ARG 134           HB3      ARG 134  -1.283  29.250 -17.173
 1084    HG2  ARG 134           HG2      ARG 134   0.205  27.852 -19.422
 1085    HG3  ARG 134           HG3      ARG 134  -0.147  29.564 -19.259
 1086    HD2  ARG 134           HD2      ARG 134   1.842  27.910 -17.659
 1087    HD3  ARG 134           HD3      ARG 134   2.198  29.222 -18.763
 1088    HE   ARG 134           HE       ARG 134   1.385  29.386 -15.969
 1089   HH11  ARG 134          HH11      ARG 134   1.582  31.255 -19.003
 1090   HH12  ARG 134          HH12      ARG 134   1.434  32.789 -18.230
 1091   HH21  ARG 134          HH21      ARG 134   1.140  31.454 -14.949
 1092   HH22  ARG 134          HH22      ARG 134   1.204  32.898 -15.884
 1093    H    GLN 135           H        GLN 135  -2.531  25.258 -16.588
 1094    HA   GLN 135           HA       GLN 135  -4.097  26.713 -14.535
 1095    HB2  GLN 135           HB2      GLN 135  -4.696  24.793 -16.695
 1096    HB3  GLN 135           HB3      GLN 135  -5.565  24.501 -15.187
 1097    HG2  GLN 135           HG2      GLN 135  -6.753  26.016 -16.797
 1098    HG3  GLN 135           HG3      GLN 135  -6.569  26.612 -15.161
 1099   HE21  GLN 135          HE22      GLN 135  -4.528  26.788 -18.223
 1100   HE22  GLN 135          HE21      GLN 135  -4.363  28.525 -18.126
 1101    H    VAL 136           H        VAL 136  -1.901  23.950 -14.635
 1102    HA   VAL 136           HA       VAL 136  -2.778  22.943 -12.072
 1103    HB   VAL 136           HB       VAL 136  -0.582  21.833 -12.052
 1104   HG11  VAL 136          HG11      VAL 136  -2.542  20.779 -13.065
 1105   HG12  VAL 136          HG12      VAL 136  -2.121  21.483 -14.646
 1106   HG13  VAL 136          HG13      VAL 136  -1.050  20.287 -13.877
 1107   HG21  VAL 136          HG21      VAL 136   0.937  21.903 -13.923
 1108   HG22  VAL 136          HG22      VAL 136  -0.125  23.032 -14.801
 1109   HG23  VAL 136          HG23      VAL 136   0.707  23.564 -13.336
 1110    H    VAL 137           H        VAL 137  -1.322  23.071 -10.103
 1111    HA   VAL 137           HA       VAL 137  -0.772  25.812  -9.377
 1112    HB   VAL 137           HB       VAL 137   0.047  24.797  -7.246
 1113   HG11  VAL 137          HG11      VAL 137  -2.171  24.091  -6.478
 1114   HG12  VAL 137          HG12      VAL 137  -2.300  25.495  -7.543
 1115   HG13  VAL 137          HG13      VAL 137  -2.724  23.881  -8.153
 1116   HG21  VAL 137          HG21      VAL 137  -0.364  22.436  -6.778
 1117   HG22  VAL 137          HG22      VAL 137  -0.860  22.130  -8.447
 1118   HG23  VAL 137          HG23      VAL 137   0.821  22.596  -8.080
 1119    H    SER 138           H        SER 138   1.240  26.687  -8.650
 1120    HA   SER 138           HA       SER 138   3.041  26.788 -10.657
 1121    HB2  SER 138           HB2      SER 138   3.646  27.433  -7.754
 1122    HB3  SER 138           HB3      SER 138   4.297  28.232  -9.197
 1123    HG   SER 138           HG       SER 138   2.568  29.437  -8.259
 1124    H    PHE 139           H        PHE 139   3.347  24.570  -7.816
 1125    HA   PHE 139           HA       PHE 139   6.111  23.985  -8.505
 1126    HB2  PHE 139           HB2      PHE 139   6.142  22.428  -6.763
 1127    HB3  PHE 139           HB3      PHE 139   5.241  23.815  -6.205
 1128    HD1  PHE 139           HD1      PHE 139   5.019  20.264  -7.271
 1129    HD2  PHE 139           HD2      PHE 139   2.901  23.597  -5.519
 1130    HE1  PHE 139           HE1      PHE 139   3.204  18.744  -6.579
 1131    HE2  PHE 139           HE2      PHE 139   1.095  22.061  -4.803
 1132    HZ   PHE 139           HZ       PHE 139   1.224  19.638  -5.344
 1133    H    LYS 140           H        LYS 140   2.974  22.637  -9.463
 1134    HA   LYS 140           HA       LYS 140   4.187  20.299 -10.790
 1135    HB2  LYS 140           HB2      LYS 140   1.355  21.420 -10.940
 1136    HB3  LYS 140           HB3      LYS 140   1.907  19.903 -11.672
 1137    HG2  LYS 140           HG2      LYS 140   2.539  19.080  -9.372
 1138    HG3  LYS 140           HG3      LYS 140   1.841  20.563  -8.703
 1139    HD2  LYS 140           HD2      LYS 140  -0.349  19.924  -9.880
 1140    HD3  LYS 140           HD3      LYS 140   0.395  18.346 -10.207
 1141    HE2  LYS 140           HE2      LYS 140   0.788  18.041  -7.755
 1142    HE3  LYS 140           HE3      LYS 140   0.037  19.612  -7.438
 1143    HZ1  LYS 140           HZ1      LYS 140  -1.386  17.291  -8.667
 1144    HZ2  LYS 140           HZ2      LYS 140  -1.522  17.758  -7.099
 1145    HZ3  LYS 140           HZ3      LYS 140  -2.059  18.747  -8.281
 1146    H    ARG 141           H        ARG 141   3.009  23.545 -11.737
 1147    HA   ARG 141           HA       ARG 141   2.866  23.447 -14.469
 1148    HB2  ARG 141           HB2      ARG 141   2.468  25.483 -13.192
 1149    HB3  ARG 141           HB3      ARG 141   4.156  25.553 -12.683
 1150    HG2  ARG 141           HG2      ARG 141   4.839  26.022 -15.049
 1151    HG3  ARG 141           HG3      ARG 141   3.128  26.079 -15.494
 1152    HD2  ARG 141           HD2      ARG 141   2.760  27.940 -13.936
 1153    HD3  ARG 141           HD3      ARG 141   4.443  27.817 -13.375
 1154    HE   ARG 141           HE       ARG 141   4.384  28.168 -16.217
 1155   HH11  ARG 141          HH11      ARG 141   3.978  30.019 -13.203
 1156   HH12  ARG 141          HH12      ARG 141   4.554  31.502 -13.875
 1157   HH21  ARG 141          HH21      ARG 141   5.168  30.146 -17.101
 1158   HH22  ARG 141          HH22      ARG 141   5.233  31.572 -16.134
 1159    H    ASP 142           H        ASP 142   5.969  23.802 -12.708
 1160    HA   ASP 142           HA       ASP 142   7.541  24.108 -15.067
 1161    HB2  ASP 142           HB2      ASP 142   8.303  24.820 -12.839
 1162    HB3  ASP 142           HB3      ASP 142   8.374  23.136 -12.307
 1163    H    VAL 143           H        VAL 143   6.510  21.211 -13.297
 1164    HA   VAL 143           HA       VAL 143   8.232  19.454 -14.896
 1165    HB   VAL 143           HB       VAL 143   6.157  18.930 -12.728
 1166   HG11  VAL 143          HG11      VAL 143   7.040  16.598 -12.724
 1167   HG12  VAL 143          HG12      VAL 143   6.217  16.982 -14.235
 1168   HG13  VAL 143          HG13      VAL 143   7.998  16.983 -14.166
 1169   HG21  VAL 143          HG21      VAL 143   8.212  19.996 -11.894
 1170   HG22  VAL 143          HG22      VAL 143   8.216  18.297 -11.420
 1171   HG23  VAL 143          HG23      VAL 143   9.217  18.819 -12.779
 1172    H    TYR 144           H        TYR 144   4.762  20.411 -14.763
 1173    HA   TYR 144           HA       TYR 144   3.946  18.480 -16.650
 1174    HB2  TYR 144           HB2      TYR 144   2.546  19.908 -15.056
 1175    HB3  TYR 144           HB3      TYR 144   2.629  21.182 -16.247
 1176    HD1  TYR 144           HD1      TYR 144   2.331  17.753 -17.751
 1177    HD2  TYR 144           HD2      TYR 144   0.107  21.009 -15.956
 1178    HE1  TYR 144           HE1      TYR 144   0.273  16.746 -18.485
 1179    HE2  TYR 144           HE2      TYR 144  -1.985  19.976 -16.702
 1180    HH   TYR 144           HH       TYR 144  -2.971  18.213 -17.924
 1181    H    ARG 145           H        ARG 145   5.290  21.811 -17.111
 1182    HA   ARG 145           HA       ARG 145   5.117  22.073 -19.851
 1183    HB2  ARG 145           HB2      ARG 145   6.151  23.569 -17.947
 1184    HB3  ARG 145           HB3      ARG 145   7.631  22.635 -18.195
 1185    HG2  ARG 145           HG2      ARG 145   7.469  23.268 -20.654
 1186    HG3  ARG 145           HG3      ARG 145   6.077  24.270 -20.207
 1187    HD2  ARG 145           HD2      ARG 145   8.085  25.661 -20.417
 1188    HD3  ARG 145           HD3      ARG 145   7.535  25.646 -18.748
 1189    HE   ARG 145           HE       ARG 145   9.843  24.096 -19.892
 1190   HH11  ARG 145          HH21      ARG 145   8.473  25.819 -17.073
 1191   HH12  ARG 145          HH22      ARG 145   9.721  25.240 -15.989
 1192   HH21  ARG 145          HH11      ARG 145  11.555  23.536 -18.450
 1193   HH22  ARG 145          HH12      ARG 145  11.505  24.066 -16.801
 1194    H    ARG 146           H        ARG 146   7.380  19.988 -17.987
 1195    HA   ARG 146           HA       ARG 146   9.051  19.297 -20.228
 1196    HB2  ARG 146           HB2      ARG 146   8.591  17.576 -17.738
 1197    HB3  ARG 146           HB3      ARG 146   9.970  17.545 -18.834
 1198    HG2  ARG 146           HG2      ARG 146  10.615  19.843 -18.110
 1199    HG3  ARG 146           HG3      ARG 146   9.199  19.884 -17.058
 1200    HD2  ARG 146           HD2      ARG 146  10.133  17.821 -15.883
 1201    HD3  ARG 146           HD3      ARG 146  11.642  18.137 -16.768
 1202    HE   ARG 146           HE       ARG 146  10.630  20.495 -15.398
 1203   HH11  ARG 146          HH11      ARG 146  12.540  17.527 -14.864
 1204   HH12  ARG 146          HH12      ARG 146  13.323  18.131 -13.452
 1205   HH21  ARG 146          HH21      ARG 146  11.612  21.266 -13.497
 1206   HH22  ARG 146          HH22      ARG 146  12.810  20.317 -12.668
 1207    H    VAL 147           H        VAL 147   6.194  17.675 -18.720
 1208    HA   VAL 147           HA       VAL 147   6.091  15.458 -20.474
 1209    HB   VAL 147           HB       VAL 147   3.757  16.929 -19.192
 1210   HG11  VAL 147          HG11      VAL 147   2.605  14.747 -19.278
 1211   HG12  VAL 147          HG12      VAL 147   3.003  15.338 -20.892
 1212   HG13  VAL 147          HG13      VAL 147   3.994  14.058 -20.157
 1213   HG21  VAL 147          HG21      VAL 147   5.413  16.254 -17.447
 1214   HG22  VAL 147          HG22      VAL 147   3.931  15.304 -17.343
 1215   HG23  VAL 147          HG23      VAL 147   5.377  14.599 -18.086
 1216    H    MET 148           H        MET 148   4.506  18.742 -20.817
 1217    HA   MET 148           HA       MET 148   3.351  18.077 -23.300
 1218    HB2  MET 148           HB2      MET 148   4.264  20.848 -22.491
 1219    HB3  MET 148           HB3      MET 148   3.120  20.446 -23.760
 1220    HG2  MET 148           HG2      MET 148   2.759  20.309 -20.777
 1221    HG3  MET 148           HG3      MET 148   1.880  21.252 -21.973
 1222    HE1  MET 148           HE1      MET 148  -0.475  20.833 -21.050
 1223    HE2  MET 148           HE2      MET 148  -1.020  19.245 -20.487
 1224    HE3  MET 148           HE3      MET 148   0.332  20.063 -19.679
 1225    H    LYS 149           H        LYS 149   6.530  19.674 -22.588
 1226    HA   LYS 149           HA       LYS 149   7.358  20.146 -25.227
 1227    HB2  LYS 149           HB2      LYS 149   8.494  21.148 -23.381
 1228    HB3  LYS 149           HB3      LYS 149   8.888  19.604 -22.644
 1229    HG2  LYS 149           HG2      LYS 149   9.990  20.149 -25.398
 1230    HG3  LYS 149           HG3      LYS 149  10.661  21.054 -24.041
 1231    HD2  LYS 149           HD2      LYS 149  11.294  19.032 -22.859
 1232    HD3  LYS 149           HD3      LYS 149  10.517  18.007 -24.068
 1233    HE2  LYS 149           HE2      LYS 149  12.064  18.813 -25.804
 1234    HE3  LYS 149           HE3      LYS 149  12.877  19.847 -24.620
 1235    HZ1  LYS 149           HZ1      LYS 149  13.573  17.886 -23.419
 1236    HZ2  LYS 149           HZ2      LYS 149  12.702  16.877 -24.384
 1237    HZ3  LYS 149           HZ3      LYS 149  14.002  17.696 -24.983
 1238    H    GLU 150           H        GLU 150   7.837  17.184 -23.224
 1239    HA   GLU 150           HA       GLU 150   9.556  15.920 -25.099
 1240    HB2  GLU 150           HB2      GLU 150   7.815  14.888 -22.829
 1241    HB3  GLU 150           HB3      GLU 150   8.900  13.832 -23.734
 1242    HG2  GLU 150           HG2      GLU 150   9.942  16.353 -22.382
 1243    HG3  GLU 150           HG3      GLU 150   9.755  14.840 -21.513
 1244    H    PHE 151           H        PHE 151   6.148  16.373 -25.224
 1245    HA   PHE 151           HA       PHE 151   5.854  14.300 -27.356
 1246    HB2  PHE 151           HB2      PHE 151   3.873  15.522 -25.432
 1247    HB3  PHE 151           HB3      PHE 151   3.461  14.376 -26.708
 1248    HD1  PHE 151           HD1      PHE 151   5.714  12.341 -26.332
 1249    HD2  PHE 151           HD2      PHE 151   3.205  14.416 -23.491
 1250    HE1  PHE 151           HE1      PHE 151   5.916  10.453 -24.761
 1251    HE2  PHE 151           HE2      PHE 151   3.359  12.485 -21.953
 1252    HZ   PHE 151           HZ       PHE 151   4.686  10.495 -22.590
 1253    H    ALA 152           H        ALA 152   6.027  17.659 -26.871
 1254    HA   ALA 152           HA       ALA 152   3.997  18.833 -28.075
 1255    HB1  ALA 152           HB1      ALA 152   6.910  19.604 -28.494
 1256    HB2  ALA 152           HB2      ALA 152   5.507  20.658 -28.780
 1257    HB3  ALA 152           HB3      ALA 152   5.852  20.071 -27.142
 1258    H    SER 153           H        SER 153   6.877  17.935 -30.091
 1259    HA   SER 153           HA       SER 153   5.704  18.626 -32.514
 1260    HB2  SER 153           HB2      SER 153   7.768  16.428 -32.153
 1261    HB3  SER 153           HB3      SER 153   7.561  17.531 -33.532
 1262    HG   SER 153           HG       SER 153   9.282  18.219 -32.156
 1263    H    VAL 154           H        VAL 154   5.087  15.729 -30.614
 1264    HA   VAL 154           HA       VAL 154   4.378  14.006 -32.828
 1265    HB   VAL 154           HB       VAL 154   3.586  13.749 -29.892
 1266   HG11  VAL 154          HG11      VAL 154   4.033  11.647 -32.049
 1267   HG12  VAL 154          HG12      VAL 154   3.635  11.327 -30.345
 1268   HG13  VAL 154          HG13      VAL 154   2.464  12.148 -31.385
 1269   HG21  VAL 154          HG21      VAL 154   6.182  12.821 -31.208
 1270   HG22  VAL 154          HG22      VAL 154   6.037  14.026 -29.912
 1271   HG23  VAL 154          HG23      VAL 154   5.628  12.344 -29.590
 1272    H    VAL 155           H        VAL 155   2.718  16.434 -30.868
 1273    HA   VAL 155           HA       VAL 155   0.145  15.722 -32.175
 1274    HB   VAL 155           HB       VAL 155   0.616  17.902 -30.151
 1275   HG11  VAL 155          HG11      VAL 155  -1.777  17.531 -29.635
 1276   HG12  VAL 155          HG12      VAL 155  -1.546  17.888 -31.355
 1277   HG13  VAL 155          HG13      VAL 155  -1.843  16.218 -30.840
 1278   HG21  VAL 155          HG21      VAL 155  -0.113  16.306 -28.382
 1279   HG22  VAL 155          HG22      VAL 155   0.007  14.972 -29.549
 1280   HG23  VAL 155          HG23      VAL 155   1.453  15.876 -29.039
 1281    H    MET 156           H        MET 156   2.576  18.380 -31.941
 1282    HA   MET 156           HA       MET 156   1.025  20.235 -33.421
 1283    HB2  MET 156           HB2      MET 156   4.041  20.013 -33.080
 1284    HB3  MET 156           HB3      MET 156   3.236  21.383 -33.844
 1285    HG2  MET 156           HG2      MET 156   2.794  20.490 -30.970
