*HEADER    RNA BINDING PROTEIN                     13-JUN-08   2K4K              
*TITLE     SOLUTION STRUCTURE OF GSP13 FROM BACILLUS SUBTILIS                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GENERAL STRESS PROTEIN 13;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: GSP13;                                                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BACILLUS SUBTILIS;                              
*SOURCE   3 ORGANISM_TAXID: 1423;                                                
*SOURCE   4 GENE: YUGI, BSU31390;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET-21A                                    
*KEYWDS    S1, CYTOPLASM, STRESS RESPONSE, RNA BINDING PROTEIN                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    W.YU, B.YU, J.HU, C.JIN, B.XIA                                        
*REVDAT   1   12-MAY-09 2K4K    0                                                


#
#   25 VAL  MGX          24 PHE  HA          5.50    (#      0:20  Unique         3.49, 5.55 A)
 &rst
  ixpk= 0, nxpk= 20, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,

      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:1        0 AMB  20-1:1      3.50    (#      1:20  Double Ambig)
 &rst
  ixpk= 1, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 337, 338,1060,1061,1060,1061,
 igr2= 335,1090,
 &end
#
#   24 PHE  HB-          24 PHE  HA          4.50    (#      2:20  Unique         2.69, 2.84 A)
 &rst
  ixpk= 2, nxpk= 20, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 337, 338,
 &end
#
#   34 LEU  MDY          24 PHE  HA          4.50    (#      3:20  Unique         2.34, 5.55 A)
 &rst
  ixpk= 3, nxpk= 20, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:4       73 SER  HA          4.50    (#      4:20  Single Ambig)
 &rst
  ixpk= 4, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1106,1054,1055, 938,
 &end
#
#    0 AMB  20-3:5       73 SER  HA          4.50    (#      5:20  Single Ambig)
 &rst
  ixpk= 5, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077, 940,
       941, 942, 944, 945, 946, 921, 922, 923, 925, 926,
       927,
 &end
#
#   73 SER  HB+          73 SER  HA          3.50    (#      6:20  Unique         2.27, 2.67 A)
 &rst
  ixpk= 6, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1092,1093,
 &end
#
#    0 AMB  20-3:7       75 SER  HA          4.50    (#      7:20  Single Ambig)
 &rst
  ixpk= 7, nxpk= 20, iat=  -1,1120, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 564, 565, 564, 565,
 &end
#
#   75 SER  HB+          75 SER  HA          4.50    (#      8:20  Unique         2.29, 2.66 A)
 &rst
  ixpk= 8, nxpk= 20, iat=  -1,1120, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1122,1123,
 &end
#
#    0 AMB  20-3:9       75 SER  HA          4.50    (#      9:20  Single Ambig)
 &rst
  ixpk= 9, nxpk= 20, iat=  -1,1120, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=1142,1143,1144,1155,1156,
 &end
#
#   75 SER  HB-          75 SER  HA          5.50    (#     10:20  Unique         2.29, 2.66 A)
 &rst
  ixpk= 10, nxpk= 20, iat=  -1,1120, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1122,1123,
 &end
#
#   76 ILE  HB           75 SER  HA          4.50    (#     11:20  Unique         4.63, 4.70 A)
 &rst
  ixpk= 11, nxpk= 20, iat=1133,1120, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:12      60 VAL  HA          3.50    (#     12:20  Single Ambig)
 &rst
  ixpk= 12, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 881,1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:13      60 VAL  HA          5.50    (#     13:20  Single Ambig)
 &rst
  ixpk= 13, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1103,1104, 897, 898,
 &end
#
#    0 AMB  20-3:14      60 VAL  HA          5.50    (#     14:20  Single Ambig)
 &rst
  ixpk= 14, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 897, 898,1176,1177,1178, 773, 774, 775, 777, 778,
       779,
 &end
#
#   79 THR  MG2          60 VAL  HA          3.50    (#     15:20  Unique         2.16, 3.96 A)
 &rst
  ixpk= 15, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1188,1189,1190,
 &end
#
#    0 AMB  20-3:16      60 VAL  HA          5.50    (#     16:20  Single Ambig)
 &rst
  ixpk= 16, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1192, 900, 901,
 &end
#
#   60 VAL  MGX          60 VAL  HA          4.50    (#     17:20  Unique         2.29, 3.50 A)
 &rst
  ixpk= 17, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#   60 VAL  MGY          60 VAL  HA          3.50    (#     18:20  Unique         2.29, 3.50 A)
 &rst
  ixpk= 18, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#   57 GLU  HB+          57 GLU  HA          3.50    (#     19:20  Unique         2.38, 2.76 A)
 &rst
  ixpk= 19, nxpk= 20, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 833, 834,
 &end
#
#   58 VAL  MGX          57 GLU  HA          5.50    (#     20:20  Unique         3.80, 5.41 A)
 &rst
  ixpk= 20, nxpk= 20, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   57 GLU  HG+          57 GLU  HA          4.50    (#     21:20  Unique         2.25, 2.85 A)
 &rst
  ixpk= 21, nxpk= 20, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 836, 837,
 &end
#
#    0 AMB  20-3:22      57 GLU  HA          4.50    (#     22:20  Single Ambig)
 &rst
  ixpk= 22, nxpk= 20, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 200, 201, 200, 201, 194, 195, 194, 195,
 &end
#
#   14 LYS  HG-          57 GLU  HA          5.50    (#     23:20  Unique         2.00, 3.09 A)
 &rst
  ixpk= 23, nxpk= 20, iat=  -1, 831, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 197, 198,
 &end
#
#   59 GLN  HG-          59 GLN  HA          4.50    (#     24:20  Unique         2.31, 3.38 A)
 &rst
  ixpk= 24, nxpk= 20, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 867, 868,