 1286    HG3  MET 156           HG3      MET 156   3.789  21.840 -31.506
 1287    HE1  MET 156           HE1      MET 156   1.028  23.874 -29.817
 1288    HE2  MET 156           HE2      MET 156   2.022  22.491 -29.291
 1289    HE3  MET 156           HE3      MET 156   2.753  23.815 -30.227
 1290    H    SER 157           H        SER 157   3.346  17.748 -34.593
 1291    HA   SER 157           HA       SER 157   3.437  18.609 -37.290
 1292    HB2  SER 157           HB2      SER 157   3.579  15.807 -36.121
 1293    HB3  SER 157           HB3      SER 157   4.101  16.266 -37.756
 1294    HG   SER 157           HG       SER 157   5.287  16.803 -35.277
 1295    H    LEU 158           H        LEU 158   0.768  17.155 -35.555
 1296    HA   LEU 158           HA       LEU 158  -0.448  15.938 -37.910
 1297    HB2  LEU 158           HB2      LEU 158  -1.649  16.646 -35.215
 1298    HB3  LEU 158           HB3      LEU 158  -2.385  15.600 -36.425
 1299    HG   LEU 158           HG       LEU 158   0.193  15.018 -34.915
 1300   HD11  LEU 158          HD11      LEU 158  -1.135  13.381 -33.675
 1301   HD12  LEU 158          HD12      LEU 158  -1.798  15.019 -33.437
 1302   HD13  LEU 158          HD13      LEU 158  -2.614  13.878 -34.530
 1303   HD21  LEU 158          HD21      LEU 158  -0.078  12.706 -35.760
 1304   HD22  LEU 158          HD22      LEU 158  -1.469  13.225 -36.743
 1305   HD23  LEU 158          HD23      LEU 158   0.162  13.855 -37.084
 1306    H    GLN 159           H        GLN 159  -0.417  19.156 -36.445
 1307    HA   GLN 159           HA       GLN 159  -2.674  20.031 -38.211
 1308    HB2  GLN 159           HB2      GLN 159  -1.554  21.552 -35.838
 1309    HB3  GLN 159           HB3      GLN 159  -3.066  21.835 -36.691
 1310    HG2  GLN 159           HG2      GLN 159  -2.378  19.616 -34.763
 1311    HG3  GLN 159           HG3      GLN 159  -3.606  20.870 -34.649
 1312   HE21  GLN 159          HE22      GLN 159  -3.250  17.586 -35.198
 1313   HE22  GLN 159          HE21      GLN 159  -4.813  17.326 -35.957
 1314    H    GLU 160           H        GLU 160   0.702  20.649 -37.318
 1315    HA   GLU 160           HA       GLU 160   1.142  22.754 -39.279
 1316    HB2  GLU 160           HB2      GLU 160   2.202  22.419 -36.974
 1317    HB3  GLU 160           HB3      GLU 160   3.104  21.074 -37.668
 1318    HG2  GLU 160           HG2      GLU 160   4.291  22.606 -39.162
 1319    HG3  GLU 160           HG3      GLU 160   3.226  23.942 -38.699
 1320    H    ASN 161           H        ASN 161   0.220  19.892 -39.963
 1321    HA   ASN 161           HA       ASN 161   2.287  18.368 -41.040
 1322    HB2  ASN 161           HB2      ASN 161  -0.179  17.740 -40.424
 1323    HB3  ASN 161           HB3      ASN 161  -0.566  18.212 -42.085
 1324   HD21  ASN 161          HD22      ASN 161   1.642  16.208 -40.116
 1325   HD22  ASN 161          HD21      ASN 161   1.842  14.907 -41.288
 1326    H    THR 162           H        THR 162   0.262  20.855 -42.670
 1327    HA   THR 162           HA       THR 162   1.264  20.248 -45.263
 1328    HB   THR 162           HB       THR 162   0.263  22.784 -45.465
 1329    HG1  THR 162           HG1      THR 162  -1.519  22.892 -44.090
 1330   HG21  THR 162          HG21      THR 162  -1.833  21.669 -46.183
 1331   HG22  THR 162          HG22      THR 162  -0.414  20.822 -46.812
 1332   HG23  THR 162          HG23      THR 162  -1.294  20.154 -45.420
 1333    HA   PRO 163           HA       PRO 163   4.420  23.784 -44.338
 1334    HB2  PRO 163           HB2      PRO 163   4.375  23.501 -41.330
 1335    HB3  PRO 163           HB3      PRO 163   4.814  24.932 -42.307
 1336    HG2  PRO 163           HG2      PRO 163   2.356  24.705 -41.146
 1337    HG3  PRO 163           HG3      PRO 163   2.537  25.393 -42.797
 1338    HD2  PRO 163           HD2      PRO 163   1.545  22.666 -42.006
 1339    HD3  PRO 163           HD3      PRO 163   1.114  23.683 -43.396
 1340    H    LYS 164           H        LYS 164   4.121  20.904 -42.246
 1341    HA   LYS 164           HA       LYS 164   6.873  20.457 -41.853
 1342    HB2  LYS 164           HB2      LYS 164   4.456  19.111 -41.152
 1343    HB3  LYS 164           HB3      LYS 164   5.412  17.934 -42.029
 1344    HG2  LYS 164           HG2      LYS 164   5.844  17.752 -39.665
 1345    HG3  LYS 164           HG3      LYS 164   7.310  18.307 -40.476
 1346    HD2  LYS 164           HD2      LYS 164   6.885  20.620 -39.709
 1347    HD3  LYS 164           HD3      LYS 164   5.350  20.116 -38.976
 1348    HE2  LYS 164           HE2      LYS 164   6.482  18.722 -37.370
 1349    HE3  LYS 164           HE3      LYS 164   8.027  18.868 -38.218
 1350    HZ1  LYS 164           HZ1      LYS 164   7.847  20.301 -36.223
 1351    HZ2  LYS 164           HZ2      LYS 164   8.157  21.163 -37.577
 1352    HZ3  LYS 164           HZ3      LYS 164   6.647  21.176 -36.938
  Start of MODEL   21
    1    H1   MET   1           H1       MET   1  -2.955   2.931  -2.422
    2    H2   MET   1           H2       MET   1  -3.318   1.372  -2.048
    3    H3   MET   1           H3       MET   1  -2.277   2.219  -1.112
    4    HA   MET   1           HA       MET   1  -1.044   0.683  -2.453
    5    HB2  MET   1           HB2      MET   1  -2.682   0.473  -4.286
    6    HB3  MET   1           HB3      MET   1  -2.349   2.121  -4.818
    7    HG2  MET   1           HG2      MET   1  -1.251   0.466  -6.237
    8    HG3  MET   1           HG3      MET   1  -0.074   1.507  -5.453
    9    HE1  MET   1           HE1      MET   1   1.926  -0.133  -6.105
   10    HE2  MET   1           HE2      MET   1   1.855  -1.888  -5.850
   11    HE3  MET   1           HE3      MET   1   0.718  -1.111  -6.974
   12    H    ILE   2           H        ILE   2   1.120   1.249  -2.479
   13    HA   ILE   2           HA       ILE   2   1.959   3.938  -3.328
   14    HB   ILE   2           HB       ILE   2   2.606   2.618  -0.660
   15   HG12  ILE   2          HG12      ILE   2   0.671   4.131  -0.577
   16   HG13  ILE   2          HG13      ILE   2   2.018   4.729   0.367
   17   HG21  ILE   2          HG21      ILE   2   4.173   4.824  -2.045
   18   HG22  ILE   2          HG22      ILE   2   4.303   4.429  -0.312
   19   HG23  ILE   2          HG23      ILE   2   4.758   3.234  -1.513
   20   HD11  ILE   2          HD11      ILE   2   0.907   6.554  -0.787
   21   HD12  ILE   2          HD12      ILE   2   2.565   6.392  -1.386
   22   HD13  ILE   2          HD13      ILE   2   1.197   5.804  -2.361
   23    H    ASP   3           H        ASP   3   4.030   3.815  -4.329
   24    HA   ASP   3           HA       ASP   3   4.422   1.321  -5.691
   25    HB2  ASP   3           HB2      ASP   3   4.745   3.518  -6.736
   26    HB3  ASP   3           HB3      ASP   3   6.109   3.842  -5.675
   27    H    ASP   4           H        ASP   4   6.454   3.076  -3.321
   28    HA   ASP   4           HA       ASP   4   7.367   0.552  -2.211
   29    HB2  ASP   4           HB2      ASP   4   9.042   0.754  -3.946
   30    HB3  ASP   4           HB3      ASP   4   9.365   2.430  -3.502
   31    H    ASP   5           H        ASP   5   8.810   3.815  -2.093
   32    HA   ASP   5           HA       ASP   5   8.784   3.667   0.771
   33    HB2  ASP   5           HB2      ASP   5  10.723   4.498  -0.409
   34    HB3  ASP   5           HB3      ASP   5   9.789   5.832  -1.088
   35    H    GLY   6           H        GLY   6   7.361   6.011  -1.507
   36    HA2  GLY   6           HA2      GLY   6   5.063   6.560   0.213
   37    HA3  GLY   6           HA3      GLY   6   6.305   7.812   0.268
   38    H    TYR   7           H        TYR   7   5.969   6.173  -2.824
   39    HA   TYR   7           HA       TYR   7   4.793   8.645  -3.953
   40    HB2  TYR   7           HB2      TYR   7   6.391   6.358  -5.158
   41    HB3  TYR   7           HB3      TYR   7   5.494   7.511  -6.140
   42    HD1  TYR   7           HD1      TYR   7   5.931   9.975  -5.929
   43    HD2  TYR   7           HD2      TYR   7   8.593   7.002  -4.295
   44    HE1  TYR   7           HE1      TYR   7   7.678  11.678  -5.708
   45    HE2  TYR   7           HE2      TYR   7  10.381   8.695  -4.124
   46    HH   TYR   7           HH       TYR   7  10.962  10.949  -4.395
   47    H    ARG   8           H        ARG   8   2.820   8.668  -4.880
   48    HA   ARG   8           HA       ARG   8   1.139   6.230  -4.761
   49    HB2  ARG   8           HB2      ARG   8   0.239   8.402  -4.027
   50    HB3  ARG   8           HB3      ARG   8   0.587   9.125  -5.589
   51    HG2  ARG   8           HG2      ARG   8  -1.767   8.704  -5.410
   52    HG3  ARG   8           HG3      ARG   8  -1.113   7.652  -6.657
   53    HD2  ARG   8           HD2      ARG   8  -1.123   5.746  -5.041
   54    HD3  ARG   8           HD3      ARG   8  -1.760   6.794  -3.784
   55    HE   ARG   8           HE       ARG   8  -3.134   5.717  -6.175
   56   HH11  ARG   8          HH12      ARG   8  -3.443   7.887  -3.364
   57   HH12  ARG   8          HH11      ARG   8  -5.166   7.938  -3.423
   58   HH21  ARG   8          HH21      ARG   8  -5.431   5.782  -6.235
   59   HH22  ARG   8          HH22      ARG   8  -6.309   6.719  -5.083
   60    HA   PRO   9           HA       PRO   9   2.575   5.741  -9.055
   61    HB2  PRO   9           HB2      PRO   9   1.916   3.146  -9.517
   62    HB3  PRO   9           HB3      PRO   9   3.235   3.605  -8.419
   63    HG2  PRO   9           HG2      PRO   9   0.387   2.856  -7.696
   64    HG3  PRO   9           HG3      PRO   9   1.917   2.268  -6.963
   65    HD2  PRO   9           HD2      PRO   9   0.408   4.315  -5.904
   66    HD3  PRO   9           HD3      PRO   9   2.189   4.229  -5.738
   67    H    ASN  10           H        ASN  10   1.569   6.362 -10.928
   68    HA   ASN  10           HA       ASN  10  -1.021   5.318 -11.665
   69    HB2  ASN  10           HB2      ASN  10  -2.212   7.387 -11.877
   70    HB3  ASN  10           HB3      ASN  10  -1.695   7.308 -10.193
   71   HD21  ASN  10          HD21      ASN  10   0.453   8.460  -9.808
   72   HD22  ASN  10          HD22      ASN  10   0.634  10.012 -10.633
   73    H    VAL  11           H        VAL  11  -1.637   6.551 -13.870
   74    HA   VAL  11           HA       VAL  11   0.825   7.375 -15.271
   75    HB   VAL  11           HB       VAL  11  -0.059   6.408 -17.331
   76   HG11  VAL  11          HG11      VAL  11   0.566   4.072 -16.853
   77   HG12  VAL  11          HG12      VAL  11   1.652   5.205 -16.034
   78   HG13  VAL  11          HG13      VAL  11   0.386   4.353 -15.114
   79   HG21  VAL  11          HG21      VAL  11  -2.143   5.083 -15.528
   80   HG22  VAL  11          HG22      VAL  11  -2.414   6.155 -16.932
   81   HG23  VAL  11          HG23      VAL  11  -1.687   4.544 -17.130
   82    H    GLY  12           H        GLY  12   0.477   9.330 -16.464
   83    HA2  GLY  12           HA2      GLY  12  -2.092  10.720 -15.904
   84    HA3  GLY  12           HA3      GLY  12  -0.597  11.455 -16.474
   85    H    ILE  13           H        ILE  13  -3.679  10.683 -17.463
   86    HA   ILE  13           HA       ILE  13  -3.134   9.798 -20.177
   87    HB   ILE  13           HB       ILE  13  -5.536  10.976 -18.738
   88   HG12  ILE  13          HG12      ILE  13  -4.943   8.605 -18.242
   89   HG13  ILE  13          HG13      ILE  13  -6.554   8.827 -18.909
   90   HG21  ILE  13          HG21      ILE  13  -5.843  11.798 -20.912
   91   HG22  ILE  13          HG22      ILE  13  -5.378  10.259 -21.670
   92   HG23  ILE  13          HG23      ILE  13  -6.906  10.401 -20.756
   93   HD11  ILE  13          HD11      ILE  13  -4.168   7.923 -20.585
   94   HD12  ILE  13          HD12      ILE  13  -5.312   6.838 -19.791
   95   HD13  ILE  13          HD13      ILE  13  -5.887   7.937 -21.048
   96    H    VAL  14           H        VAL  14  -2.208  11.094 -21.763
   97    HA   VAL  14           HA       VAL  14  -2.802  14.022 -21.642
   98    HB   VAL  14           HB       VAL  14  -0.586  12.704 -23.250
   99   HG11  VAL  14          HG11      VAL  14   0.121  14.961 -23.738
  100   HG12  VAL  14          HG12      VAL  14  -1.580  14.834 -24.167
  101   HG13  VAL  14          HG13      VAL  14  -1.113  15.654 -22.662
  102   HG21  VAL  14          HG21      VAL  14   0.937  13.882 -21.676
  103   HG22  VAL  14          HG22      VAL  14  -0.455  14.245 -20.643
  104   HG23  VAL  14          HG23      VAL  14   0.038  12.543 -20.945
  105    H    ILE  15           H        ILE  15  -4.942  13.774 -22.514
  106    HA   ILE  15           HA       ILE  15  -5.220  12.425 -25.106
  107    HB   ILE  15           HB       ILE  15  -7.060  14.497 -23.812
  108   HG12  ILE  15          HG12      ILE  15  -7.238  12.495 -22.512
  109   HG13  ILE  15          HG13      ILE  15  -8.630  12.549 -23.565
  110   HG21  ILE  15          HG21      ILE  15  -7.349  14.650 -26.169
  111   HG22  ILE  15          HG22      ILE  15  -7.271  12.885 -26.367
  112   HG23  ILE  15          HG23      ILE  15  -8.672  13.672 -25.565
  113   HD11  ILE  15          HD11      ILE  15  -7.368  10.960 -25.161
  114   HD12  ILE  15          HD12      ILE  15  -6.166  10.791 -23.876
  115   HD13  ILE  15          HD13      ILE  15  -7.828  10.272 -23.580
  116    H    CYS  16           H        CYS  16  -4.681  13.230 -27.012
  117    HA   CYS  16           HA       CYS  16  -4.048  16.152 -27.190
  118    HB2  CYS  16           HB2      CYS  16  -2.822  13.822 -28.728
  119    HB3  CYS  16           HB3      CYS  16  -2.502  15.564 -29.000
  120    HG   CYS  16           HG       CYS  16  -2.133  13.816 -26.208
  121    H    ASN  17           H        ASN  17  -5.572  17.149 -28.319
  122    HA   ASN  17           HA       ASN  17  -7.442  15.566 -29.979
  123    HB2  ASN  17           HB2      ASN  17  -8.378  17.323 -28.463
  124    HB3  ASN  17           HB3      ASN  17  -7.443  18.553 -29.328
  125   HD21  ASN  17          HD22      ASN  17 -10.358  16.601 -29.421
  126   HD22  ASN  17          HD21      ASN  17 -10.836  17.007 -31.048
  127    H    ARG  18           H        ARG  18  -7.277  15.602 -32.153
  128    HA   ARG  18           HA       ARG  18  -4.826  16.102 -33.366
  129    HB2  ARG  18           HB2      ARG  18  -7.522  15.872 -34.769
  130    HB3  ARG  18           HB3      ARG  18  -5.931  15.449 -35.420
  131    HG2  ARG  18           HG2      ARG  18  -5.757  13.666 -33.602
  132    HG3  ARG  18           HG3      ARG  18  -7.443  14.039 -33.161
  133    HD2  ARG  18           HD2      ARG  18  -8.156  13.611 -35.479
  134    HD3  ARG  18           HD3      ARG  18  -6.474  13.222 -35.913
  135    HE   ARG  18           HE       ARG  18  -7.636  11.640 -33.699
  136   HH11  ARG  18          HH11      ARG  18  -7.150  11.725 -37.227
  137   HH12  ARG  18          HH12      ARG  18  -7.270  10.014 -37.417
  138   HH21  ARG  18          HH21      ARG  18  -7.807   9.424 -33.941
  139   HH22  ARG  18          HH22      ARG  18  -7.640   8.655 -35.498
  140    H    GLN  19           H        GLN  19  -7.247  18.522 -32.769
  141    HA   GLN  19           HA       GLN  19  -6.455  20.265 -34.957
  142    HB2  GLN  19           HB2      GLN  19  -7.773  20.775 -32.268
  143    HB3  GLN  19           HB3      GLN  19  -7.545  22.009 -33.519
  144    HG2  GLN  19           HG2      GLN  19  -9.033  20.972 -35.032
  145    HG3  GLN  19           HG3      GLN  19  -9.037  19.443 -34.155
  146   HE21  GLN  19          HE22      GLN  19 -10.077  19.319 -32.066
  147   HE22  GLN  19          HE21      GLN  19 -11.358  20.448 -31.613
  148    H    GLY  20           H        GLY  20  -4.795  19.165 -32.133
  149    HA2  GLY  20           HA2      GLY  20  -2.485  19.542 -31.829
  150    HA3  GLY  20           HA3      GLY  20  -2.624  21.173 -32.519
  151    H    GLN  21           H        GLN  21  -4.571  19.589 -30.002
  152    HA   GLN  21           HA       GLN  21  -3.799  21.729 -28.085
  153    HB2  GLN  21           HB2      GLN  21  -6.588  21.339 -29.250
  154    HB3  GLN  21           HB3      GLN  21  -6.328  22.039 -27.667
  155    HG2  GLN  21           HG2      GLN  21  -6.374  23.970 -28.891
  156    HG3  GLN  21           HG3      GLN  21  -4.649  23.681 -28.902
  157   HE21  GLN  21          HE22      GLN  21  -3.640  23.563 -31.052
  158   HE22  GLN  21          HE21      GLN  21  -4.556  23.348 -32.521
  159    H    VAL  22           H        VAL  22  -4.356  21.171 -25.878
  160    HA   VAL  22           HA       VAL  22  -4.174  18.205 -25.617
  161    HB   VAL  22           HB       VAL  22  -2.834  18.730 -23.584
  162   HG11  VAL  22          HG11      VAL  22  -1.764  18.162 -25.708
  163   HG12  VAL  22          HG12      VAL  22  -1.803  19.861 -26.215
  164   HG13  VAL  22          HG13      VAL  22  -0.804  19.366 -24.831
  165   HG21  VAL  22          HG21      VAL  22  -1.942  20.953 -23.235
  166   HG22  VAL  22          HG22      VAL  22  -2.856  21.611 -24.600
  167   HG23  VAL  22          HG23      VAL  22  -3.710  21.034 -23.161
  168    H    MET  23           H        MET  23  -4.753  17.237 -23.672
  169    HA   MET  23           HA       MET  23  -7.286  17.541 -22.623
  170    HB2  MET  23           HB2      MET  23  -6.037  15.542 -22.242
  171    HB3  MET  23           HB3      MET  23  -4.695  16.410 -21.507
  172    HG2  MET  23           HG2      MET  23  -6.052  15.122 -19.885
  173    HG3  MET  23           HG3      MET  23  -5.880  16.831 -19.524
  174    HE1  MET  23           HE1      MET  23  -9.830  14.885 -20.934
  175    HE2  MET  23           HE2      MET  23  -8.413  14.990 -21.999
  176    HE3  MET  23           HE3      MET  23  -8.354  13.965 -20.541
  177    H    TRP  24           H        TRP  24  -8.227  18.970 -21.339
  178    HA   TRP  24           HA       TRP  24  -7.027  19.821 -18.929
  179    HB2  TRP  24           HB2      TRP  24  -6.327  21.643 -20.619
  180    HB3  TRP  24           HB3      TRP  24  -8.028  22.081 -20.700
  181    HD1  TRP  24           HD1      TRP  24  -8.421  24.128 -19.215
  182    HE1  TRP  24           HE1      TRP  24  -7.640  24.999 -16.951
  183    HE3  TRP  24           HE3      TRP  24  -5.074  20.433 -18.049
  184    HZ2  TRP  24           HZ2      TRP  24  -5.721  24.217 -14.880
  185    HZ3  TRP  24           HZ3      TRP  24  -3.800  20.517 -15.932
  186    HH2  TRP  24           HH2      TRP  24  -4.114  22.399 -14.342
  187    H    ALA  25           H        ALA  25  -8.725  19.756 -17.429
  188    HA   ALA  25           HA       ALA  25 -11.494  19.747 -18.431
  189    HB1  ALA  25           HB1      ALA  25 -11.829  17.480 -17.339
  190    HB2  ALA  25           HB2      ALA  25 -10.906  17.448 -18.859
  191    HB3  ALA  25           HB3      ALA  25 -10.068  17.304 -17.290
  192    H    ARG  26           H        ARG  26 -13.007  20.087 -16.879
  193    HA   ARG  26           HA       ARG  26 -12.065  21.486 -14.490
  194    HB2  ARG  26           HB2      ARG  26 -13.974  22.283 -15.903
  195    HB3  ARG  26           HB3      ARG  26 -14.914  20.871 -15.396
  196    HG2  ARG  26           HG2      ARG  26 -14.788  21.638 -13.026
  197    HG3  ARG  26           HG3      ARG  26 -13.739  22.979 -13.515
  198    HD2  ARG  26           HD2      ARG  26 -15.978  23.831 -13.218
  199    HD3  ARG  26           HD3      ARG  26 -15.560  23.881 -14.940
  200    HE   ARG  26           HE       ARG  26 -16.982  21.455 -14.123
  201   HH11  ARG  26          HH11      ARG  26 -17.488  24.834 -15.128
  202   HH12  ARG  26          HH12      ARG  26 -19.092  24.558 -15.701
  203   HH21  ARG  26          HH21      ARG  26 -19.050  21.079 -14.883
  204   HH22  ARG  26          HH22      ARG  26 -20.020  22.363 -15.562
  205    H    ARG  27           H        ARG  27 -12.172  20.676 -12.396
  206    HA   ARG  27           HA       ARG  27 -12.053  17.795 -12.321
  207    HB2  ARG  27           HB2      ARG  27 -10.457  19.527 -11.313
  208    HB3  ARG  27           HB3      ARG  27 -11.601  19.720 -10.019
  209    HG2  ARG  27           HG2      ARG  27 -10.154  17.146 -10.801
  210    HG3  ARG  27           HG3      ARG  27  -9.693  18.245  -9.499
  211    HD2  ARG  27           HD2      ARG  27 -11.759  17.711  -8.286
  212    HD3  ARG  27           HD3      ARG  27 -12.178  16.536  -9.553
  213    HE   ARG  27           HE       ARG  27  -9.581  15.918  -8.726
  214   HH11  ARG  27          HH11      ARG  27 -12.835  16.034  -7.279
  215   HH12  ARG  27          HH12      ARG  27 -12.492  14.850  -6.056
  216   HH21  ARG  27          HH21      ARG  27  -9.225  14.113  -7.313
  217   HH22  ARG  27          HH22      ARG  27 -10.358  13.771  -6.042
  218    H    PHE  28           H        PHE  28 -13.449  16.422 -11.356
  219    HA   PHE  28           HA       PHE  28 -16.186  17.076 -10.803
  220    HB2  PHE  28           HB2      PHE  28 -15.591  14.893 -11.575
  221    HB3  PHE  28           HB3      PHE  28 -14.337  14.717 -10.359
  222    HD1  PHE  28           HD1      PHE  28 -17.974  14.478 -10.985
  223    HD2  PHE  28           HD2      PHE  28 -14.767  13.992  -8.134
  224    HE1  PHE  28           HE1      PHE  28 -19.468  13.116  -9.538
  225    HE2  PHE  28           HE2      PHE  28 -16.278  12.639  -6.681
  226    HZ   PHE  28           HZ       PHE  28 -18.628  12.210  -7.381
  227    H    GLY  29           H        GLY  29 -17.159  17.725  -8.871
  228    HA2  GLY  29           HA2      GLY  29 -17.450  18.058  -6.618
  229    HA3  GLY  29           HA3      GLY  29 -16.044  17.031  -6.300
  230    H    GLN  30           H        GLN  30 -15.525  19.663  -8.494
  231    HA   GLN  30           HA       GLN  30 -14.461  21.542  -6.485
  232    HB2  GLN  30           HB2      GLN  30 -12.929  19.777  -8.289
  233    HB3  GLN  30           HB3      GLN  30 -12.610  21.470  -8.637
  234    HG2  GLN  30           HG2      GLN  30 -11.910  21.860  -6.329
  235    HG3  GLN  30           HG3      GLN  30 -12.362  20.206  -5.882
  236   HE21  GLN  30          HE22      GLN  30 -10.245  21.995  -8.243
  237   HE22  GLN  30          HE21      GLN  30  -8.951  20.816  -8.213
  238    H    HIS  31           H        HIS  31 -14.058  23.661  -7.569
  239    HA   HIS  31           HA       HIS  31 -15.696  24.060 -10.038
  240    HB2  HIS  31           HB2      HIS  31 -15.252  26.053  -7.799
  241    HB3  HIS  31           HB3      HIS  31 -16.259  26.268  -9.230
  242    HD1  HIS  31           HD1      HIS  31 -17.254  26.355  -6.089
  243    HD2  HIS  31           HD2      HIS  31 -17.773  23.269  -8.917
  244    HE1  HIS  31           HE1      HIS  31 -19.286  25.019  -5.333
  245    H    SER  32           H        SER  32 -13.048  23.141 -10.046
  246    HA   SER  32           HA       SER  32 -11.498  25.318 -11.260
  247    HB2  SER  32           HB2      SER  32  -9.565  24.599  -9.664
  248    HB3  SER  32           HB3      SER  32 -10.825  25.674  -9.050
  249    HG   SER  32           HG       SER  32 -10.669  24.184  -7.504
  250    H    TRP  33           H        TRP  33  -9.267  24.201 -11.978
  251    HA   TRP  33           HA       TRP  33 -10.086  21.722 -13.420
  252    HB2  TRP  33           HB2      TRP  33  -8.268  23.995 -14.273
  253    HB3  TRP  33           HB3      TRP  33  -8.641  22.557 -15.216
  254    HD1  TRP  33           HD1      TRP  33 -10.644  25.506 -13.638
  255    HE1  TRP  33           HE1      TRP  33 -12.589  26.122 -15.148
  256    HE3  TRP  33           HE3      TRP  33  -9.783  22.205 -17.426
  257    HZ2  TRP  33           HZ2      TRP  33 -13.713  25.235 -17.676
  258    HZ3  TRP  33           HZ3      TRP  33 -11.280  22.134 -19.411
  259    HH2  TRP  33           HH2      TRP  33 -13.271  23.629 -19.526
  260    H    GLN  34           H        GLN  34  -8.263  20.196 -13.951
  261    HA   GLN  34           HA       GLN  34  -6.116  20.287 -11.893
  262    HB2  GLN  34           HB2      GLN  34  -8.192  19.069 -11.060
  263    HB3  GLN  34           HB3      GLN  34  -7.887  17.866 -12.312
  264    HG2  GLN  34           HG2      GLN  34  -5.496  17.732 -11.126
  265    HG3  GLN  34           HG3      GLN  34  -6.356  18.453  -9.782
  266   HE21  GLN  34          HE22      GLN  34  -5.862  15.571 -11.728
  267   HE22  GLN  34          HE21      GLN  34  -6.842  14.480 -10.732
  268    H    PHE  35           H        PHE  35  -4.341  19.162 -12.307
  269    HA   PHE  35           HA       PHE  35  -3.429  18.502 -14.909
  270    HB2  PHE  35           HB2      PHE  35  -1.650  17.276 -13.511
  271    HB3  PHE  35           HB3      PHE  35  -1.792  19.012 -13.284
  272    HD1  PHE  35           HD1      PHE  35  -2.657  19.977 -11.187
  273    HD2  PHE  35           HD2      PHE  35  -2.414  15.699 -11.711
  274    HE1  PHE  35           HE1      PHE  35  -3.365  19.652  -8.838
  275    HE2  PHE  35           HE2      PHE  35  -3.099  15.386  -9.344
  276    HZ   PHE  35           HZ       PHE  35  -3.645  17.352  -7.925
  277    HA   PRO  36           HA       PRO  36  -5.303  14.447 -15.184
  278    HB2  PRO  36           HB2      PRO  36  -2.902  13.725 -16.828
  279    HB3  PRO  36           HB3      PRO  36  -4.611  13.436 -17.199
  280    HG2  PRO  36           HG2      PRO  36  -3.369  15.501 -18.426
  281    HG3  PRO  36           HG3      PRO  36  -5.011  15.723 -17.748
  282    HD2  PRO  36           HD2      PRO  36  -2.372  16.537 -16.497
  283    HD3  PRO  36           HD3      PRO  36  -3.896  17.465 -16.659
  284    H    GLN  37           H        GLN  37  -4.955  12.318 -14.520
  285    HA   GLN  37           HA       GLN  37  -2.670  11.010 -13.690
  286    HB2  GLN  37           HB2      GLN  37  -3.106  10.930 -11.197
  287    HB3  GLN  37           HB3      GLN  37  -2.164  12.272 -11.826
  288    HG2  GLN  37           HG2      GLN  37  -3.955  13.830 -11.504
  289    HG3  GLN  37           HG3      GLN  37  -5.138  12.556 -11.342
  290   HE21  GLN  37          HE22      GLN  37  -5.945  13.158  -9.368
  291   HE22  GLN  37          HE21      GLN  37  -5.016  13.125  -7.873
  292    H    GLY  38           H        GLY  38  -3.365   8.937 -13.786
  293    HA2  GLY  38           HA2      GLY  38  -6.189   8.227 -13.242
  294    HA3  GLY  38           HA3      GLY  38  -4.926   7.204 -13.921
  295    H    GLY  39           H        GLY  39  -4.165   5.691 -12.682
  296    HA2  GLY  39           HA2      GLY  39  -3.323   5.795  -9.985
  297    HA3  GLY  39           HA3      GLY  39  -4.915   5.010 -10.112
  298    H    ILE  40           H        ILE  40  -2.482   3.530  -9.451
  299    HA   ILE  40           HA       ILE  40  -2.553   1.668 -11.789
  300    HB   ILE  40           HB       ILE  40  -0.280   2.569 -10.062
  301   HG12  ILE  40          HG12      ILE  40  -0.391   1.546 -12.926
  302   HG13  ILE  40          HG13      ILE  40  -0.761   3.212 -12.516
  303   HG21  ILE  40          HG21      ILE  40  -0.341   0.202  -9.483
  304   HG22  ILE  40          HG22      ILE  40  -0.421  -0.254 -11.205
  305   HG23  ILE  40          HG23      ILE  40   1.029   0.517 -10.532
  306   HD11  ILE  40          HD11      ILE  40   1.502   2.964 -13.375
  307   HD12  ILE  40          HD12      ILE  40   1.533   3.566 -11.716
  308   HD13  ILE  40          HD13      ILE  40   1.935   1.861 -12.063
  309    H    ASN  41           H        ASN  41  -3.596  -0.094 -11.438
  310    HA   ASN  41           HA       ASN  41  -4.674  -0.864  -8.818
  311    HB2  ASN  41           HB2      ASN  41  -6.082  -1.162 -10.773
  312    HB3  ASN  41           HB3      ASN  41  -4.785  -1.953 -11.648
  313   HD21  ASN  41          HD22      ASN  41  -5.728  -3.948 -12.115
  314   HD22  ASN  41          HD21      ASN  41  -6.268  -5.048 -10.857
  315    HA   PRO  42           HA       PRO  42  -0.966  -2.806  -7.718
  316    HB2  PRO  42           HB2      PRO  42  -2.611  -4.949  -6.335
  317    HB3  PRO  42           HB3      PRO  42  -1.155  -4.090  -5.740
  318    HG2  PRO  42           HG2      PRO  42  -3.606  -3.272  -4.944
  319    HG3  PRO  42           HG3      PRO  42  -2.393  -2.055  -5.441
  320    HD2  PRO  42           HD2      PRO  42  -4.699  -3.166  -7.026
  321    HD3  PRO  42           HD3      PRO  42  -4.136  -1.476  -6.889
  322    H    GLY  43           H        GLY  43   0.234  -3.654  -9.167
  323    HA2  GLY  43           HA2      GLY  43   1.382  -5.401 -10.221
  324    HA3  GLY  43           HA3      GLY  43   0.026  -6.497  -9.927
  325    H    GLU  44           H        GLU  44  -1.180  -3.594 -11.198
  326    HA   GLU  44           HA       GLU  44  -1.588  -4.727 -13.897
  327    HB2  GLU  44           HB2      GLU  44  -3.336  -3.624 -12.504
  328    HB3  GLU  44           HB3      GLU  44  -2.503  -2.077 -12.729
  329    HG2  GLU  44           HG2      GLU  44  -2.927  -2.051 -15.047
  330    HG3  GLU  44           HG3      GLU  44  -3.294  -3.781 -15.096
  331    H    SER  45           H        SER  45  -0.279  -4.323 -15.551
  332    HA   SER  45           HA       SER  45   2.024  -2.661 -15.299
  333    HB2  SER  45           HB2      SER  45   2.117  -3.429 -17.853
  334    HB3  SER  45           HB3      SER  45   2.509  -4.496 -16.495
  335    HG   SER  45           HG       SER  45   1.106  -5.684 -17.638
  336    H    ALA  46           H        ALA  46   2.630  -1.011 -16.801
  337    HA   ALA  46           HA       ALA  46   1.164   1.234 -16.373
  338    HB1  ALA  46           HB1      ALA  46   2.700   2.321 -17.937