 &end
#
#   59 GLN  HB-          59 GLN  HA          3.50    (#     25:20  Unique         2.35, 2.58 A)
 &rst
  ixpk= 25, nxpk= 20, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 864, 865,
 &end
#
#   60 VAL  MGX          59 GLN  HA          4.50    (#     26:20  Unique         3.36, 4.82 A)
 &rst
  ixpk= 26, nxpk= 20, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#   59 GLN  HB+          59 GLN  HA          4.50    (#     27:20  Unique         2.35, 2.58 A)
 &rst
  ixpk= 27, nxpk= 20, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 864, 865,
 &end
#
#   59 GLN  HG+          59 GLN  HA          4.50    (#     28:20  Unique         2.31, 3.38 A)
 &rst
  ixpk= 28, nxpk= 20, iat=  -1, 862, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 867, 868,
 &end
#
#   27 LEU  HG           32 GLN  HA          4.50    (#     29:20  Unique         2.85, 3.56 A)
 &rst
  ixpk= 29, nxpk= 20, iat= 386, 456, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 ALA  MB           32 GLN  HA          4.50    (#     30:20  Unique         3.99, 4.63 A)
 &rst
  ixpk= 30, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 373, 374, 375,
 &end
#
#    0 AMB  20-3:31      14 LYS  HA          2.80    (#     31:20  Single Ambig)
 &rst
  ixpk= 31, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 194, 195, 194, 195,
 &end
#
#   58 VAL  MGX          14 LYS  HA          5.50    (#     32:20  Unique         2.54, 5.47 A)
 &rst
  ixpk= 32, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   57 GLU  HB+          14 LYS  HA          4.50    (#     33:20  Unique         3.78, 4.73 A)
 &rst
  ixpk= 33, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 833, 834,
 &end
#
#   14 LYS  HG+          14 LYS  HA          4.50    (#     34:20  Unique         2.27, 2.95 A)
 &rst
  ixpk= 34, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 197, 198,
 &end
#
#    0 AMB  20-3:35      32 GLN  HA          4.50    (#     35:20  Single Ambig)
 &rst
  ixpk= 35, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 461, 462, 461, 462,
 &end
#
#   32 GLN  HB-          32 GLN  HA          3.50    (#     36:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 36, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 458, 459,
 &end
#
#   32 GLN  HB+          32 GLN  HA          3.50    (#     37:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 37, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 458, 459,
 &end
#
#   61 LYS  HB-          61 LYS  HA          4.50    (#     38:20  Unique         2.32, 2.52 A)
 &rst
  ixpk= 38, nxpk= 20, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#   61 LYS  HG-          61 LYS  HA          4.50    (#     39:20  Unique         2.54, 3.57 A)
 &rst
  ixpk= 39, nxpk= 20, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 900, 901,
 &end
#
#   61 LYS  HB+          61 LYS  HA          4.50    (#     40:20  Unique         2.32, 2.52 A)
 &rst
  ixpk= 40, nxpk= 20, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#    0 AMB  20-3:41      61 LYS  HA          4.50    (#     41:20  Single Ambig)
 &rst
  ixpk= 41, nxpk= 20, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   15 VAL  MGY          14 LYS  HA          4.50    (#     42:20  Unique         3.62, 5.59 A)
 &rst
  ixpk= 42, nxpk= 20, iat=  -1, 192, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   61 LYS  HG+          61 LYS  HA          4.50    (#     43:20  Unique         2.54, 3.57 A)
 &rst
  ixpk= 43, nxpk= 20, iat=  -1, 895, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 900, 901,
 &end
#
#   34 LEU  HB+          34 LEU  HA          4.50    (#     44:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 44, nxpk= 20, iat=  -1, 480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 482, 483,
 &end
#
#   34 LEU  HB-          34 LEU  HA          4.50    (#     45:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 45, nxpk= 20, iat=  -1, 480, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 482, 483,
 &end
#
#   34 LEU  HG           34 LEU  HA          4.50    (#     46:20  Unique         3.26, 3.35 A)
 &rst
  ixpk= 46, nxpk= 20, iat= 485, 480, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 LEU  MDY          34 LEU  HA          4.50    (#     47:20  Unique         2.10, 3.94 A)
 &rst
  ixpk= 47, nxpk= 20, iat=  -1, 480, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   62 VAL  HA           74 LEU  HA          4.50    (#     48:20  Unique         2.24, 2.58 A)
 &rst
  ixpk= 48, nxpk= 20, iat= 917,1101, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HB-          74 LEU  HA          4.50    (#     49:20  Unique         2.29, 2.67 A)
 &rst
  ixpk= 49, nxpk= 20, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1103,1104,
 &end
#
#    0 AMB  20-3:50      74 LEU  HA          3.50    (#     50:20  Single Ambig)
 &rst
  ixpk= 50, nxpk= 20, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 940, 941, 942, 944, 945, 946,1108,1109,1110,1112,
      1113,1114,
 &end
#
#    0 AMB  20-3:51      74 LEU  HA          4.50    (#     51:20  Single Ambig)
 &rst
  ixpk= 51, nxpk= 20, iat=  -1,1101, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1106, 938,
 &end
#
#    0 AMB  20-3:52      23 ALA  HA          3.50    (#     52:20  Single Ambig)
 &rst
  ixpk= 52, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 258, 259, 260, 262, 263, 264, 712, 713, 714,
 &end
#
#   23 ALA  MB           23 ALA  HA          2.80    (#     53:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 53, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 327, 328, 329,
 &end
#
#    0 AMB  20-3:54      23 ALA  HA          4.50    (#     54:20  Single Ambig)
 &rst
  ixpk= 54, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 7.47, r4= 7.97,
 igr1= 503, 504, 505, 507, 508, 509, 705, 706, 707, 800,
       801, 802, 804, 805, 806, 800, 801, 802, 804, 805,
       806,
 &end
#
#   12 THR  HB           12 THR  HA          4.50    (#     62:20  Unique         2.97, 3.01 A)
 &rst
  ixpk= 62, nxpk= 20, iat= 173, 171, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:64      12 THR  HA          4.50    (#     64:20  Single Ambig)
 &rst
  ixpk= 64, nxpk= 20, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 883, 884, 885, 887, 888, 889, 138, 139, 140, 142,
       143, 144,
 &end
#
#   10 VAL  HB           10 VAL  HA          3.50    (#     66:20  Unique         2.36, 2.93 A)
 &rst
  ixpk= 66, nxpk= 20, iat= 136, 134, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 LYS  HG+          10 VAL  HA          5.50    (#     67:20  Unique         2.00, 4.68 A)
 &rst
  ixpk= 67, nxpk= 20, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 900, 901,
 &end
#
#    0 AMB  20-3:68      10 VAL  HA          2.80    (#     68:20  Single Ambig)
 &rst
  ixpk= 68, nxpk= 20, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#  105 PRO  HD+         104 THR  HA          4.50    (#     74:20  Unique         2.07, 2.43 A)
 &rst
  ixpk= 74, nxpk= 20, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1580,1581,
 &end
#
#    0 AMB  20-3:75     104 THR  HA          4.50    (#     75:20  Single Ambig)
 &rst
  ixpk= 75, nxpk= 20, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1571,1572,1573,1575,
 &end
#
#  104 THR  HB          104 THR  HA          4.50    (#     76:20  Unique         2.32, 2.56 A)
 &rst
  ixpk= 76, nxpk= 20, iat=1569,1567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  105 PRO  HD-         104 THR  HA          4.50    (#     77:20  Unique         2.07, 2.43 A)
 &rst
  ixpk= 77, nxpk= 20, iat=  -1,1567, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1580,1581,
 &end
#
#   74 LEU  HB+          35 VAL  HA          4.50    (#     78:20  Unique         2.74, 4.22 A)
 &rst
  ixpk= 78, nxpk= 20, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1103,1104,
 &end
#
#   35 VAL  MGX          35 VAL  HA          3.50    (#     79:20  Unique         2.38, 3.36 A)
 &rst
  ixpk= 79, nxpk= 20, iat=  -1, 499, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 503, 504, 505, 507, 508, 509,
 &end
#
#   35 VAL  HB           36 HIS  HA          7.00    (#     80:20  Unique         4.96, 5.29 A)
 &rst
  ixpk= 80, nxpk= 20, iat= 501, 515, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-3:81       0 AMB  20-1:81     3.50    (#     81:20  Double Ambig)
 &rst
  ixpk= 81, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1103,1104, 485,
 igr2= 499, 515,
 &end
#
#    0 AMB  20-3:82      36 HIS  HA          4.50    (#     82:20  Single Ambig)
 &rst
  ixpk= 82, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 581, 582, 583, 585, 586, 587,1142,1143,1144,
 &end
#
#   22 GLY  HA-          36 HIS  HA          4.50    (#     83:20  Unique         2.63, 3.43 A)
 &rst
  ixpk= 83, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 318, 319,
 &end
#
#   36 HIS  HB+          36 HIS  HA          3.50    (#     84:20  Unique         2.52, 2.81 A)
 &rst
  ixpk= 84, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 517, 518,
 &end
#
#   36 HIS  HB-          36 HIS  HA          3.50    (#     85:20  Unique         2.52, 2.81 A)
 &rst
  ixpk= 85, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 517, 518,
 &end
#
#   34 LEU  MDY          36 HIS  HA          4.50    (#     86:20  Unique         3.15, 5.07 A)
 &rst
  ixpk= 86, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#    9 SER  HB-           9 SER  HA          3.50    (#     89:20  Unique         2.24, 2.65 A)
 &rst
  ixpk= 89, nxpk= 20, iat=  -1, 123, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 125, 126,
 &end
#
#    0 AMB  20-3:90       9 SER  HA          4.50    (#     90:20  Single Ambig)
 &rst
  ixpk= 90, nxpk= 20, iat=  -1, 123, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    9 SER  HB+           9 SER  HA          4.50    (#     91:20  Unique         2.24, 2.65 A)
 &rst
  ixpk= 91, nxpk= 20, iat=  -1, 123, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 125, 126,
 &end
#
#   67 GLU  HG+          67 GLU  HA          3.50    (#     92:20  Unique         2.28, 3.00 A)
 &rst
  ixpk= 92, nxpk= 20, iat=  -1, 990, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 995, 996,
 &end
#
#   67 GLU  HB+          67 GLU  HA          2.80    (#     93:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 93, nxpk= 20, iat=  -1, 990, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 992, 993,
 &end
#
#   41 THR  HB           41 THR  HA          3.50    (#     94:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 94, nxpk= 20, iat= 595, 593, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 ARG  HB-          41 THR  HA          4.50    (#     95:20  Unique         2.17, 2.73 A)
 &rst
  ixpk= 95, nxpk= 20, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1152,1153,
 &end
#
#    0 AMB  20-3:96      41 THR  HA          4.50    (#     96:20  Single Ambig)
 &rst
  ixpk= 96, nxpk= 20, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 581, 582, 583, 585, 586, 587, 771,
 &end
#
#    0 AMB  20-3:97      41 THR  HA          4.50    (#     97:20  Single Ambig)
 &rst
  ixpk= 97, nxpk= 20, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 597, 598, 599, 601,
 &end
#
#   77 ARG  HA           41 THR  HA          5.50    (#     98:20  Unique         3.24, 3.62 A)
 &rst
  ixpk= 98, nxpk= 20, iat=1150, 593, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 ARG  HB+          41 THR  HA          5.50    (#     99:20  Unique         2.17, 2.73 A)
 &rst
  ixpk= 99, nxpk= 20, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1152,1153,
 &end