  339    HB2  ALA  46           HB2      ALA  46   3.578   1.067 -17.034
  340    HB3  ALA  46           HB3      ALA  46   3.068   0.739 -18.705
  341    H    GLU  47           H        GLU  47   0.975  -0.775 -19.384
  342    HA   GLU  47           HA       GLU  47  -0.567   1.278 -20.745
  343    HB2  GLU  47           HB2      GLU  47  -0.070  -1.658 -21.373
  344    HB3  GLU  47           HB3      GLU  47  -1.002  -0.569 -22.409
  345    HG2  GLU  47           HG2      GLU  47   0.929   0.883 -22.724
  346    HG3  GLU  47           HG3      GLU  47   1.901  -0.094 -21.615
  347    H    GLN  48           H        GLN  48  -1.267  -1.765 -19.024
  348    HA   GLN  48           HA       GLN  48  -4.081  -1.840 -19.425
  349    HB2  GLN  48           HB2      GLN  48  -2.257  -3.025 -17.269
  350    HB3  GLN  48           HB3      GLN  48  -3.980  -3.333 -17.358
  351    HG2  GLN  48           HG2      GLN  48  -2.569  -5.126 -18.382
  352    HG3  GLN  48           HG3      GLN  48  -3.819  -4.471 -19.432
  353   HE21  GLN  48          HE22      GLN  48  -0.248  -4.033 -18.724
  354   HE22  GLN  48          HE21      GLN  48   0.165  -3.648 -20.377
  355    H    ALA  49           H        ALA  49  -2.087  -0.451 -16.773
  356    HA   ALA  49           HA       ALA  49  -4.199   0.783 -15.344
  357    HB1  ALA  49           HB1      ALA  49  -1.918   0.403 -14.466
  358    HB2  ALA  49           HB2      ALA  49  -1.284   1.586 -15.644
  359    HB3  ALA  49           HB3      ALA  49  -2.393   2.120 -14.367
  360    H    MET  50           H        MET  50  -2.524   1.791 -18.343
  361    HA   MET  50           HA       MET  50  -3.503   4.515 -18.161
  362    HB2  MET  50           HB2      MET  50  -1.425   4.048 -19.327
  363    HB3  MET  50           HB3      MET  50  -2.242   2.971 -20.450
  364    HG2  MET  50           HG2      MET  50  -2.906   5.917 -20.142
  365    HG3  MET  50           HG3      MET  50  -1.774   5.272 -21.317
  366    HE1  MET  50           HE1      MET  50  -2.240   3.981 -23.379
  367    HE2  MET  50           HE2      MET  50  -3.115   2.657 -22.566
  368    HE3  MET  50           HE3      MET  50  -3.847   3.480 -23.961
  369    H    TYR  51           H        TYR  51  -4.642   1.529 -19.780
  370    HA   TYR  51           HA       TYR  51  -6.967   2.912 -20.712
  371    HB2  TYR  51           HB2      TYR  51  -6.676  -0.036 -20.053
  372    HB3  TYR  51           HB3      TYR  51  -7.998   0.696 -20.946
  373    HD1  TYR  51           HD2      TYR  51  -7.484   1.883 -23.177
  374    HD2  TYR  51           HD1      TYR  51  -4.601  -0.521 -21.111
  375    HE1  TYR  51           HE2      TYR  51  -6.257   1.567 -25.295
  376    HE2  TYR  51           HE1      TYR  51  -3.254  -0.750 -23.162
  377    HH   TYR  51           HH       TYR  51  -3.235  -0.387 -25.523
  378    H    ARG  52           H        ARG  52  -6.116   1.551 -17.542
  379    HA   ARG  52           HA       ARG  52  -8.757   1.852 -16.461
  380    HB2  ARG  52           HB2      ARG  52  -6.594   0.641 -15.490
  381    HB3  ARG  52           HB3      ARG  52  -6.238   2.229 -14.815
  382    HG2  ARG  52           HG2      ARG  52  -7.379   1.060 -13.113
  383    HG3  ARG  52           HG3      ARG  52  -8.533   2.218 -13.769
  384    HD2  ARG  52           HD2      ARG  52  -9.682   0.141 -13.429
  385    HD3  ARG  52           HD3      ARG  52  -9.511   0.343 -15.183
  386    HE   ARG  52           HE       ARG  52  -7.278  -1.167 -14.319
  387   HH11  ARG  52          HH11      ARG  52 -10.836  -1.514 -14.509
  388   HH12  ARG  52          HH12      ARG  52 -10.798  -3.232 -14.627
  389   HH21  ARG  52          HH21      ARG  52  -7.254  -3.460 -14.335
  390   HH22  ARG  52          HH22      ARG  52  -8.722  -4.365 -14.567
  391    H    ALA  53           H        ALA  53  -5.891   4.053 -16.536
  392    HA   ALA  53           HA       ALA  53  -7.102   6.199 -15.199
  393    HB1  ALA  53           HB1      ALA  53  -5.018   6.272 -17.415
  394    HB2  ALA  53           HB2      ALA  53  -5.305   7.520 -16.190
  395    HB3  ALA  53           HB3      ALA  53  -4.668   5.930 -15.708
  396    H    LEU  54           H        LEU  54  -7.155   5.258 -18.597
  397    HA   LEU  54           HA       LEU  54  -8.287   7.550 -19.814
  398    HB2  LEU  54           HB2      LEU  54  -7.200   5.627 -20.914
  399    HB3  LEU  54           HB3      LEU  54  -8.446   4.572 -20.250
  400    HG   LEU  54           HG       LEU  54 -10.146   5.652 -21.666
  401   HD11  LEU  54          HD11      LEU  54  -9.019   7.824 -22.077
  402   HD12  LEU  54          HD12      LEU  54  -7.664   6.993 -22.863
  403   HD13  LEU  54          HD13      LEU  54  -9.281   6.978 -23.617
  404   HD21  LEU  54          HD21      LEU  54  -9.127   3.559 -22.171
  405   HD22  LEU  54          HD22      LEU  54  -9.337   4.483 -23.680
  406   HD23  LEU  54          HD23      LEU  54  -7.719   4.343 -22.930
  407    H    PHE  55           H        PHE  55  -9.708   4.668 -18.289
  408    HA   PHE  55           HA       PHE  55 -12.451   5.513 -18.557
  409    HB2  PHE  55           HB2      PHE  55 -12.304   3.255 -18.382
  410    HB3  PHE  55           HB3      PHE  55 -10.927   3.274 -17.317
  411    HD1  PHE  55           HD1      PHE  55 -14.594   3.279 -17.483
  412    HD2  PHE  55           HD2      PHE  55 -11.137   3.416 -14.919
  413    HE1  PHE  55           HE1      PHE  55 -16.013   2.647 -15.526
  414    HE2  PHE  55           HE2      PHE  55 -12.549   2.770 -12.967
  415    HZ   PHE  55           HZ       PHE  55 -14.990   2.375 -13.280
  416    H    GLU  56           H        GLU  56 -10.071   5.710 -15.820
  417    HA   GLU  56           HA       GLU  56 -11.884   6.813 -13.950
  418    HB2  GLU  56           HB2      GLU  56  -8.864   7.042 -14.222
  419    HB3  GLU  56           HB3      GLU  56  -9.760   7.686 -12.848
  420    HG2  GLU  56           HG2      GLU  56 -10.560   5.482 -12.228
  421    HG3  GLU  56           HG3      GLU  56  -9.767   4.746 -13.620
  422    H    GLU  57           H        GLU  57  -9.779   8.419 -16.317
  423    HA   GLU  57           HA       GLU  57 -10.351  11.034 -15.186
  424    HB2  GLU  57           HB2      GLU  57  -8.568  10.188 -17.508
  425    HB3  GLU  57           HB3      GLU  57  -8.693  11.803 -16.817
  426    HG2  GLU  57           HG2      GLU  57  -8.077  10.719 -14.553
  427    HG3  GLU  57           HG3      GLU  57  -7.614   9.285 -15.455
  428    H    VAL  58           H        VAL  58 -10.983   9.374 -18.353
  429    HA   VAL  58           HA       VAL  58 -12.834  11.596 -18.964
  430    HB   VAL  58           HB       VAL  58 -12.227  11.221 -21.291
  431   HG11  VAL  58          HG11      VAL  58 -10.251  12.615 -21.180
  432   HG12  VAL  58          HG12      VAL  58 -11.408  13.123 -19.938
  433   HG13  VAL  58          HG13      VAL  58  -9.978  12.179 -19.471
  434   HG21  VAL  58          HG21      VAL  58 -11.101   9.061 -21.210
  435   HG22  VAL  58          HG22      VAL  58 -10.054  10.305 -21.902
  436   HG23  VAL  58          HG23      VAL  58  -9.781   9.757 -20.234
  437    H    GLY  59           H        GLY  59 -12.853   8.330 -18.191
  438    HA2  GLY  59           HA2      GLY  59 -14.677   6.916 -18.201
  439    HA3  GLY  59           HA3      GLY  59 -15.650   8.216 -18.892
  440    H    LEU  60           H        LEU  60 -12.671   7.214 -20.461
  441    HA   LEU  60           HA       LEU  60 -14.224   6.187 -22.795
  442    HB2  LEU  60           HB2      LEU  60 -11.391   7.199 -22.437
  443    HB3  LEU  60           HB3      LEU  60 -11.913   6.355 -23.886
  444    HG   LEU  60           HG       LEU  60 -12.928   9.009 -22.807
  445   HD11  LEU  60          HD11      LEU  60 -11.403   8.295 -25.360
  446   HD12  LEU  60          HD12      LEU  60 -11.890   9.923 -24.875
  447   HD13  LEU  60          HD13      LEU  60 -10.690   9.053 -23.917
  448   HD21  LEU  60          HD21      LEU  60 -14.187   9.158 -25.014
  449   HD22  LEU  60          HD22      LEU  60 -13.888   7.424 -25.231
  450   HD23  LEU  60          HD23      LEU  60 -14.841   8.003 -23.856
  451    H    SER  61           H        SER  61 -13.351   4.241 -23.842
  452    HA   SER  61           HA       SER  61 -12.234   2.322 -21.840
  453    HB2  SER  61           HB2      SER  61 -14.241   1.742 -24.039
  454    HB3  SER  61           HB3      SER  61 -13.659   0.624 -22.788
  455    HG   SER  61           HG       SER  61 -15.706   1.519 -22.242
  456    H    ARG  62           H        ARG  62 -11.281   0.353 -23.031
  457    HA   ARG  62           HA       ARG  62  -9.059   1.356 -24.477
  458    HB2  ARG  62           HB2      ARG  62  -8.171  -0.919 -24.200
  459    HB3  ARG  62           HB3      ARG  62  -8.883  -0.292 -22.724
  460    HG2  ARG  62           HG2      ARG  62 -11.029  -1.672 -23.519
  461    HG3  ARG  62           HG3      ARG  62  -9.836  -2.534 -24.488
  462    HD2  ARG  62           HD2      ARG  62  -9.988  -3.763 -22.460
  463    HD3  ARG  62           HD3      ARG  62  -8.478  -2.876 -22.368
  464    HE   ARG  62           HE       ARG  62  -9.257  -1.715 -20.543
  465   HH11  ARG  62          HH11      ARG  62 -12.039  -3.340 -22.043
  466   HH12  ARG  62          HH12      ARG  62 -13.124  -2.975 -20.752
  467   HH21  ARG  62          HH22      ARG  62 -10.717  -1.210 -18.827
  468   HH22  ARG  62          HH21      ARG  62 -12.352  -1.752 -18.894
  469    H    LYS  63           H        LYS  63 -10.538   2.187 -26.113
  470    HA   LYS  63           HA       LYS  63 -10.290   0.744 -28.645
  471    HB2  LYS  63           HB2      LYS  63 -12.638   0.454 -29.057
  472    HB3  LYS  63           HB3      LYS  63 -12.325  -0.238 -27.461
  473    HG2  LYS  63           HG2      LYS  63 -13.149   1.929 -26.436
  474    HG3  LYS  63           HG3      LYS  63 -13.609   2.450 -28.075
  475    HD2  LYS  63           HD2      LYS  63 -15.166   0.535 -28.247
  476    HD3  LYS  63           HD3      LYS  63 -14.692   0.016 -26.619
  477    HE2  LYS  63           HE2      LYS  63 -16.744   1.246 -26.390
  478    HE3  LYS  63           HE3      LYS  63 -15.436   2.241 -25.715
  479    HZ1  LYS  63           HZ1      LYS  63 -15.491   3.624 -27.640
  480    HZ2  LYS  63           HZ2      LYS  63 -16.545   2.629 -28.442
  481    HZ3  LYS  63           HZ3      LYS  63 -17.014   3.493 -27.139
  482    H    ASP  64           H        ASP  64 -11.245   3.539 -26.692
  483    HA   ASP  64           HA       ASP  64 -12.126   5.123 -28.945
  484    HB2  ASP  64           HB2      ASP  64 -11.737   5.700 -25.981
  485    HB3  ASP  64           HB3      ASP  64 -12.493   6.824 -27.102
  486    H    VAL  65           H        VAL  65  -9.027   4.457 -28.121
  487    HA   VAL  65           HA       VAL  65  -7.995   7.087 -28.904
  488    HB   VAL  65           HB       VAL  65  -6.524   7.174 -26.915
  489   HG11  VAL  65          HG11      VAL  65  -8.128   8.187 -25.437
  490   HG12  VAL  65          HG12      VAL  65  -8.729   8.431 -27.088
  491   HG13  VAL  65          HG13      VAL  65  -9.443   7.181 -26.064
  492   HG21  VAL  65          HG21      VAL  65  -7.053   5.835 -24.895
  493   HG22  VAL  65          HG22      VAL  65  -8.311   4.964 -25.776
  494   HG23  VAL  65          HG23      VAL  65  -6.604   4.780 -26.233
  495    H    ARG  66           H        ARG  66  -5.561   6.973 -29.061
  496    HA   ARG  66           HA       ARG  66  -4.583   4.335 -30.071
  497    HB2  ARG  66           HB2      ARG  66  -5.495   5.468 -31.990
  498    HB3  ARG  66           HB3      ARG  66  -4.990   7.047 -31.409
  499    HG2  ARG  66           HG2      ARG  66  -3.667   6.541 -33.264
  500    HG3  ARG  66           HG3      ARG  66  -2.635   6.486 -31.851
  501    HD2  ARG  66           HD2      ARG  66  -3.877   3.885 -32.787
  502    HD3  ARG  66           HD3      ARG  66  -2.663   4.613 -33.844
  503    HE   ARG  66           HE       ARG  66  -1.351   4.681 -31.475
  504   HH11  ARG  66          HH11      ARG  66  -2.916   2.003 -33.241
  505   HH12  ARG  66          HH12      ARG  66  -1.767   0.830 -32.710
  506   HH21  ARG  66          HH21      ARG  66   0.160   3.184 -30.842
  507   HH22  ARG  66          HH22      ARG  66   0.032   1.513 -31.303
  508    H    ILE  67           H        ILE  67  -2.593   4.048 -28.901
  509    HA   ILE  67           HA       ILE  67  -1.393   6.317 -27.541
  510    HB   ILE  67           HB       ILE  67  -0.431   3.468 -28.027
  511   HG12  ILE  67          HG12      ILE  67  -1.535   4.497 -25.398
  512   HG13  ILE  67          HG13      ILE  67  -2.670   3.970 -26.631
  513   HG21  ILE  67          HG21      ILE  67   1.461   4.870 -27.453
  514   HG22  ILE  67          HG22      ILE  67   0.570   5.617 -26.102
  515   HG23  ILE  67          HG23      ILE  67   1.046   3.903 -26.043
  516   HD11  ILE  67          HD11      ILE  67  -0.424   2.242 -25.496
  517   HD12  ILE  67          HD12      ILE  67  -2.155   2.103 -25.149
  518   HD13  ILE  67          HD13      ILE  67  -1.558   1.774 -26.787
  519    H    LEU  68           H        LEU  68   0.093   7.707 -28.330
  520    HA   LEU  68           HA       LEU  68   1.425   6.981 -30.927
  521    HB2  LEU  68           HB2      LEU  68   0.059   9.391 -30.065
  522    HB3  LEU  68           HB3      LEU  68   1.747   9.767 -30.366
  523    HG   LEU  68           HG       LEU  68   0.313  10.174 -32.298
  524   HD11  LEU  68          HD11      LEU  68   2.258   7.880 -32.847
  525   HD12  LEU  68          HD12      LEU  68   1.671   9.082 -34.013
  526   HD13  LEU  68          HD13      LEU  68   2.707   9.585 -32.666
  527   HD21  LEU  68          HD21      LEU  68  -0.757   8.421 -33.560
  528   HD22  LEU  68          HD22      LEU  68  -0.125   7.160 -32.495
  529   HD23  LEU  68          HD23      LEU  68  -1.318   8.321 -31.877
  530    H    ALA  69           H        ALA  69   1.997   8.076 -27.576
  531    HA   ALA  69           HA       ALA  69   4.777   7.242 -27.711
  532    HB1  ALA  69           HB1      ALA  69   4.073  10.209 -27.363
  533    HB2  ALA  69           HB2      ALA  69   5.689   9.499 -27.146
  534    HB3  ALA  69           HB3      ALA  69   4.933   9.510 -28.746
  535    H    SER  70           H        SER  70   5.799   7.677 -25.457
  536    HA   SER  70           HA       SER  70   3.986   8.488 -23.354
  537    HB2  SER  70           HB2      SER  70   4.319   6.524 -21.941
  538    HB3  SER  70           HB3      SER  70   3.422   6.127 -23.407
  539    HG   SER  70           HG       SER  70   5.230   5.128 -24.261
  540    H    THR  71           H        THR  71   5.355   8.797 -21.214
  541    HA   THR  71           HA       THR  71   7.812  10.088 -22.015
  542    HB   THR  71           HB       THR  71   8.101  10.310 -19.465
  543    HG1  THR  71           HG1      THR  71   6.862   8.854 -18.545
  544   HG21  THR  71          HG21      THR  71   5.609  11.382 -20.832
  545   HG22  THR  71          HG22      THR  71   6.237  11.950 -19.265
  546   HG23  THR  71          HG23      THR  71   7.199  12.154 -20.743
  547    H    ARG  72           H        ARG  72   9.955   9.441 -21.614
  548    HA   ARG  72           HA       ARG  72  10.321   6.676 -22.162
  549    HB2  ARG  72           HB2      ARG  72  12.225   8.974 -21.574
  550    HB3  ARG  72           HB3      ARG  72  12.790   7.354 -22.017
  551    HG2  ARG  72           HG2      ARG  72  11.576   7.430 -24.132
  552    HG3  ARG  72           HG3      ARG  72  10.898   9.012 -23.756
  553    HD2  ARG  72           HD2      ARG  72  13.881   8.457 -23.987
  554    HD3  ARG  72           HD3      ARG  72  12.874   9.014 -25.329
  555    HE   ARG  72           HE       ARG  72  12.265  10.994 -23.802
  556   HH11  ARG  72          HH21      ARG  72  15.516   9.498 -23.761
  557   HH12  ARG  72          HH22      ARG  72  16.315  10.967 -23.329
  558   HH21  ARG  72          HH11      ARG  72  13.299  12.894 -23.353
  559   HH22  ARG  72          HH12      ARG  72  15.017  12.944 -23.021
  560    H    ASN  73           H        ASN  73  10.211   8.307 -19.088
  561    HA   ASN  73           HA       ASN  73  10.460   5.781 -17.738
  562    HB2  ASN  73           HB2      ASN  73  12.088   6.453 -16.075
  563    HB3  ASN  73           HB3      ASN  73  12.840   6.560 -17.655
  564   HD21  ASN  73          HD22      ASN  73  13.284   8.744 -18.556
  565   HD22  ASN  73          HD21      ASN  73  13.281  10.140 -17.508
  566    H    TRP  74           H        TRP  74   9.956   6.238 -15.274
  567    HA   TRP  74           HA       TRP  74   7.475   7.724 -15.200
  568    HB2  TRP  74           HB2      TRP  74   9.036   6.388 -12.950
  569    HB3  TRP  74           HB3      TRP  74   7.378   6.969 -12.887
  570    HD1  TRP  74           HD1      TRP  74   9.522   4.177 -14.433
  571    HE1  TRP  74           HE1      TRP  74   8.033   2.302 -15.283
  572    HE3  TRP  74           HE3      TRP  74   4.938   6.166 -13.292
  573    HZ2  TRP  74           HZ2      TRP  74   5.242   1.808 -15.660
  574    HZ3  TRP  74           HZ3      TRP  74   2.871   4.963 -13.933
  575    HH2  TRP  74           HH2      TRP  74   2.985   2.852 -15.217
  576    H    LEU  75           H        LEU  75   7.362   9.842 -14.862
  577    HA   LEU  75           HA       LEU  75   9.583  11.411 -13.731
  578    HB2  LEU  75           HB2      LEU  75   6.763  12.098 -14.661
  579    HB3  LEU  75           HB3      LEU  75   7.862  13.279 -13.953
  580    HG   LEU  75           HG       LEU  75   8.375  11.729 -16.530
  581   HD11  LEU  75          HD11      LEU  75   7.649  14.666 -16.152
  582   HD12  LEU  75          HD12      LEU  75   7.882  13.800 -17.684
  583   HD13  LEU  75          HD13      LEU  75   6.519  13.384 -16.631
  584   HD21  LEU  75          HD21      LEU  75  10.204  13.406 -16.875
  585   HD22  LEU  75          HD22      LEU  75   9.953  14.000 -15.219
  586   HD23  LEU  75          HD23      LEU  75  10.515  12.338 -15.505
  587    H    ARG  76           H        ARG  76   9.282  12.596 -11.717
  588    HA   ARG  76           HA       ARG  76   7.055  11.844  -9.999
  589    HB2  ARG  76           HB2      ARG  76   8.457  11.027  -8.122
  590    HB3  ARG  76           HB3      ARG  76   8.329   9.958  -9.492
  591    HG2  ARG  76           HG2      ARG  76  10.511   9.722  -8.816
  592    HG3  ARG  76           HG3      ARG  76  10.634  10.735 -10.249
  593    HD2  ARG  76           HD2      ARG  76  10.963  12.733  -8.807
  594    HD3  ARG  76           HD3      ARG  76  10.674  11.735  -7.366
  595    HE   ARG  76           HE       ARG  76  12.852  10.832  -9.102
  596   HH11  ARG  76          HH11      ARG  76  12.046  12.830  -6.270
  597   HH12  ARG  76          HH12      ARG  76  13.670  12.896  -5.684
  598   HH21  ARG  76          HH21      ARG  76  14.999  10.883  -8.298
  599   HH22  ARG  76          HH22      ARG  76  15.376  11.739  -6.849
  600    H    TYR  77           H        TYR  77   6.910  13.216  -8.109
  601    HA   TYR  77           HA       TYR  77   8.764  15.457  -7.854
  602    HB2  TYR  77           HB2      TYR  77   6.950  17.155  -7.988
  603    HB3  TYR  77           HB3      TYR  77   7.323  16.390  -9.509
  604    HD1  TYR  77           HD1      TYR  77   4.884  16.091  -6.628
  605    HD2  TYR  77           HD2      TYR  77   5.530  15.662 -10.879
  606    HE1  TYR  77           HE1      TYR  77   2.517  15.561  -6.937
  607    HE2  TYR  77           HE2      TYR  77   3.145  15.191 -11.202
  608    HH   TYR  77           HH       TYR  77   1.061  14.863 -10.175
  609    H    LYS  78           H        LYS  78   8.062  16.786  -5.911
  610    HA   LYS  78           HA       LYS  78   7.133  14.888  -3.797
  611    HB2  LYS  78           HB2      LYS  78   9.657  15.387  -4.106
  612    HB3  LYS  78           HB3      LYS  78   9.315  16.987  -3.468
  613    HG2  LYS  78           HG2      LYS  78   8.835  14.321  -2.047
  614    HG3  LYS  78           HG3      LYS  78  10.224  15.379  -1.829
  615    HD2  LYS  78           HD2      LYS  78   8.536  17.204  -1.100
  616    HD3  LYS  78           HD3      LYS  78   7.346  15.895  -1.048
  617    HE2  LYS  78           HE2      LYS  78   8.117  16.159   1.173
  618    HE3  LYS  78           HE3      LYS  78   8.828  14.659   0.574
  619    HZ1  LYS  78           HZ1      LYS  78  10.435  16.028   1.786
  620    HZ2  LYS  78           HZ2      LYS  78  10.929  15.878   0.241
  621    HZ3  LYS  78           HZ3      LYS  78  10.245  17.278   0.760
  622    H    LEU  79           H        LEU  79   5.443  15.668  -2.676
  623    HA   LEU  79           HA       LEU  79   4.131  18.118  -3.413
  624    HB2  LEU  79           HB2      LEU  79   3.688  16.239  -1.045
  625    HB3  LEU  79           HB3      LEU  79   2.580  17.518  -1.511
  626    HG   LEU  79           HG       LEU  79   3.293  15.152  -3.287
  627   HD11  LEU  79          HD11      LEU  79   2.115  14.422  -1.227
  628   HD12  LEU  79          HD12      LEU  79   0.797  15.552  -1.596
  629   HD13  LEU  79          HD13      LEU  79   1.143  14.187  -2.682
  630   HD21  LEU  79          HD21      LEU  79   1.258  15.783  -4.543
  631   HD22  LEU  79          HD22      LEU  79   1.071  17.226  -3.522
  632   HD23  LEU  79          HD23      LEU  79   2.485  17.052  -4.593
  633    HA   PRO  80           HA       PRO  80   6.097  20.800  -0.339
  634    HB2  PRO  80           HB2      PRO  80   4.132  22.701   0.016
  635    HB3  PRO  80           HB3      PRO  80   5.183  22.629  -1.429
  636    HG2  PRO  80           HG2      PRO  80   2.388  21.494  -1.107
  637    HG3  PRO  80           HG3      PRO  80   3.027  22.504  -2.452
  638    HD2  PRO  80           HD2      PRO  80   2.888  19.809  -2.655
  639    HD3  PRO  80           HD3      PRO  80   4.283  20.701  -3.328
  640    H    LYS  81           H        LYS  81   5.946  21.077   1.981
  641    HA   LYS  81           HA       LYS  81   5.166  18.935   3.332
  642    HB2  LYS  81           HB2      LYS  81   6.487  21.197   3.947
  643    HB3  LYS  81           HB3      LYS  81   5.017  21.573   4.822
  644    HG2  LYS  81           HG2      LYS  81   6.829  19.171   5.131
  645    HG3  LYS  81           HG3      LYS  81   6.678  20.546   6.233
  646    HD2  LYS  81           HD2      LYS  81   4.230  19.810   6.612
  647    HD3  LYS  81           HD3      LYS  81   4.618  18.354   5.697
  648    HE2  LYS  81           HE2      LYS  81   4.819  17.750   7.989
  649    HE3  LYS  81           HE3      LYS  81   6.466  17.856   7.365
  650    HZ1  LYS  81           HZ1      LYS  81   6.225  18.909   9.542
  651    HZ2  LYS  81           HZ2      LYS  81   6.665  20.035   8.452
  652    HZ3  LYS  81           HZ3      LYS  81   5.113  19.959   8.986
  653    H    ARG  82           H        ARG  82   3.139  21.851   3.195
  654    HA   ARG  82           HA       ARG  82   1.108  20.929   4.943
  655    HB2  ARG  82           HB2      ARG  82  -0.145  22.879   4.196
  656    HB3  ARG  82           HB3      ARG  82   1.542  23.276   4.445
  657    HG2  ARG  82           HG2      ARG  82   1.642  22.747   1.751
  658    HG3  ARG  82           HG3      ARG  82  -0.062  23.156   1.898
  659    HD2  ARG  82           HD2      ARG  82   1.148  25.150   1.325
  660    HD3  ARG  82           HD3      ARG  82   0.616  25.312   3.010
  661    HE   ARG  82           HE       ARG  82   3.268  24.190   2.923
  662   HH11  ARG  82          HH11      ARG  82   1.599  27.276   2.334
  663   HH12  ARG  82          HH12      ARG  82   2.967  28.258   2.730
  664   HH21  ARG  82          HH21      ARG  82   5.099  25.510   3.462
  665   HH22  ARG  82          HH22      ARG  82   4.987  27.230   3.378
  666    H    LEU  83           H        LEU  83   1.736  19.890   1.751
  667    HA   LEU  83           HA       LEU  83  -1.047  18.970   1.338
  668    HB2  LEU  83           HB2      LEU  83  -0.002  20.567  -0.294
  669    HB3  LEU  83           HB3      LEU  83   1.225  19.353  -0.645
  670    HG   LEU  83           HG       LEU  83  -0.469  17.867  -1.620
  671   HD11  LEU  83          HD11      LEU  83  -2.816  18.707  -1.953
  672   HD12  LEU  83          HD12      LEU  83  -2.454  18.374  -0.262
  673   HD13  LEU  83          HD13      LEU  83  -2.462  20.053  -0.842
  674   HD21  LEU  83          HD21      LEU  83  -0.722  20.730  -2.632
  675   HD22  LEU  83          HD22      LEU  83   0.601  19.617  -3.011
  676   HD23  LEU  83          HD23      LEU  83  -1.045  19.253  -3.566
  677    H    VAL  84           H        VAL  84   2.002  17.806   2.459
  678    HA   VAL  84           HA       VAL  84   1.839  15.141   1.287
  679    HB   VAL  84           HB       VAL  84   3.294  16.305   3.706
  680   HG11  VAL  84          HG11      VAL  84   2.897  13.918   4.150
  681   HG12  VAL  84          HG12      VAL  84   3.538  13.499   2.554
  682   HG13  VAL  84          HG13      VAL  84   4.593  14.213   3.788
  683   HG21  VAL  84          HG21      VAL  84   4.169  17.076   1.509
  684   HG22  VAL  84          HG22      VAL  84   5.316  16.036   2.354
  685   HG23  VAL  84          HG23      VAL  84   4.360  15.383   1.008
  686    H    ARG  85           H        ARG  85   0.703  13.436   2.137
  687    HA   ARG  85           HA       ARG  85  -1.068  14.018   4.488
  688    HB2  ARG  85           HB2      ARG  85  -1.242  11.809   2.408
  689    HB3  ARG  85           HB3      ARG  85  -2.004  11.690   3.981
  690    HG2  ARG  85           HG2      ARG  85  -3.725  12.488   2.641
  691    HG3  ARG  85           HG3      ARG  85  -3.191  13.884   3.571
  692    HD2  ARG  85           HD2      ARG  85  -3.607  14.523   1.277
  693    HD3  ARG  85           HD3      ARG  85  -1.864  14.654   1.576
  694    HE   ARG  85           HE       ARG  85  -2.268  12.055   0.683
  695   HH11  ARG  85          HH21      ARG  85  -2.719  15.302  -0.664
  696   HH12  ARG  85          HH22      ARG  85  -2.846  14.786  -2.311
  697   HH21  ARG  85          HH11      ARG  85  -2.362  11.335  -1.530
  698   HH22  ARG  85          HH12      ARG  85  -2.641  12.462  -2.806
  699    H    TRP  86           H        TRP  86  -0.491  13.291   6.374
  700    HA   TRP  86           HA       TRP  86   1.679  11.286   6.635
  701    HB2  TRP  86           HB2      TRP  86   0.462  13.226   8.623
  702    HB3  TRP  86           HB3      TRP  86   1.868  12.198   8.904
  703    HD1  TRP  86           HD1      TRP  86   0.795  15.355   7.016
  704    HE1  TRP  86           HE1      TRP  86   2.800  16.594   6.073
  705    HE3  TRP  86           HE3      TRP  86   4.452  12.036   8.366
  706    HZ2  TRP  86           HZ2      TRP  86   5.678  16.129   5.811
  707    HZ3  TRP  86           HZ3      TRP  86   6.822  12.472   7.775
  708    HH2  TRP  86           HH2      TRP  86   7.439  14.505   6.485
  709    H    ASP  87           H        ASP  87  -1.548  11.201   6.190
  710    HA   ASP  87           HA       ASP  87  -2.194   9.331   8.427
  711    HB2  ASP  87           HB2      ASP  87  -3.568  11.364   8.169
  712    HB3  ASP  87           HB3      ASP  87  -3.971  10.884   6.520
  713    H    THR  88           H        THR  88  -1.327   9.336   5.067
  714    HA   THR  88           HA       THR  88  -3.125   7.303   4.155
  715    HB   THR  88           HB       THR  88  -1.233   7.291   2.303
  716    HG1  THR  88           HG1      THR  88   0.384   8.369   3.179
  717   HG21  THR  88          HG21      THR  88  -3.419   8.332   1.956
  718   HG22  THR  88          HG22      THR  88  -2.942   9.741   2.920
  719   HG23  THR  88          HG23      THR  88  -2.147   9.412   1.362
  720    H    LYS  89           H        LYS  89   0.076   7.269   5.578
  721    HA   LYS  89           HA       LYS  89   1.589   5.661   6.154
  722    HB2  LYS  89           HB2      LYS  89  -0.955   4.373   7.160
  723    HB3  LYS  89           HB3      LYS  89   0.695   3.916   7.618
  724    HG2  LYS  89           HG2      LYS  89   1.071   6.333   8.342
  725    HG3  LYS  89           HG3      LYS  89  -0.664   6.602   8.095
  726    HD2  LYS  89           HD2      LYS  89  -1.139   4.761   9.722
  727    HD3  LYS  89           HD3      LYS  89   0.617   4.596   9.994
  728    HE2  LYS  89           HE2      LYS  89   0.712   6.963  10.757
  729    HE3  LYS  89           HE3      LYS  89  -1.025   7.133  10.481
  730    HZ1  LYS  89           HZ1      LYS  89  -1.394   5.445  12.193
  731    HZ2  LYS  89           HZ2      LYS  89   0.221   5.291  12.450
  732    HZ3  LYS  89           HZ3      LYS  89  -0.540   6.694  12.803
  733    HA   PRO  90           HA       PRO  90   3.458   5.000   5.012
  734    HB2  PRO  90           HB2      PRO  90   3.715   5.165   2.016
  735    HB3  PRO  90           HB3      PRO  90   4.971   4.834   3.246
  736    HG2  PRO  90           HG2      PRO  90   3.905   2.793   1.825
  737    HG3  PRO  90           HG3      PRO  90   4.160   2.612   3.593
  738    HD2  PRO  90           HD2      PRO  90   1.588   3.300   2.138
  739    HD3  PRO  90           HD3      PRO  90   1.864   2.131   3.456
  740    H    VAL  91           H        VAL  91   4.139   7.153   4.974
  741    HA   VAL  91           HA       VAL  91   2.292   9.278   4.607
  742    HB   VAL  91           HB       VAL  91   5.348   9.262   4.648
  743   HG11  VAL  91          HG11      VAL  91   4.365  11.414   3.785
  744   HG12  VAL  91          HG12      VAL  91   3.499  11.585   5.322