#
#   68 GLU  HG-          68 GLU  HA          4.50    (#    100:20  Unique         2.15, 2.98 A)
 &rst
  ixpk= 100, nxpk= 20, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1010,1011,
 &end
#
#    0 AMB  20-3:101     68 GLU  HA          2.80    (#    101:20  Single Ambig)
 &rst
  ixpk= 101, nxpk= 20, iat=  -1,1005, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1007,1008,1007,1008,
 &end
#
#   67 GLU  HG+          67 GLU  HA          3.50    (#    102:20  Unique         2.28, 3.00 A)
 &rst
  ixpk= 102, nxpk= 20, iat=  -1, 990, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 995, 996,
 &end
#
#    0 AMB  20-3:103     67 GLU  HA          4.50    (#    103:20  Single Ambig)
 &rst
  ixpk= 103, nxpk= 20, iat=  -1, 990, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#    0 AMB  20-3:104     77 ARG  HA          5.50    (#    104:20  Single Ambig)
 &rst
  ixpk= 104, nxpk= 20, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1203,1204,1203,1204,
 &end
#
#   41 THR  HA           77 ARG  HA          5.50    (#    105:20  Unique         3.24, 3.62 A)
 &rst
  ixpk= 105, nxpk= 20, iat= 593,1150, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 ARG  HB+          77 ARG  HA          4.50    (#    107:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 107, nxpk= 20, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1152,1153,
 &end
#
#   77 ARG  HB-          77 ARG  HA          3.50    (#    108:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 108, nxpk= 20, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1152,1153,
 &end
#
#    0 AMB  20-3:111    118 TRP  HA          3.50    (#    111:20  Single Ambig)
 &rst
  ixpk= 111, nxpk= 20, iat=  -1,1791, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1793,1794,1793,1794,
 &end
#
#  108 PHE  HB-         108 PHE  HA          4.50    (#    117:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 117, nxpk= 20, iat=  -1,1619, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1621,1622,
 &end
#
#  108 PHE  HB+         108 PHE  HA          4.50    (#    118:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 118, nxpk= 20, iat=  -1,1619, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1621,1622,
 &end
#
#   44 PHE  HB+          44 PHE  HA          3.50    (#    119:20  Unique         2.38, 2.69 A)
 &rst
  ixpk= 119, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 633, 634,
 &end
#
#    0 AMB  20-3:120     44 PHE  HA          5.50    (#    120:20  Single Ambig)
 &rst
  ixpk= 120, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 653, 675, 676, 675, 676,
 &end
#
#    0 AMB  20-3:121     44 PHE  HA          7.00    (#    121:20  Single Ambig)
 &rst
  ixpk= 121, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3=10.27, r4=10.77,
 igr1= 597, 598, 599, 601, 655, 656, 657, 659, 660, 661,
      
 &end
#
#    0 AMB  20-3:122      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= 3.96, r4= 4.46,
 igr1= 609, 610, 633, 634,
 igr2= 607, 631,
 &end
#
#    0 AMB  20-3:126    117 GLU  HA          3.50    (#    126:20  Single Ambig)
 &rst
  ixpk= 126, nxpk= 20, iat=  -1,1776, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1778,1779,1778,1779,
 &end
#
#    0 AMB  20-3:129    120 GLU  HA          4.50    (#    129:20  Single Ambig)
 &rst
  ixpk= 129, nxpk= 20, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1839,1840,1839,1840,
 &end
#
#  120 GLU  HB-         120 GLU  HA          2.80    (#    130:20  Unique         2.26, 2.68 A)
 &rst
  ixpk= 130, nxpk= 20, iat=  -1,1834, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1836,1837,
 &end
#
#    0 AMB  20-3:131     46 LYS  HA          4.50    (#    131:20  Single Ambig)
 &rst
  ixpk= 131, nxpk= 20, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 672, 673, 672, 673,
 &end
#
#    0 AMB  20-3:133     50 GLU  HA          7.00    (#    133:20  Single Ambig)
 &rst
  ixpk= 133, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 722, 723, 691, 692,
 &end
#
#   50 GLU  HG+          50 GLU  HA          4.50    (#    134:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 134, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 739, 740,
 &end
#
#   50 GLU  HG-          50 GLU  HA          3.50    (#    135:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 135, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 739, 740,
 &end
#
#   50 GLU  HB+          50 GLU  HA          3.50    (#    136:20  Unique         2.35, 2.68 A)
 &rst
  ixpk= 136, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#   50 GLU  HB-          50 GLU  HA          3.50    (#    137:20  Unique         2.35, 2.68 A)
 &rst
  ixpk= 137, nxpk= 20, iat=  -1, 734, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 736, 737,
 &end
#
#    4 LYS  HB+           4 LYS  HA          4.50    (#    138:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 138, nxpk= 20, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
#   51 HIS  HB-          51 HIS  HA          3.50    (#    139:20  Unique         2.51, 2.81 A)
 &rst
  ixpk= 139, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 751, 752,
 &end
#
#   51 HIS  HB+          51 HIS  HA          4.50    (#    140:20  Unique         2.51, 2.81 A)
 &rst
  ixpk= 140, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 751, 752,
 &end
#
#    0 AMB  20-3:141     51 HIS  HA          7.00    (#    141:20  Single Ambig)
 &rst
  ixpk= 141, nxpk= 20, iat=  -1, 749, r1= 1.30, r2= 1.80, r3= 9.68, r4=10.18,
 igr1= 771, 581, 582, 583, 585, 586, 587,
 &end
#
#    5 PHE  HB-           5 PHE  HA          4.50    (#    142:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 142, nxpk= 20, iat=  -1,  65, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  67,  68,
 &end
#
#    5 PHE  HB+           5 PHE  HA          3.50    (#    143:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 143, nxpk= 20, iat=  -1,  65, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  67,  68,
 &end
#
#    0 AMB  20-3:144     46 LYS  HA          2.80    (#    144:20  Single Ambig)
 &rst
  ixpk= 144, nxpk= 20, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 669, 670, 669, 670,
 &end
#
#    0 AMB  20-3:145     46 LYS  HA          5.50    (#    145:20  Single Ambig)
 &rst
  ixpk= 145, nxpk= 20, iat=  -1, 667, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 655, 656, 657, 659, 660, 661, 597, 598, 599,
 &end
#
#    0 AMB  20-3:146      4 LYS  HA          5.50    (#    146:20  Single Ambig)
 &rst
  ixpk= 146, nxpk= 20, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  51,  52,  51,  52,
 &end
#
#    4 LYS  HB-           4 LYS  HA          4.50    (#    147:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 147, nxpk= 20, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
#    4 LYS  HG+           4 LYS  HA          4.50    (#    148:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 148, nxpk= 20, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  48,  49,
 &end
#
#    4 LYS  HG-           4 LYS  HA          4.50    (#    149:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 149, nxpk= 20, iat=  -1,  43, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  48,  49,
 &end
#
#   54 VAL  HA           53 SER  HA          5.50    (#    150:20  Unique         4.33, 4.36 A)
 &rst
  ixpk= 150, nxpk= 20, iat= 796, 785, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   18 LEU  MDY          53 SER  HA          4.50    (#    151:20  Unique         2.12, 4.57 A)
 &rst
  ixpk= 151, nxpk= 20, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 258, 259, 260, 262, 263, 264,
 &end
#
#   53 SER  HB+          53 SER  HA          3.50    (#    152:20  Unique         2.29, 2.78 A)
 &rst
  ixpk= 152, nxpk= 20, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   53 SER  HB-          53 SER  HA          4.50    (#    153:20  Unique         2.29, 2.78 A)
 &rst
  ixpk= 153, nxpk= 20, iat=  -1, 785, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#  121 MET  HB-         121 MET  HA          4.50    (#    154:20  Unique         2.35, 2.65 A)
 &rst
  ixpk= 154, nxpk= 20, iat=  -1,1849, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1851,1852,
 &end
#
#    0 AMB  20-3:157    124 ARG  HA          4.50    (#    157:20  Single Ambig)
 &rst
  ixpk= 157, nxpk= 20, iat=  -1,1891, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1899,1900,1899,1900,
 &end
#
#    0 AMB  20-3:160     84 GLU  HA          4.50    (#    160:20  Single Ambig)
 &rst
  ixpk= 160, nxpk= 20, iat=  -1,1249, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1254,1255,1254,1255,
 &end
#
#    0 AMB  20-3:161     84 GLU  HA          2.80    (#    161:20  Single Ambig)
 &rst
  ixpk= 161, nxpk= 20, iat=  -1,1249, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1251,1252,1251,1252,
 &end
#
#    0 AMB  20-3:162     87 GLU  HA          4.50    (#    162:20  Single Ambig)
 &rst
  ixpk= 162, nxpk= 20, iat=  -1,1308, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1313,1314,1313,1314,
 &end
#
#   87 GLU  HB-          87 GLU  HA          2.80    (#    163:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 163, nxpk= 20, iat=  -1,1308, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1310,1311,
 &end
#
#    0 AMB  20-3:165     85 LYS  HA          4.50    (#    165:20  Single Ambig)
 &rst
  ixpk= 165, nxpk= 20, iat=  -1,1264, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1272,1273,1272,1273,
 &end
#
#    0 AMB  20-3:167      0 AMB  20-1:167    5.50    (#    167:20  Double Ambig)
 &rst
  ixpk= 167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1=1297,1298,1297,1298,1998,1999,1998,1999,
 igr2=1286,1987,
 &end
#
#    0 AMB  20-3:171    106 GLN  HA          5.50    (#    171:20  Single Ambig)
 &rst
  ixpk= 171, nxpk= 20, iat=  -1,1595, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1600,1601,1600,1601,
 &end
#
#    0 AMB  20-3:172    115 LEU  HA          4.50    (#    172:20  Single Ambig)
 &rst
  ixpk= 172, nxpk= 20, iat=  -1,1742, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1749,1750,1751,1753,1754,1755,1749,1750,1751,1753,
      1754,1755,
 &end
#
#    0 AMB  20-3:173     30 GLU  HA          3.50    (#    173:20  Single Ambig)
 &rst
  ixpk= 173, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 432, 433, 432, 433,
 &end
#
#   30 GLU  HB-          30 GLU  HA          3.50    (#    174:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 174, nxpk= 20, iat=  -1, 427, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 429, 430,
 &end
#
#   27 LEU  MDX          27 LEU  HA          4.50    (#    175:20  Unique         1.99, 3.90 A)
 &rst
  ixpk= 175, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   13 GLY  HA-          27 LEU  HA          4.50    (#    176:20  Unique         2.03, 3.21 A)
 &rst
  ixpk= 176, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 185, 186,
 &end
#
#   27 LEU  HG           27 LEU  HA          4.50    (#    177:20  Unique         2.54, 3.08 A)
 &rst
  ixpk= 177, nxpk= 20, iat= 386, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HB+          27 LEU  HA          3.50    (#    178:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 178, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 383, 384,
 &end
#
#   27 LEU  MDY          27 LEU  HA          3.50    (#    179:20  Unique         1.99, 3.90 A)
 &rst
  ixpk= 179, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   56 ASP  HB+          56 ASP  HA          4.50    (#    180:20  Unique         2.60, 2.84 A)
 &rst
  ixpk= 180, nxpk= 20, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 821, 822,
 &end