  745   HG13  VAL  91          HG13      VAL  91   5.267  11.584   5.288
  746   HG21  VAL  91          HG21      VAL  91   4.480   8.262   6.716
  747   HG22  VAL  91          HG22      VAL  91   5.109   9.869   7.052
  748   HG23  VAL  91          HG23      VAL  91   3.354   9.614   6.934
  749    H    CYS  92           H        CYS  92   1.617  10.230   2.740
  750    HA   CYS  92           HA       CYS  92   2.766   9.163   0.218
  751    HB2  CYS  92           HB2      CYS  92   0.368   8.920   0.706
  752    HB3  CYS  92           HB3      CYS  92   0.200  10.687   0.793
  753    HG   CYS  92           HG       CYS  92   1.210   8.798  -1.763
  754    H    ILE  93           H        ILE  93   4.459  10.322  -0.438
  755    HA   ILE  93           HA       ILE  93   4.554  13.226   0.128
  756    HB   ILE  93           HB       ILE  93   7.012  12.992  -0.149
  757   HG12  ILE  93          HG12      ILE  93   8.027  10.740   0.139
  758   HG13  ILE  93          HG13      ILE  93   6.473   9.997  -0.219
  759   HG21  ILE  93          HG21      ILE  93   7.362  11.983   2.036
  760   HG22  ILE  93          HG22      ILE  93   5.882  12.939   2.053
  761   HG23  ILE  93          HG23      ILE  93   5.794  11.163   1.956
  762   HD11  ILE  93          HD11      ILE  93   8.161  10.039  -2.086
  763   HD12  ILE  93          HD12      ILE  93   6.595  10.703  -2.524
  764   HD13  ILE  93          HD13      ILE  93   7.962  11.796  -2.174
  765    H    GLY  94           H        GLY  94   3.976  11.202  -2.598
  766    HA2  GLY  94           HA2      GLY  94   4.015  13.441  -4.422
  767    HA3  GLY  94           HA3      GLY  94   5.493  12.482  -4.545
  768    H    GLN  95           H        GLN  95   4.094  12.585  -6.777
  769    HA   GLN  95           HA       GLN  95   2.495  10.061  -6.958
  770    HB2  GLN  95           HB2      GLN  95   2.431  12.690  -8.483
  771    HB3  GLN  95           HB3      GLN  95   1.881  11.207  -9.218
  772    HG2  GLN  95           HG2      GLN  95  -0.022  12.363  -8.477
  773    HG3  GLN  95           HG3      GLN  95   0.159  10.889  -7.546
  774   HE21  GLN  95          HE22      GLN  95  -1.458  12.052  -6.098
  775   HE22  GLN  95          HE21      GLN  95  -0.805  13.131  -4.880
  776    H    LYS  96           H        LYS  96   3.471   8.442  -8.110
  777    HA   LYS  96           HA       LYS  96   5.946   9.001  -9.721
  778    HB2  LYS  96           HB2      LYS  96   6.291   7.091  -8.320
  779    HB3  LYS  96           HB3      LYS  96   4.667   6.476  -8.559
  780    HG2  LYS  96           HG2      LYS  96   5.213   5.924 -10.941
  781    HG3  LYS  96           HG3      LYS  96   6.850   6.565 -10.704
  782    HD2  LYS  96           HD2      LYS  96   7.368   4.825  -9.126
  783    HD3  LYS  96           HD3      LYS  96   5.674   4.282  -9.086
  784    HE2  LYS  96           HE2      LYS  96   5.784   3.577 -11.446
  785    HE3  LYS  96           HE3      LYS  96   7.432   4.204 -11.591
  786    HZ1  LYS  96           HZ1      LYS  96   7.341   1.769 -11.204
  787    HZ2  LYS  96           HZ2      LYS  96   8.202   2.546 -10.048
  788    HZ3  LYS  96           HZ3      LYS  96   6.689   2.022  -9.709
  789    H    GLN  97           H        GLN  97   5.492   9.432 -11.934
  790    HA   GLN  97           HA       GLN  97   3.060   8.201 -13.028
  791    HB2  GLN  97           HB2      GLN  97   2.773  10.722 -14.111
  792    HB3  GLN  97           HB3      GLN  97   1.773   9.928 -12.935
  793    HG2  GLN  97           HG2      GLN  97   2.139  12.085 -12.103
  794    HG3  GLN  97           HG3      GLN  97   3.068  11.009 -11.086
  795   HE21  GLN  97          HE22      GLN  97   4.785  12.299 -10.374
  796   HE22  GLN  97          HE21      GLN  97   5.739  13.303 -11.463
  797    H    LYS  98           H        LYS  98   3.191   7.450 -14.962
  798    HA   LYS  98           HA       LYS  98   5.320   8.465 -16.815
  799    HB2  LYS  98           HB2      LYS  98   5.645   6.084 -16.395
  800    HB3  LYS  98           HB3      LYS  98   3.928   5.751 -16.677
  801    HG2  LYS  98           HG2      LYS  98   4.210   6.421 -19.061
  802    HG3  LYS  98           HG3      LYS  98   5.939   6.709 -18.768
  803    HD2  LYS  98           HD2      LYS  98   6.271   4.338 -18.191
  804    HD3  LYS  98           HD3      LYS  98   4.529   4.064 -18.218
  805    HE2  LYS  98           HE2      LYS  98   5.285   3.161 -20.263
  806    HE3  LYS  98           HE3      LYS  98   4.526   4.691 -20.680
  807    HZ1  LYS  98           HZ1      LYS  98   6.896   5.630 -20.684
  808    HZ2  LYS  98           HZ2      LYS  98   7.428   4.078 -20.589
  809    HZ3  LYS  98           HZ3      LYS  98   6.528   4.577 -21.872
  810    H    TRP  99           H        TRP  99   4.440   9.395 -18.712
  811    HA   TRP  99           HA       TRP  99   1.472   9.743 -18.616
  812    HB2  TRP  99           HB2      TRP  99   3.658  11.513 -19.727
  813    HB3  TRP  99           HB3      TRP  99   1.938  11.807 -19.884
  814    HD1  TRP  99           HD1      TRP  99   4.547  11.487 -16.997
  815    HE1  TRP  99           HE1      TRP  99   3.850  13.028 -15.099
  816    HE3  TRP  99           HE3      TRP  99   0.048  13.024 -18.834
  817    HZ2  TRP  99           HZ2      TRP  99   1.673  14.920 -14.555
  818    HZ3  TRP  99           HZ3      TRP  99  -1.253  14.773 -17.698
  819    HH2  TRP  99           HH2      TRP  99  -0.530  15.625 -15.474
  820    H    PHE 100           H        PHE 100   0.286   9.451 -20.492
  821    HA   PHE 100           HA       PHE 100   1.746   8.127 -22.751
  822    HB2  PHE 100           HB2      PHE 100  -0.905   7.451 -21.450
  823    HB3  PHE 100           HB3      PHE 100  -0.529   6.981 -23.104
  824    HD1  PHE 100           HD1      PHE 100   0.706   6.628 -19.566
  825    HD2  PHE 100           HD2      PHE 100   0.773   5.067 -23.592
  826    HE1  PHE 100           HE1      PHE 100   1.888   4.602 -18.770
  827    HE2  PHE 100           HE2      PHE 100   1.966   3.054 -22.787
  828    HZ   PHE 100           HZ       PHE 100   2.505   2.798 -20.380
  829    H    LEU 101           H        LEU 101   1.511   9.053 -24.634
  830    HA   LEU 101           HA       LEU 101  -0.173  11.467 -24.955
  831    HB2  LEU 101           HB2      LEU 101   2.274  11.350 -25.666
  832    HB3  LEU 101           HB3      LEU 101   1.791  10.178 -26.880
  833    HG   LEU 101           HG       LEU 101   1.029  13.107 -26.699
  834   HD11  LEU 101          HD11      LEU 101   2.333  11.437 -28.899
  835   HD12  LEU 101          HD12      LEU 101   2.126  13.205 -28.893
  836   HD13  LEU 101          HD13      LEU 101   3.224  12.432 -27.738
  837   HD21  LEU 101          HD21      LEU 101  -0.232  12.794 -28.835
  838   HD22  LEU 101          HD22      LEU 101  -0.158  11.036 -28.591
  839   HD23  LEU 101          HD23      LEU 101  -1.029  12.090 -27.453
  840    H    LEU 102           H        LEU 102  -2.220  10.832 -25.312
  841    HA   LEU 102           HA       LEU 102  -2.729   8.559 -27.162
  842    HB2  LEU 102           HB2      LEU 102  -4.379  10.045 -25.067
  843    HB3  LEU 102           HB3      LEU 102  -5.140   9.026 -26.286
  844    HG   LEU 102           HG       LEU 102  -3.081   8.080 -24.244
  845   HD11  LEU 102          HD11      LEU 102  -6.098   7.842 -24.470
  846   HD12  LEU 102          HD12      LEU 102  -5.114   6.837 -23.385
  847   HD13  LEU 102          HD13      LEU 102  -5.142   8.590 -23.186
  848   HD21  LEU 102          HD21      LEU 102  -4.144   5.802 -25.283
  849   HD22  LEU 102          HD22      LEU 102  -4.188   6.852 -26.743
  850   HD23  LEU 102          HD23      LEU 102  -2.671   6.580 -25.871
  851    H    GLN 103           H        GLN 103  -3.624   8.831 -29.068
  852    HA   GLN 103           HA       GLN 103  -4.467  11.612 -29.846
  853    HB2  GLN 103           HB2      GLN 103  -3.778   9.151 -31.504
  854    HB3  GLN 103           HB3      GLN 103  -4.632  10.544 -32.172
  855    HG2  GLN 103           HG2      GLN 103  -1.880  10.625 -30.860
  856    HG3  GLN 103           HG3      GLN 103  -2.190  10.651 -32.601
  857   HE21  GLN 103          HE22      GLN 103  -0.747  12.699 -31.020
  858   HE22  GLN 103          HE21      GLN 103  -1.711  14.171 -31.200
  859    H    LEU 104           H        LEU 104  -6.655  11.989 -29.996
  860    HA   LEU 104           HA       LEU 104  -8.462   9.964 -29.023
  861    HB2  LEU 104           HB2      LEU 104  -9.000  12.546 -30.564
  862    HB3  LEU 104           HB3      LEU 104 -10.305  11.486 -30.025
  863    HG   LEU 104           HG       LEU 104  -8.233  12.688 -28.234
  864   HD11  LEU 104          HD11      LEU 104 -11.083  13.607 -28.712
  865   HD12  LEU 104          HD12      LEU 104 -10.037  14.213 -27.420
  866   HD13  LEU 104          HD13      LEU 104  -9.587  14.451 -29.116
  867   HD21  LEU 104          HD21      LEU 104 -10.105  12.020 -26.452
  868   HD22  LEU 104          HD22      LEU 104 -10.486  10.794 -27.690
  869   HD23  LEU 104          HD23      LEU 104  -8.875  10.878 -26.983
  870    H    VAL 105           H        VAL 105  -9.743   8.484 -29.931
  871    HA   VAL 105           HA       VAL 105  -9.908   8.374 -32.910
  872    HB   VAL 105           HB       VAL 105 -10.037   6.090 -30.905
  873   HG11  VAL 105          HG11      VAL 105 -10.093   6.019 -33.939
  874   HG12  VAL 105          HG12      VAL 105  -9.966   4.608 -32.861
  875   HG13  VAL 105          HG13      VAL 105 -11.428   5.594 -32.835
  876   HG21  VAL 105          HG21      VAL 105  -7.854   6.788 -32.919
  877   HG22  VAL 105          HG22      VAL 105  -7.704   6.951 -31.158
  878   HG23  VAL 105          HG23      VAL 105  -7.906   5.354 -31.877
  879    H    SER 106           H        SER 106 -11.580   8.473 -29.773
  880    HA   SER 106           HA       SER 106 -14.164   8.755 -31.304
  881    HB2  SER 106           HB2      SER 106 -13.973   7.791 -28.451
  882    HB3  SER 106           HB3      SER 106 -15.400   7.846 -29.488
  883    HG   SER 106           HG       SER 106 -14.299   5.784 -29.194
  884    H    GLY 107           H        GLY 107 -12.664   9.684 -28.166
  885    HA2  GLY 107           HA2      GLY 107 -12.325  11.848 -27.315
  886    HA3  GLY 107           HA3      GLY 107 -12.801  12.463 -28.920
  887    H    ASP 108           H        ASP 108 -14.005  14.101 -28.060
  888    HA   ASP 108           HA       ASP 108 -15.764  14.354 -26.087
  889    HB2  ASP 108           HB2      ASP 108 -15.205  16.135 -27.594
  890    HB3  ASP 108           HB3      ASP 108 -15.929  15.295 -28.968
  891    H    ALA 109           H        ALA 109 -16.455  12.596 -29.106
  892    HA   ALA 109           HA       ALA 109 -19.259  12.481 -28.882
  893    HB1  ALA 109           HB1      ALA 109 -19.086  10.692 -30.571
  894    HB2  ALA 109           HB2      ALA 109 -17.999  12.034 -30.966
  895    HB3  ALA 109           HB3      ALA 109 -17.348  10.536 -30.251
  896    H    GLU 110           H        GLU 110 -16.798  10.585 -27.211
  897    HA   GLU 110           HA       GLU 110 -18.908   8.973 -25.940
  898    HB2  GLU 110           HB2      GLU 110 -16.297   7.898 -27.082
  899    HB3  GLU 110           HB3      GLU 110 -17.266   7.049 -25.875
  900    HG2  GLU 110           HG2      GLU 110 -19.260   7.318 -27.501
  901    HG3  GLU 110           HG3      GLU 110 -18.052   7.751 -28.716
  902    H    ILE 111           H        ILE 111 -16.293  11.120 -25.453
  903    HA   ILE 111           HA       ILE 111 -15.364  10.193 -22.905
  904    HB   ILE 111           HB       ILE 111 -15.517  12.898 -24.219
  905   HG12  ILE 111          HG12      ILE 111 -13.200  11.184 -23.272
  906   HG13  ILE 111          HG13      ILE 111 -13.772  11.309 -24.927
  907   HG21  ILE 111          HG21      ILE 111 -14.343  13.930 -22.301
  908   HG22  ILE 111          HG22      ILE 111 -15.888  13.310 -21.775
  909   HG23  ILE 111          HG23      ILE 111 -14.411  12.399 -21.402
  910   HD11  ILE 111          HD11      ILE 111 -11.836  12.658 -24.790
  911   HD12  ILE 111          HD12      ILE 111 -13.224  13.766 -24.872
  912   HD13  ILE 111          HD13      ILE 111 -12.395  13.459 -23.320
  913    H    ASN 112           H        ASN 112 -16.238  10.303 -20.954
  914    HA   ASN 112           HA       ASN 112 -19.028  11.354 -20.635
  915    HB2  ASN 112           HB2      ASN 112 -19.171   8.998 -21.349
  916    HB3  ASN 112           HB3      ASN 112 -18.070   8.517 -20.059
  917   HD21  ASN 112          HD22      ASN 112 -19.234   7.529 -18.394
  918   HD22  ASN 112          HD21      ASN 112 -20.825   8.046 -17.868
  919    H    MET 113           H        MET 113 -16.037  10.232 -19.187
  920    HA   MET 113           HA       MET 113 -14.922  10.581 -17.330
  921    HB2  MET 113           HB2      MET 113 -16.808  12.908 -16.813
  922    HB3  MET 113           HB3      MET 113 -15.317  12.540 -15.938
  923    HG2  MET 113           HG2      MET 113 -13.997  12.792 -17.922
  924    HG3  MET 113           HG3      MET 113 -15.423  13.050 -18.940
  925    HE1  MET 113           HE1      MET 113 -13.182  16.323 -18.740
  926    HE2  MET 113           HE2      MET 113 -12.514  14.757 -18.222
  927    HE3  MET 113           HE3      MET 113 -13.520  14.858 -19.688
  928    H    GLN 114           H        GLN 114 -18.434  10.708 -16.607
  929    HA   GLN 114           HA       GLN 114 -17.907   9.664 -13.946
  930    HB2  GLN 114           HB2      GLN 114 -20.447  10.497 -15.384
  931    HB3  GLN 114           HB3      GLN 114 -20.398   9.979 -13.682
  932    HG2  GLN 114           HG2      GLN 114 -18.692  11.866 -13.303
  933    HG3  GLN 114           HG3      GLN 114 -19.183  12.489 -14.887
  934   HE21  GLN 114          HE22      GLN 114 -21.884  12.329 -15.024
  935   HE22  GLN 114          HE21      GLN 114 -22.660  13.092 -13.655
  936    H    THR 115           H        THR 115 -17.485   7.979 -16.368
  937    HA   THR 115           HA       THR 115 -19.230   5.726 -16.172
  938    HB   THR 115           HB       THR 115 -16.309   5.597 -16.985
  939    HG1  THR 115           HG1      THR 115 -17.230   6.271 -19.103
  940   HG21  THR 115          HG21      THR 115 -18.823   4.336 -18.181
  941   HG22  THR 115          HG22      THR 115 -17.140   4.033 -18.678
  942   HG23  THR 115          HG23      THR 115 -17.704   3.500 -17.087
  943    H    SER 116           H        SER 116 -16.311   6.763 -14.356
  944    HA   SER 116           HA       SER 116 -16.258   4.408 -12.685
  945    HB2  SER 116           HB2      SER 116 -14.937   7.074 -12.150
  946    HB3  SER 116           HB3      SER 116 -14.379   5.457 -11.680