#
#   56 ASP  HB-          56 ASP  HA          3.50    (#    181:20  Unique         2.60, 2.84 A)
 &rst
  ixpk= 181, nxpk= 20, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 821, 822,
 &end
#
#   14 LYS  HG+          56 ASP  HA          5.50    (#    182:20  Unique         4.53, 5.90 A)
 &rst
  ixpk= 182, nxpk= 20, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 197, 198,
 &end
#
#   15 VAL  MGY          56 ASP  HA          4.50    (#    183:20  Unique         4.75, 6.98 A)
 &rst
  ixpk= 183, nxpk= 20, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:186      0 AMB  20-1:186    2.80    (#    186:20  Double Ambig)
 &rst
  ixpk= 186, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  87,  88,  87,  88,1022,1023,
 igr2=  85,1020,
 &end
#
#    0 AMB  20-3:187     69 LYS  HA          4.50    (#    187:20  Single Ambig)
 &rst
  ixpk= 187, nxpk= 20, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1028,1029,1028,1029,
 &end
#
#   69 LYS  HB-          69 LYS  HA          2.80    (#    188:20  Unique         2.48, 2.81 A)
 &rst
  ixpk= 188, nxpk= 20, iat=  -1,1020, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1022,1023,
 &end
#
#   57 GLU  HB+          56 ASP  HA          4.50    (#    190:20  Unique         4.25, 4.62 A)
 &rst
  ixpk= 190, nxpk= 20, iat=  -1, 819, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 833, 834,
 &end
#
#   71 LYS  HB+          71 LYS  HA          3.50    (#    193:20  Unique         2.41, 2.78 A)
 &rst
  ixpk= 193, nxpk= 20, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1051,1052,
 &end
#
#   71 LYS  HG+          71 LYS  HA          4.50    (#    194:20  Unique         2.18, 2.87 A)
 &rst
  ixpk= 194, nxpk= 20, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#    0 AMB  20-3:195     71 LYS  HA          3.50    (#    195:20  Single Ambig)
 &rst
  ixpk= 195, nxpk= 20, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1057,1058,1057,1058,1051,1052,
 &end
#
#   71 LYS  HG-          71 LYS  HA          4.50    (#    196:20  Unique         2.18, 2.87 A)
 &rst
  ixpk= 196, nxpk= 20, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#   37 ILE  QD1          21 TYR  HA          4.50    (#    197:20  Unique         2.71, 4.47 A)
 &rst
  ixpk= 197, nxpk= 20, iat=  -1, 297, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 543, 544, 545,
 &end
#
#   21 TYR  HB+          21 TYR  HA          3.50    (#    199:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 199, nxpk= 20, iat=  -1, 297, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 299, 300,
 &end
#
#   21 TYR  HB-          21 TYR  HA          2.80    (#    200:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 200, nxpk= 20, iat=  -1, 297, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 299, 300,
 &end
#
#   37 ILE  QG2          21 TYR  HA          3.50    (#    201:20  Unique         2.33, 3.75 A)
 &rst
  ixpk= 201, nxpk= 20, iat=  -1, 297, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 536, 537, 538,
 &end
#
#   48 ILE  QG2          20 ALA  HA          4.50    (#    202:20  Unique         2.08, 3.80 A)
 &rst
  ixpk= 202, nxpk= 20, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  20-3:203    113 ASP  HA          2.80    (#    203:20  Single Ambig)
 &rst
  ixpk= 203, nxpk= 20, iat=  -1,1708, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1710,1711,1710,1711,
 &end
#
#    0 AMB  20-3:209     80 GLN  HA          2.80    (#    209:20  Single Ambig)
 &rst
  ixpk= 209, nxpk= 20, iat=  -1,1198, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1200,1201,1200,1201,
 &end
#
#    0 AMB  20-3:211     39 GLU  HA          4.50    (#    211:20  Single Ambig)
 &rst
  ixpk= 211, nxpk= 20, iat=  -1, 562, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1155,1156,1152,1153,
 &end
#
#   20 ALA  MB           20 ALA  HA          2.80    (#    212:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 212, nxpk= 20, iat=  -1, 287, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 289, 290, 291,
 &end
#
#    0 AMB  20-3:213    126 ASP  HA          3.50    (#    213:20  Single Ambig)
 &rst
  ixpk= 213, nxpk= 20, iat=  -1,1937, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1939,1940,1939,1940,
 &end
#
#    0 AMB  20-3:216     89 LYS  HA          4.50    (#    216:20  Single Ambig)
 &rst
  ixpk= 216, nxpk= 20, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1336,1337,1336,1337,
 &end
#
#    0 AMB  20-3:217     89 LYS  HA          5.50    (#    217:20  Single Ambig)
 &rst
  ixpk= 217, nxpk= 20, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1339,1340,1339,1340,
 &end
#
#    0 AMB  20-3:218      0 AMB  20-1:218    3.50    (#    218:20  Double Ambig)
 &rst
  ixpk= 218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1355,1356,1415,1416,
 igr2=1334,1394,
 &end
#
#   90 PRO  HD-          89 LYS  HA          4.50    (#    219:20  Unique         2.07, 2.47 A)
 &rst
  ixpk= 219, nxpk= 20, iat=  -1,1334, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1355,1356,
 &end
#
#    0 AMB  20-3:220      0 AMB  20-1:220    4.50    (#    220:20  Double Ambig)
 &rst
  ixpk= 220, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1402,1403,1402,1403,1342,1343,1342,1343,
 igr2=1394,1334,
 &end
#
#    0 AMB  20-3:221      0 AMB  20-1:221    4.50    (#    221:20  Double Ambig)
 &rst
  ixpk= 221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1399,1400,1399,1400,1339,1340,1339,1340,
 igr2=1394,1334,
 &end
#
#    0 AMB  20-3:222      0 AMB  20-1:222    3.50    (#    222:20  Double Ambig)
 &rst
  ixpk= 222, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1355,1356,1415,1416,
 igr2=1334,1394,
 &end
#
#    0 AMB  20-3:223      0 AMB  20-1:223    3.50    (#    223:20  Double Ambig)
 &rst
  ixpk= 223, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1355,1356,1415,1416,
 igr2=1334,1394,
 &end
#
#    0 AMB  20-3:225      0 AMB  20-1:225    3.50    (#    225:20  Double Ambig)
 &rst
  ixpk= 225, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1402,1403,1402,1403,1342,1343,1342,1343,
 igr2=1394,1334,
 &end
#
#   28 ASP  HB+          28 ASP  HA          2.80    (#    226:20  Unique         2.56, 2.81 A)
 &rst
  ixpk= 226, nxpk= 20, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 402, 403,
 &end
#
#   78 ALA  MB           78 ALA  HA          2.80    (#    227:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 227, nxpk= 20, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1176,1177,1178,
 &end
#
#   77 ARG  HG+          78 ALA  HA          5.50    (#    228:20  Unique         3.18, 4.00 A)
 &rst
  ixpk= 228, nxpk= 20, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1155,1156,
 &end
#
#   19 GLN  HG-          19 GLN  HA          4.50    (#    230:20  Unique         2.11, 3.03 A)
 &rst
  ixpk= 230, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 275, 276,
 &end
#
#   19 GLN  HG+          19 GLN  HA          4.50    (#    231:20  Unique         2.11, 3.03 A)
 &rst
  ixpk= 231, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 275, 276,
 &end
#
#   19 GLN  HB+          19 GLN  HA          3.50    (#    232:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 232, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 272, 273,
 &end
#
#   19 GLN  HB-          19 GLN  HA          4.50    (#    233:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 233, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 272, 273,
 &end
#
#    7 VAL  HB           64 ALA  HA          5.50    (#    234:20  Unique         2.64, 4.09 A)
 &rst
  ixpk= 234, nxpk= 20, iat= 102, 952, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   64 ALA  MB           64 ALA  HA          2.80    (#    235:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 235, nxpk= 20, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 954, 955, 956,
 &end
#
#    7 VAL  MGX          64 ALA  HA          3.50    (#    236:20  Unique         2.04, 4.24 A)
 &rst
  ixpk= 236, nxpk= 20, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:237     64 ALA  HA          4.50    (#    237:20  Single Ambig)
 &rst
  ixpk= 237, nxpk= 20, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 104, 105, 106, 108, 109, 110, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  20-3:238     64 ALA  HA          5.50    (#    238:20  Single Ambig)
 &rst
  ixpk= 238, nxpk= 20, iat=  -1, 952, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927, 940, 941, 942, 944,
       945, 946,
 &end
#
#  102 ALA  MB          102 ALA  HA          4.50    (#    239:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 239, nxpk= 20, iat=  -1,1546, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1548,1549,1550,
 &end
#
#   96 ALA  MB           96 ALA  HA          2.80    (#    243:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 243, nxpk= 20, iat=  -1,1462, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1464,1465,1466,
 &end
#
#    4 LYS  HG+           3 ALA  HA          4.50    (#    244:20  Unique         3.44, 5.10 A)
 &rst
  ixpk= 244, nxpk= 20, iat=  -1,  33, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  48,  49,
 &end
#
#    2 ALA  MB            2 ALA  HA          4.50    (#    245:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 245, nxpk= 20, iat=  -1,  23, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=  25,  26,  27,
 &end
#
#  104 THR  HB          105 PRO  HD+         4.50    (#    246:20  Unique         2.01, 4.14 A)
 &rst
  ixpk= 246, nxpk= 20, iat=1569,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1580,1581,
 &end
#
#    0 AMB  20-3:247      0 AMB  20-1:247    2.80    (#    247:20  Double Ambig)
 &rst
  ixpk= 247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1334,1567,1394,
 igr2=1355,1356,1580,1581,1415,1416,
 &end
#
#    0 AMB  20-3:248      0 AMB  20-1:248    5.50    (#    248:20  Double Ambig)
 &rst
  ixpk= 248, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1556,1589,1364,1424,
 igr2=1580,1581,1355,1356,1415,1416,
 &end
#
#    0 AMB  20-3:255      0 AMB  20-1:255    2.80    (#    255:20  Double Ambig)
 &rst
  ixpk= 255, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1334,1567,1394,
 igr2=1355,1356,1580,1581,1415,1416,
 &end
#
#    0 AMB  20-3:256      0 AMB  20-1:256    4.50    (#    256:20  Double Ambig)
 &rst
  ixpk= 256, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1589,1364,1424,
 igr2=1580,1581,1355,1356,1415,1416,
 &end
#
#    0 AMB  20-3:259     90 PRO  HD-         4.50    (#    259:20  Single Ambig)
 &rst
  ixpk= 259, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1336,1337,1336,1337,
 igr2=1355,1356,
 &end
#
#   82 ALA  MB           82 ALA  HA          3.50    (#    264:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 264, nxpk= 20, iat=  -1,1225, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1227,1228,1229,
 &end
#
#   36 HIS  HA           22 GLY  HA+         4.50    (#    277:20  Unique         2.63, 3.43 A)
 &rst
  ixpk= 277, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   48 ILE  QG2          22 GLY  HA+         4.50    (#    278:20  Unique         3.42, 6.92 A)
 &rst
  ixpk= 278, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 705, 706, 707,
 igr2= 318, 319,
 &end
#
#   34 LEU  MDY          22 GLY  HA+         4.50    (#    279:20  Unique         2.08, 5.49 A)
 &rst
  ixpk= 279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 318, 319,
 &end
#
#   48 ILE  QD1          22 GLY  HA+         4.50    (#    281:20  Unique         2.22, 4.20 A)
 &rst
  ixpk= 281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 712, 713, 714,
 igr2= 318, 319,
 &end