  947    HG   SER 116           HG       SER 116 -14.042   5.029 -13.928
  948    H    SER 117           H        SER 117 -18.560   6.741 -12.733
  949    HA   SER 117           HA       SER 117 -20.048   7.700 -11.430
  950    HB2  SER 117           HB2      SER 117 -19.300   5.634  -9.332
  951    HB3  SER 117           HB3      SER 117 -20.830   6.514  -9.475
  952    HG   SER 117           HG       SER 117 -20.962   4.397 -10.391
  953    H    THR 118           H        THR 118 -16.983   7.323  -9.653
  954    HA   THR 118           HA       THR 118 -17.258  10.145  -8.785
  955    HB   THR 118           HB       THR 118 -17.853   8.837  -6.908
  956    HG1  THR 118           HG1      THR 118 -16.441   9.691  -5.455
  957   HG21  THR 118          HG21      THR 118 -16.405   7.251  -5.745
  958   HG22  THR 118          HG22      THR 118 -16.819   6.658  -7.350
  959   HG23  THR 118          HG23      THR 118 -15.208   7.334  -7.046
  960    HA   PRO 119           HA       PRO 119 -13.400   9.358 -11.283
  961    HB2  PRO 119           HB2      PRO 119 -13.822  11.042 -13.341
  962    HB3  PRO 119           HB3      PRO 119 -14.763   9.532 -13.200
  963    HG2  PRO 119           HG2      PRO 119 -15.578  12.305 -12.206
  964    HG3  PRO 119           HG3      PRO 119 -16.454  11.280 -13.377
  965    HD2  PRO 119           HD2      PRO 119 -17.011  11.221 -10.699
  966    HD3  PRO 119           HD3      PRO 119 -17.064   9.728 -11.685
  967    H    GLU 120           H        GLU 120 -12.027  11.517 -12.259
  968    HA   GLU 120           HA       GLU 120 -12.028  13.553 -10.071
  969    HB2  GLU 120           HB2      GLU 120  -9.846  12.740 -12.019
  970    HB3  GLU 120           HB3      GLU 120  -9.803  14.198 -11.025
  971    HG2  GLU 120           HG2      GLU 120 -10.358  12.549  -9.036
  972    HG3  GLU 120           HG3      GLU 120  -9.679  11.331 -10.118
  973    H    PHE 121           H        PHE 121 -13.431  13.258 -13.172
  974    HA   PHE 121           HA       PHE 121 -13.175  16.200 -13.504
  975    HB2  PHE 121           HB2      PHE 121 -12.687  14.147 -15.662
  976    HB3  PHE 121           HB3      PHE 121 -12.816  15.890 -15.891
  977    HD1  PHE 121           HD1      PHE 121 -11.181  17.456 -14.813
  978    HD2  PHE 121           HD2      PHE 121 -10.583  13.195 -14.873
  979    HE1  PHE 121           HE1      PHE 121  -8.773  17.796 -14.407
  980    HE2  PHE 121           HE2      PHE 121  -8.166  13.529 -14.380
  981    HZ   PHE 121           HZ       PHE 121  -7.252  15.831 -14.158
  982    H    ASP 122           H        ASP 122 -14.697  17.194 -14.786
  983    HA   ASP 122           HA       ASP 122 -17.368  15.841 -14.825
  984    HB2  ASP 122           HB2      ASP 122 -17.191  17.075 -12.805
  985    HB3  ASP 122           HB3      ASP 122 -16.434  18.455 -13.607
  986    H    GLY 123           H        GLY 123 -15.160  18.138 -16.437
  987    HA2  GLY 123           HA2      GLY 123 -16.858  18.094 -18.806
  988    HA3  GLY 123           HA3      GLY 123 -16.663  19.696 -18.068
  989    H    TRP 124           H        TRP 124 -15.688  18.705 -20.668
  990    HA   TRP 124           HA       TRP 124 -12.749  19.039 -20.307
  991    HB2  TRP 124           HB2      TRP 124 -12.562  17.702 -22.382
  992    HB3  TRP 124           HB3      TRP 124 -13.153  16.799 -21.009
  993    HD1  TRP 124           HD1      TRP 124 -14.041  17.736 -24.522
  994    HE1  TRP 124           HE1      TRP 124 -16.321  16.780 -25.212
  995    HE3  TRP 124           HE3      TRP 124 -15.705  16.161 -19.947
  996    HZ2  TRP 124           HZ2      TRP 124 -18.456  15.280 -23.987
  997    HZ3  TRP 124           HZ3      TRP 124 -17.876  14.995 -19.728
  998    HH2  TRP 124           HH2      TRP 124 -19.259  14.534 -21.746
  999    H    ARG 125           H        ARG 125 -11.682  20.385 -21.701
 1000    HA   ARG 125           HA       ARG 125 -12.984  21.455 -24.094
 1001    HB2  ARG 125           HB2      ARG 125 -13.694  23.081 -22.341
 1002    HB3  ARG 125           HB3      ARG 125 -12.004  23.331 -21.884
 1003    HG2  ARG 125           HG2      ARG 125 -11.530  24.256 -24.146
 1004    HG3  ARG 125           HG3      ARG 125 -13.215  23.953 -24.618
 1005    HD2  ARG 125           HD2      ARG 125 -13.982  25.493 -22.834
 1006    HD3  ARG 125           HD3      ARG 125 -12.289  25.795 -22.369
 1007    HE   ARG 125           HE       ARG 125 -12.558  26.325 -25.137
 1008   HH11  ARG 125          HH21      ARG 125 -13.671  27.725 -22.059
 1009   HH12  ARG 125          HH22      ARG 125 -13.800  29.332 -22.679
 1010   HH21  ARG 125          HH11      ARG 125 -12.754  28.463 -25.966
 1011   HH22  ARG 125          HH12      ARG 125 -13.272  29.757 -24.949
 1012    H    TRP 126           H        TRP 126 -11.348  21.325 -25.703
 1013    HA   TRP 126           HA       TRP 126  -8.631  20.830 -24.789
 1014    HB2  TRP 126           HB2      TRP 126  -9.512  21.236 -27.644
 1015    HB3  TRP 126           HB3      TRP 126  -8.129  20.322 -27.041
 1016    HD1  TRP 126           HD1      TRP 126 -11.129  19.576 -28.665
 1017    HE1  TRP 126           HE1      TRP 126 -12.395  17.507 -27.895
 1018    HE3  TRP 126           HE3      TRP 126  -8.727  18.778 -24.206
 1019    HZ2  TRP 126           HZ2      TRP 126 -12.457  15.784 -25.578
 1020    HZ3  TRP 126           HZ3      TRP 126  -9.555  17.031 -22.656
 1021    HH2  TRP 126           HH2      TRP 126 -11.412  15.539 -23.319
 1022    H    VAL 127           H        VAL 127  -6.809  22.146 -25.085
 1023    HA   VAL 127           HA       VAL 127  -7.287  24.996 -25.718
 1024    HB   VAL 127           HB       VAL 127  -7.961  24.500 -23.376
 1025   HG11  VAL 127          HG11      VAL 127  -5.042  23.795 -22.896
 1026   HG12  VAL 127          HG12      VAL 127  -6.304  23.993 -21.656
 1027   HG13  VAL 127          HG13      VAL 127  -6.417  22.677 -22.829
 1028   HG21  VAL 127          HG21      VAL 127  -6.916  26.348 -22.325
 1029   HG22  VAL 127          HG22      VAL 127  -5.534  26.311 -23.425
 1030   HG23  VAL 127          HG23      VAL 127  -7.152  26.747 -24.029
 1031    H    SER 128           H        SER 128  -5.131  26.240 -25.545
 1032    HA   SER 128           HA       SER 128  -3.346  25.316 -27.371
 1033    HB2  SER 128           HB2      SER 128  -2.588  27.148 -25.070
 1034    HB3  SER 128           HB3      SER 128  -1.914  27.128 -26.709
 1035    HG   SER 128           HG       SER 128  -3.495  28.799 -26.472
 1036    H    TYR 129           H        TYR 129  -1.304  24.408 -27.372
 1037    HA   TYR 129           HA       TYR 129  -1.129  22.069 -25.983
 1038    HB2  TYR 129           HB2      TYR 129  -0.120  22.686 -28.161
 1039    HB3  TYR 129           HB3      TYR 129   1.151  23.578 -27.311
 1040    HD1  TYR 129           HD1      TYR 129  -0.304  20.237 -28.022
 1041    HD2  TYR 129           HD2      TYR 129   2.945  22.392 -26.180
 1042    HE1  TYR 129           HE1      TYR 129   0.853  18.092 -27.521
 1043    HE2  TYR 129           HE2      TYR 129   4.153  20.278 -25.806
 1044    HH   TYR 129           HH       TYR 129   4.011  17.971 -25.861
 1045    H    TRP 130           H        TRP 130   0.548  25.101 -25.007
 1046    HA   TRP 130           HA       TRP 130   1.818  23.638 -22.769
 1047    HB2  TRP 130           HB2      TRP 130   2.141  26.528 -23.611
 1048    HB3  TRP 130           HB3      TRP 130   3.135  25.638 -22.461
 1049    HD1  TRP 130           HD1      TRP 130   2.585  26.166 -26.161
 1050    HE1  TRP 130           HE1      TRP 130   4.274  24.902 -27.552
 1051    HE3  TRP 130           HE3      TRP 130   4.879  23.561 -22.394
 1052    HZ2  TRP 130           HZ2      TRP 130   6.407  22.931 -27.093
 1053    HZ3  TRP 130           HZ3      TRP 130   6.768  22.022 -22.899
 1054    HH2  TRP 130           HH2      TRP 130   7.508  21.669 -25.234
 1055    H    TYR 131           H        TYR 131  -1.207  25.055 -23.115
 1056    HA   TYR 131           HA       TYR 131  -1.209  26.939 -21.011
 1057    HB2  TYR 131           HB2      TYR 131  -2.842  26.914 -22.789
 1058    HB3  TYR 131           HB3      TYR 131  -3.504  25.395 -22.245
 1059    HD1  TYR 131           HD2      TYR 131  -3.236  29.010 -21.545
 1060    HD2  TYR 131           HD1      TYR 131  -4.971  25.266 -20.273
 1061    HE1  TYR 131           HE2      TYR 131  -4.892  30.247 -20.188
 1062    HE2  TYR 131           HE1      TYR 131  -6.677  26.497 -18.975
 1063    HH   TYR 131           HH       TYR 131  -6.770  30.093 -18.795
 1064    HA   PRO 132           HA       PRO 132  -2.835  23.460 -18.058
 1065    HB2  PRO 132           HB2      PRO 132  -1.210  21.191 -19.215
 1066    HB3  PRO 132           HB3      PRO 132  -2.715  21.100 -18.277
 1067    HG2  PRO 132           HG2      PRO 132  -2.841  20.849 -20.935
 1068    HG3  PRO 132           HG3      PRO 132  -4.001  21.952 -20.131
 1069    HD2  PRO 132           HD2      PRO 132  -1.419  22.678 -21.541
 1070    HD3  PRO 132           HD3      PRO 132  -3.030  23.428 -21.689
 1071    H    VAL 133           H        VAL 133   0.467  23.496 -19.481
 1072    HA   VAL 133           HA       VAL 133   1.826  22.989 -16.958
 1073    HB   VAL 133           HB       VAL 133   2.855  24.247 -19.550
 1074   HG11  VAL 133          HG11      VAL 133   4.373  23.135 -17.156
 1075   HG12  VAL 133          HG12      VAL 133   5.100  23.613 -18.711
 1076   HG13  VAL 133          HG13      VAL 133   4.340  24.835 -17.698
 1077   HG21  VAL 133          HG21      VAL 133   3.845  22.018 -19.912
 1078   HG22  VAL 133          HG22      VAL 133   2.995  21.403 -18.478
 1079   HG23  VAL 133          HG23      VAL 133   2.074  21.972 -19.878
 1080    H    ARG 134           H        ARG 134   0.903  25.933 -18.863
 1081    HA   ARG 134           HA       ARG 134   2.049  27.693 -16.888
 1082    HB2  ARG 134           HB2      ARG 134  -0.299  28.198 -18.808
 1083    HB3  ARG 134           HB3      ARG 134   0.564  29.441 -17.927
 1084    HG2  ARG 134           HG2      ARG 134   1.710  27.711 -20.164
 1085    HG3  ARG 134           HG3      ARG 134   1.238  29.403 -20.247
 1086    HD2  ARG 134           HD2      ARG 134   3.424  29.833 -19.877
 1087    HD3  ARG 134           HD3      ARG 134   3.019  29.575 -18.200
 1088    HE   ARG 134           HE       ARG 134   4.171  27.554 -18.198
 1089   HH11  ARG 134          HH11      ARG 134   3.839  28.653 -21.568
 1090   HH12  ARG 134          HH12      ARG 134   5.147  27.698 -22.164
 1091   HH21  ARG 134          HH21      ARG 134   6.036  26.402 -18.984
 1092   HH22  ARG 134          HH22      ARG 134   6.382  26.368 -20.675
 1093    H    GLN 135           H        GLN 135  -1.071  25.966 -17.053
 1094    HA   GLN 135           HA       GLN 135  -2.235  27.704 -15.022
 1095    HB2  GLN 135           HB2      GLN 135  -3.117  25.064 -16.244
 1096    HB3  GLN 135           HB3      GLN 135  -4.012  25.878 -14.960
 1097    HG2  GLN 135           HG2      GLN 135  -3.443  27.055 -17.706
 1098    HG3  GLN 135           HG3      GLN 135  -4.964  26.377 -17.138
 1099   HE21  GLN 135          HE22      GLN 135  -6.064  27.529 -15.254
 1100   HE22  GLN 135          HE21      GLN 135  -5.799  29.246 -15.081
 1101    H    VAL 136           H        VAL 136  -0.410  24.642 -14.890
 1102    HA   VAL 136           HA       VAL 136  -1.469  23.953 -12.346
 1103    HB   VAL 136           HB       VAL 136  -0.497  22.466 -14.183
 1104   HG11  VAL 136          HG11      VAL 136   2.085  23.111 -12.736
 1105   HG12  VAL 136          HG12      VAL 136   1.865  21.744 -13.827
 1106   HG13  VAL 136          HG13      VAL 136   1.712  23.408 -14.441
 1107   HG21  VAL 136          HG21      VAL 136  -1.359  21.619 -12.073
 1108   HG22  VAL 136          HG22      VAL 136   0.013  20.671 -12.668
 1109   HG23  VAL 136          HG23      VAL 136   0.243  21.811 -11.324
 1110    H    VAL 137           H        VAL 137  -0.344  23.732 -10.313
 1111    HA   VAL 137           HA       VAL 137   0.890  26.028  -9.295
 1112    HB   VAL 137           HB       VAL 137   1.603  24.396  -7.427
 1113   HG11  VAL 137          HG11      VAL 137  -1.355  24.610  -8.176
 1114   HG12  VAL 137          HG12      VAL 137  -0.707  24.267  -6.559
 1115   HG13  VAL 137          HG13      VAL 137  -0.407  25.840  -7.311
 1116   HG21  VAL 137          HG21      VAL 137   0.528  22.235  -7.306
 1117   HG22  VAL 137          HG22      VAL 137  -0.249  22.443  -8.875
 1118   HG23  VAL 137          HG23      VAL 137   1.525  22.287  -8.767
 1119    H    SER 138           H        SER 138   2.996  26.531  -8.621
 1120    HA   SER 138           HA       SER 138   4.875  26.285 -10.593
 1121    HB2  SER 138           HB2      SER 138   5.357  26.943  -7.667
 1122    HB3  SER 138           HB3      SER 138   6.292  27.528  -9.058
 1123    HG   SER 138           HG       SER 138   4.560  28.962  -8.154
 1124    H    PHE 139           H        PHE 139   4.678  24.192  -7.655
 1125    HA   PHE 139           HA       PHE 139   7.287  23.086  -8.163
 1126    HB2  PHE 139           HB2      PHE 139   6.924  21.624  -6.395
 1127    HB3  PHE 139           HB3      PHE 139   6.182  23.138  -5.940
 1128    HD1  PHE 139           HD2      PHE 139   5.644  19.598  -6.763
 1129    HD2  PHE 139           HD1      PHE 139   3.704  23.289  -5.659
 1130    HE1  PHE 139           HE2      PHE 139   3.610  18.344  -6.160
 1131    HE2  PHE 139           HE1      PHE 139   1.657  22.028  -5.057
 1132    HZ   PHE 139           HZ       PHE 139   1.598  19.554  -5.287
 1133    H    LYS 140           H        LYS 140   4.073  22.288  -9.419
 1134    HA   LYS 140           HA       LYS 140   5.119  19.822 -10.706
 1135    HB2  LYS 140           HB2      LYS 140   2.352  21.066 -10.865
 1136    HB3  LYS 140           HB3      LYS 140   2.855  19.524 -11.574
 1137    HG2  LYS 140           HG2      LYS 140   3.498  18.758  -9.223
 1138    HG3  LYS 140           HG3      LYS 140   2.718  20.227  -8.617
 1139    HD2  LYS 140           HD2      LYS 140   0.598  19.466  -9.866
 1140    HD3  LYS 140           HD3      LYS 140   1.439  17.928 -10.161
 1141    HE2  LYS 140           HE2      LYS 140   1.832  17.840  -7.607
 1142    HE3  LYS 140           HE3      LYS 140   0.703  19.196  -7.480
 1143    HZ1  LYS 140           HZ1      LYS 140  -0.970  17.733  -8.597
 1144    HZ2  LYS 140           HZ2      LYS 140   0.084  16.467  -8.527
 1145    HZ3  LYS 140           HZ3      LYS 140  -0.494  17.137  -7.147
 1146    H    ARG 141           H        ARG 141   4.239  23.161 -11.607
 1147    HA   ARG 141           HA       ARG 141   4.081  23.083 -14.347
 1148    HB2  ARG 141           HB2      ARG 141   3.880  25.050 -12.880
 1149    HB3  ARG 141           HB3      ARG 141   5.634  25.142 -12.713
 1150    HG2  ARG 141           HG2      ARG 141   5.931  25.874 -14.931
 1151    HG3  ARG 141           HG3      ARG 141   4.432  25.125 -15.472
 1152    HD2  ARG 141           HD2      ARG 141   4.131  27.520 -15.490
 1153    HD3  ARG 141           HD3      ARG 141   3.100  26.828 -14.247
 1154    HE   ARG 141           HE       ARG 141   5.683  28.286 -13.849
 1155   HH11  ARG 141          HH11      ARG 141   2.545  27.227 -12.403
 1156   HH12  ARG 141          HH12      ARG 141   2.797  28.189 -10.987
 1157   HH21  ARG 141          HH21      ARG 141   5.926  29.499 -11.931
 1158   HH22  ARG 141          HH22      ARG 141   4.780  29.317 -10.642
 1159    H    ASP 142           H        ASP 142   7.231  23.028 -12.596
 1160    HA   ASP 142           HA       ASP 142   8.791  23.157 -14.982
 1161    HB2  ASP 142           HB2      ASP 142   9.673  23.785 -12.794
 1162    HB3  ASP 142           HB3      ASP 142   9.515  22.117 -12.218
 1163    H    VAL 143           H        VAL 143   7.484  20.355 -13.200
 1164    HA   VAL 143           HA       VAL 143   8.976  18.512 -14.923
 1165    HB   VAL 143           HB       VAL 143   8.881  17.879 -12.687
 1166   HG11  VAL 143          HG11      VAL 143   5.840  17.964 -12.768
 1167   HG12  VAL 143          HG12      VAL 143   6.846  17.343 -11.447
 1168   HG13  VAL 143          HG13      VAL 143   6.937  19.039 -11.849
 1169   HG21  VAL 143          HG21      VAL 143   7.994  15.631 -12.785
 1170   HG22  VAL 143          HG22      VAL 143   6.958  16.040 -14.175
 1171   HG23  VAL 143          HG23      VAL 143   8.729  16.049 -14.340
 1172    H    TYR 144           H        TYR 144   5.652  19.825 -14.699
 1173    HA   TYR 144           HA       TYR 144   4.553  18.064 -16.621
 1174    HB2  TYR 144           HB2      TYR 144   3.372  19.613 -14.970
 1175    HB3  TYR 144           HB3      TYR 144   3.638  20.914 -16.103
 1176    HD1  TYR 144           HD2      TYR 144   2.870  17.717 -17.824
 1177    HD2  TYR 144           HD1      TYR 144   1.091  21.064 -15.735
 1178    HE1  TYR 144           HE2      TYR 144   0.683  17.044 -18.617
 1179    HE2  TYR 144           HE1      TYR 144  -1.110  20.423 -16.599
 1180    HH   TYR 144           HH       TYR 144  -1.597  17.650 -18.844
 1181    H    ARG 145           H        ARG 145   6.386  21.166 -17.021
 1182    HA   ARG 145           HA       ARG 145   6.217  21.498 -19.751
 1183    HB2  ARG 145           HB2      ARG 145   7.474  22.802 -17.845
 1184    HB3  ARG 145           HB3      ARG 145   8.824  21.690 -18.152
 1185    HG2  ARG 145           HG2      ARG 145   8.723  22.386 -20.570
 1186    HG3  ARG 145           HG3      ARG 145   7.420  23.499 -20.124
 1187    HD2  ARG 145           HD2      ARG 145   9.524  24.730 -20.331
 1188    HD3  ARG 145           HD3      ARG 145   8.987  24.752 -18.659
 1189    HE   ARG 145           HE       ARG 145  11.182  23.090 -19.847
 1190   HH11  ARG 145          HH11      ARG 145   9.857  24.686 -16.940
 1191   HH12  ARG 145          HH12      ARG 145  11.101  24.034 -15.892
 1192   HH21  ARG 145          HH21      ARG 145  12.925  22.486 -18.468
 1193   HH22  ARG 145          HH22      ARG 145  12.909  22.939 -16.798
 1194    H    ARG 146           H        ARG 146   8.168  19.017 -17.995
 1195    HA   ARG 146           HA       ARG 146   9.665  18.200 -20.322
 1196    HB2  ARG 146           HB2      ARG 146   8.985  16.302 -18.045
 1197    HB3  ARG 146           HB3      ARG 146  10.400  16.315 -19.088
 1198    HG2  ARG 146           HG2      ARG 146   9.723  18.209 -16.831
 1199    HG3  ARG 146           HG3      ARG 146  10.990  17.005 -16.840
 1200    HD2  ARG 146           HD2      ARG 146  12.254  18.312 -18.481
 1201    HD3  ARG 146           HD3      ARG 146  10.939  19.488 -18.614
 1202    HE   ARG 146           HE       ARG 146  11.200  20.000 -16.214
 1203   HH11  ARG 146          HH11      ARG 146  14.038  18.667 -17.932
 1204   HH12  ARG 146          HH12      ARG 146  15.179  19.256 -16.777
 1205   HH21  ARG 146          HH21      ARG 146  12.722  20.714 -14.647
 1206   HH22  ARG 146          HH22      ARG 146  14.417  20.460 -14.897
 1207    H    VAL 147           H        VAL 147   6.621  16.952 -18.826
 1208    HA   VAL 147           HA       VAL 147   6.095  14.861 -20.624
 1209    HB   VAL 147           HB       VAL 147   4.064  16.778 -19.397
 1210   HG11  VAL 147          HG11      VAL 147   3.048  15.315 -21.078
 1211   HG12  VAL 147          HG12      VAL 147   3.777  13.892 -20.306
 1212   HG13  VAL 147          HG13      VAL 147   2.532  14.843 -19.459
 1213   HG21  VAL 147          HG21      VAL 147   5.157  14.194 -18.228
 1214   HG22  VAL 147          HG22      VAL 147   5.562  15.814 -17.609
 1215   HG23  VAL 147          HG23      VAL 147   3.908  15.227 -17.507
 1216    H    MET 148           H        MET 148   5.116  18.350 -20.875
 1217    HA   MET 148           HA       MET 148   3.840  18.016 -23.370
 1218    HB2  MET 148           HB2      MET 148   5.141  20.483 -22.171
 1219    HB3  MET 148           HB3      MET 148   4.123  20.493 -23.609
 1220    HG2  MET 148           HG2      MET 148   3.302  19.819 -20.784
 1221    HG3  MET 148           HG3      MET 148   2.875  21.226 -21.773
 1222    HE1  MET 148           HE1      MET 148  -0.620  19.860 -21.246
 1223    HE2  MET 148           HE2      MET 148   0.717  20.055 -20.097
 1224    HE3  MET 148           HE3      MET 148   0.400  21.304 -21.309
 1225    H    LYS 149           H        LYS 149   7.242  19.011 -22.609
 1226    HA   LYS 149           HA       LYS 149   8.110  19.510 -25.244
 1227    HB2  LYS 149           HB2      LYS 149   9.411  20.229 -23.396
 1228    HB3  LYS 149           HB3      LYS 149   9.519  18.628 -22.691
 1229    HG2  LYS 149           HG2      LYS 149  10.753  19.026 -25.413
 1230    HG3  LYS 149           HG3      LYS 149  11.536  19.772 -24.023
 1231    HD2  LYS 149           HD2      LYS 149  11.806  17.646 -22.890
 1232    HD3  LYS 149           HD3      LYS 149  10.887  16.783 -24.126
 1233    HE2  LYS 149           HE2      LYS 149  12.549  17.340 -25.841
 1234    HE3  LYS 149           HE3      LYS 149  13.486  18.285 -24.678
 1235    HZ1  LYS 149           HZ1      LYS 149  13.970  16.292 -23.460
 1236    HZ2  LYS 149           HZ2      LYS 149  12.930  15.370 -24.332
 1237    HZ3  LYS 149           HZ3      LYS 149  14.302  15.973 -25.028
 1238    H    GLU 150           H        GLU 150   8.057  16.428 -23.435
 1239    HA   GLU 150           HA       GLU 150   9.529  14.924 -25.360
 1240    HB2  GLU 150           HB2      GLU 150   7.543  14.161 -23.188
 1241    HB3  GLU 150           HB3      GLU 150   8.359  12.950 -24.162
 1242    HG2  GLU 150           HG2      GLU 150   9.905  15.053 -22.585
 1243    HG3  GLU 150           HG3      GLU 150   9.386  13.529 -21.882
 1244    H    PHE 151           H        PHE 151   6.147  15.884 -25.285
 1245    HA   PHE 151           HA       PHE 151   5.480  14.058 -27.540
 1246    HB2  PHE 151           HB2      PHE 151   3.777  15.575 -25.541
 1247    HB3  PHE 151           HB3      PHE 151   3.140  14.556 -26.807
 1248    HD1  PHE 151           HD2      PHE 151   5.518  12.343 -26.241
 1249    HD2  PHE 151           HD1      PHE 151   2.561  14.393 -23.844
 1250    HE1  PHE 151           HE2      PHE 151   5.607  10.539 -24.600
 1251    HE2  PHE 151           HE1      PHE 151   2.619  12.520 -22.215
 1252    HZ   PHE 151           HZ       PHE 151   4.138  10.612 -22.567
 1253    H    ALA 152           H        ALA 152   6.283  17.345 -27.094
 1254    HA   ALA 152           HA       ALA 152   4.365  18.748 -28.424
 1255    HB1  ALA 152           HB1      ALA 152   7.375  19.223 -28.504
 1256    HB2  ALA 152           HB2      ALA 152   6.136  20.419 -28.928
 1257    HB3  ALA 152           HB3      ALA 152   6.237  19.806 -27.268
 1258    H    SER 153           H        SER 153   7.360  17.734 -30.202
 1259    HA   SER 153           HA       SER 153   6.290  18.345 -32.707
 1260    HB2  SER 153           HB2      SER 153   8.351  16.181 -32.185
 1261    HB3  SER 153           HB3      SER 153   8.192  17.236 -33.602
 1262    HG   SER 153           HG       SER 153   9.860  17.962 -32.178
 1263    H    VAL 154           H        VAL 154   5.488  15.604 -30.687
 1264    HA   VAL 154           HA       VAL 154   4.963  13.781 -32.918
 1265    HB   VAL 154           HB       VAL 154   4.257  13.503 -29.973
 1266   HG11  VAL 154          HG11      VAL 154   4.541  11.429 -32.198
 1267   HG12  VAL 154          HG12      VAL 154   4.252  11.062 -30.487
 1268   HG13  VAL 154          HG13      VAL 154   3.027  11.930 -31.421
 1269   HG21  VAL 154          HG21      VAL 154   6.302  12.089 -29.792
 1270   HG22  VAL 154          HG22      VAL 154   6.763  12.578 -31.441
 1271   HG23  VAL 154          HG23      VAL 154   6.689  13.773 -30.127
 1272    H    VAL 155           H        VAL 155   3.141  15.974 -30.758
 1273    HA   VAL 155           HA       VAL 155   0.611  15.331 -32.099
 1274    HB   VAL 155           HB       VAL 155   1.350  17.629 -30.248
 1275   HG11  VAL 155          HG11      VAL 155  -1.391  16.484 -31.057
 1276   HG12  VAL 155          HG12      VAL 155  -1.115  17.746 -29.836
 1277   HG13  VAL 155          HG13      VAL 155  -0.722  18.063 -31.527
 1278   HG21  VAL 155          HG21      VAL 155   0.093  14.914 -29.641
 1279   HG22  VAL 155          HG22      VAL 155   1.664  15.513 -29.050
 1280   HG23  VAL 155          HG23      VAL 155   0.174  16.260 -28.502
 1281    H    MET 156           H        MET 156   3.040  18.018 -32.154
 1282    HA   MET 156           HA       MET 156   1.529  19.627 -33.924
 1283    HB2  MET 156           HB2      MET 156   4.492  19.581 -33.289
 1284    HB3  MET 156           HB3      MET 156   3.698  20.860 -34.220
 1285    HG2  MET 156           HG2      MET 156   2.288  21.477 -32.373
 1286    HG3  MET 156           HG3      MET 156   2.745  20.055 -31.446
 1287    HE1  MET 156           HE1      MET 156   2.683  22.626 -29.897
 1288    HE2  MET 156           HE2      MET 156   3.331  21.098 -29.262
 1289    HE3  MET 156           HE3      MET 156   4.257  22.599 -29.067
 1290    H    SER 157           H        SER 157   3.583  16.857 -34.744
 1291    HA   SER 157           HA       SER 157   4.031  17.568 -37.464
 1292    HB2  SER 157           HB2      SER 157   3.760  14.828 -36.149
 1293    HB3  SER 157           HB3      SER 157   4.293  15.100 -37.816
 1294    HG   SER 157           HG       SER 157   5.564  15.934 -35.408
 1295    H    LEU 158           H        LEU 158   1.120  16.420 -35.820
 1296    HA   LEU 158           HA       LEU 158  -0.335  15.625 -38.219
 1297    HB2  LEU 158           HB2      LEU 158  -1.127  16.493 -35.441
 1298    HB3  LEU 158           HB3      LEU 158  -2.336  16.283 -36.699
 1299    HG   LEU 158           HG       LEU 158  -1.825  13.890 -36.822
 1300   HD11  LEU 158          HD11      LEU 158  -0.463  12.818 -35.026
 1301   HD12  LEU 158          HD12      LEU 158   0.533  13.814 -36.092
 1302   HD13  LEU 158          HD13      LEU 158   0.071  14.421 -34.481
 1303   HD21  LEU 158          HD21      LEU 158  -3.580  14.803 -35.313
 1304   HD22  LEU 158          HD22      LEU 158  -2.842  13.358 -34.617
 1305   HD23  LEU 158          HD23      LEU 158  -2.401  14.967 -33.996
 1306    H    GLN 159           H        GLN 159  -0.120  18.657 -36.235
 1307    HA   GLN 159           HA       GLN 159  -2.009  20.053 -37.908
 1308    HB2  GLN 159           HB2      GLN 159  -0.132  21.145 -35.763
 1309    HB3  GLN 159           HB3      GLN 159  -1.402  22.061 -36.568
 1310    HG2  GLN 159           HG2      GLN 159  -2.275  21.453 -34.579
 1311    HG3  GLN 159           HG3      GLN 159  -3.099  20.427 -35.766
 1312   HE21  GLN 159          HE22      GLN 159  -3.340  18.260 -34.991
 1313   HE22  GLN 159          HE21      GLN 159  -2.196  17.530 -33.881
 1314    H    GLU 160           H        GLU 160   1.496  19.693 -37.988
 1315    HA   GLU 160           HA       GLU 160   2.005  21.750 -39.909
 1316    HB2  GLU 160           HB2      GLU 160   3.648  20.654 -38.369
 1317    HB3  GLU 160           HB3      GLU 160   3.520  19.170 -39.316
 1318    HG2  GLU 160           HG2      GLU 160   4.445  20.315 -41.288
 1319    HG3  GLU 160           HG3      GLU 160   4.430  21.859 -40.428
 1320    H    ASN 161           H        ASN 161   0.433  18.617 -40.247
 1321    HA   ASN 161           HA       ASN 161   1.274  18.374 -43.066
 1322    HB2  ASN 161           HB2      ASN 161   1.638  16.516 -41.393
 1323    HB3  ASN 161           HB3      ASN 161  -0.120  16.324 -41.321
 1324   HD21  ASN 161          HD22      ASN 161  -0.713  14.540 -42.596
 1325   HD22  ASN 161          HD21      ASN 161   0.085  14.112 -44.094
 1326    H    THR 162           H        THR 162  -0.774  20.366 -42.263
 1327    HA   THR 162           HA       THR 162  -2.932  21.001 -42.570
 1328    HB   THR 162           HB       THR 162  -3.803  20.510 -44.947
 1329    HG1  THR 162           HG1      THR 162  -2.277  18.683 -45.244
 1330   HG21  THR 162          HG21      THR 162  -2.219  22.140 -45.900
 1331   HG22  THR 162          HG22      THR 162  -2.732  22.610 -44.277
 1332   HG23  THR 162          HG23      THR 162  -1.122  21.898 -44.518
 1333    HA   PRO 163           HA       PRO 163  -3.505  17.016 -40.098
 1334    HB2  PRO 163           HB2      PRO 163  -6.103  18.550 -40.358
 1335    HB3  PRO 163           HB3      PRO 163  -5.661  17.373 -39.061
 1336    HG2  PRO 163           HG2      PRO 163  -4.968  19.961 -38.715
 1337    HG3  PRO 163           HG3      PRO 163  -3.767  18.661 -38.402
 1338    HD2  PRO 163           HD2      PRO 163  -3.907  20.578 -40.671
 1339    HD3  PRO 163           HD3      PRO 163  -2.473  19.757 -40.001
 1340    H    LYS 164           H        LYS 164  -2.866  16.307 -42.486
 1341    HA   LYS 164           HA       LYS 164  -4.988  14.429 -43.384
 1342    HB2  LYS 164           HB2      LYS 164  -3.837  15.713 -45.146
 1343    HB3  LYS 164           HB3      LYS 164  -2.279  15.085 -44.603
 1344    HG2  LYS 164           HG2      LYS 164  -2.998  12.781 -45.153
 1345    HG3  LYS 164           HG3      LYS 164  -4.600  13.385 -45.624
 1346    HD2  LYS 164           HD2      LYS 164  -3.558  14.715 -47.450
 1347    HD3  LYS 164           HD3      LYS 164  -1.960  14.179 -46.927
 1348    HE2  LYS 164           HE2      LYS 164  -2.559  12.867 -48.833
 1349    HE3  LYS 164           HE3      LYS 164  -2.585  11.813 -47.414
 1350    HZ1  LYS 164           HZ1      LYS 164  -4.987  13.009 -48.690
 1351    HZ2  LYS 164           HZ2      LYS 164  -4.493  11.469 -48.879
 1352    HZ3  LYS 164           HZ3      LYS 164  -5.009  11.972 -47.418