#
#   36 HIS  HA           22 GLY  HA-         4.50    (#    282:20  Unique         2.63, 3.43 A)
 &rst
  ixpk= 282, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   37 ILE  HB           22 GLY  HA-         4.50    (#    284:20  Unique         2.89, 3.96 A)
 &rst
  ixpk= 284, nxpk= 20, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   48 ILE  QD1          22 GLY  HA-         4.50    (#    285:20  Unique         2.22, 4.20 A)
 &rst
  ixpk= 285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 712, 713, 714,
 igr2= 318, 319,
 &end
#
#   34 LEU  MDY          22 GLY  HA-         4.50    (#    286:20  Unique         2.08, 5.49 A)
 &rst
  ixpk= 286, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 318, 319,
 &end
#
#   54 VAL  MGY          17 GLY  HA+         3.50    (#    287:20  Unique         1.99, 4.21 A)
 &rst
  ixpk= 287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 800, 801, 802, 804, 805, 806,
 igr2= 244, 245,
 &end
#
#    0 AMB  20-3:290     17 GLY  HA-         3.50    (#    290:20  Single Ambig)
 &rst
  ixpk= 290, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806,
 igr2= 244, 245,
 &end
#
#    0 AMB  20-3:293      0 AMB  20-1:293    4.50    (#    293:20  Double Ambig)
 &rst
  ixpk= 293, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806, 104, 105, 106, 108, 109, 110,
 igr2= 812, 813, 812, 813, 116, 117,
 &end
#
#    0 AMB  20-3:295      0 AMB  20-1:295    4.50    (#    295:20  Double Ambig)
 &rst
  ixpk= 295, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 906, 907, 906, 907,
 igr2= 116, 117, 116, 117,
 &end
#
#    0 AMB  20-3:296      8 GLY  HA-         4.50    (#    296:20  Single Ambig)
 &rst
  ixpk= 296, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 104, 105, 106, 108, 109, 110, 921, 922, 923, 925,
       926, 927,
 igr2= 116, 117,
 &end
#
#    0 AMB  20-3:297      8 GLY  HA-         4.50    (#    297:20  Single Ambig)
 &rst
  ixpk= 297, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 906, 907, 906, 907,
 igr2= 116, 117,
 &end
#
#    0 AMB  20-3:299     55 GLY  HA-         7.00    (#    299:20  Single Ambig)
 &rst
  ixpk= 299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.11, r4=11.61,
 igr1= 194, 195, 194, 195, 200, 201, 200, 201,
 igr2= 812, 813,
 &end
#
#    0 AMB  20-3:301     55 GLY  HA-         5.50    (#    301:20  Single Ambig)
 &rst
  ixpk= 301, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806,
 igr2= 812, 813,
 &end
#
#    0 AMB  20-3:303     55 GLY  HA-         5.50    (#    303:20  Single Ambig)
 &rst
  ixpk= 303, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.73, r4= 9.23,
 igr1= 194, 195, 194, 195, 200, 201, 200, 201,
 igr2= 812, 813,
 &end
#
#    0 AMB  20-3:304     33 GLY  HA-         4.50    (#    304:20  Single Ambig)
 &rst
  ixpk= 304, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1106, 357,1054,1055,
 igr2= 473, 474,
 &end
#
#   72 ILE  HB           33 GLY  HA-         4.50    (#    305:20  Unique         2.04, 2.92 A)
 &rst
  ixpk= 305, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 473, 474,
 &end
#
#   74 LEU  MDY          33 GLY  HA-         2.80    (#    306:20  Unique         2.06, 4.68 A)
 &rst
  ixpk= 306, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1108,1109,1110,1112,1113,1114,
 igr2= 473, 474,
 &end
#
#    0 AMB  20-3:307     33 GLY  HA-         5.50    (#    307:20  Single Ambig)
 &rst
  ixpk= 307, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1106,1054,1055,
 igr2= 473, 474,
 &end
#
#    0 AMB  20-3:308      0 AMB  20-1:308    3.50    (#    308:20  Double Ambig)
 &rst
  ixpk= 308, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077, 883,
       884, 885, 887, 888, 889,
 igr2= 473, 474, 185, 186,
 &end
#
#    0 AMB  20-3:310      0 AMB  20-1:310    5.50    (#    310:20  Double Ambig)
 &rst
  ixpk= 310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 607, 631,
 igr2= 624, 625, 624, 625, 624, 625,
 &end
#
#    0 AMB  20-3:311      0 AMB  20-1:311    5.50    (#    311:20  Double Ambig)
 &rst
  ixpk= 311, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 609, 610, 609, 610, 633, 634,
 igr2= 624, 625, 624, 625, 624, 625,
 &end
#
#   27 LEU  MDY          13 GLY  HA-         4.50    (#    313:20  Unique         2.11, 5.56 A)
 &rst
  ixpk= 313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 185, 186,
 &end
#
#   25 VAL  MGY          13 GLY  HA-         3.50    (#    314:20  Unique         2.03, 5.28 A)
 &rst
  ixpk= 314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 185, 186,
 &end
#
#   27 LEU  HA           13 GLY  HA-         4.50    (#    315:20  Unique         2.03, 3.21 A)
 &rst
  ixpk= 315, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   27 LEU  MDY          13 GLY  HA-         4.50    (#    316:20  Unique         2.11, 5.56 A)
 &rst
  ixpk= 316, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 185, 186,
 &end
#
#    0 AMB  20-3:319      0 AMB  20-1:319    4.50    (#    319:20  Double Ambig)
 &rst
  ixpk= 319, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 921, 922, 923, 925, 926, 927, 883, 884, 885, 887,
       888, 889,
 igr2= 152, 153, 152, 153,
 &end
#
#   27 LEU  MDY          11 TYR  HB+         4.50    (#    320:20  Unique         2.04, 4.76 A)
 &rst
  ixpk= 320, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 152, 153,
 &end
#
#    0 AMB  20-3:324      0 AMB  20-1:324    2.80    (#    324:20  Double Ambig)
 &rst
  ixpk= 324, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1896,1897,1896,1897,1896,1897,
 igr2=1899,1900,1899,1900,1899,1900,
 &end
#
#  124 ARG  HB-           0 AMB  20-1:326    4.50    (#    326:20  Single Ambig)
 &rst
  ixpk= 326, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1893,1894,
 igr2=1899,1900,1899,1900,
 &end
#
#   28 ASP  HA           28 ASP  HB+         3.50    (#    329:20  Unique         2.56, 2.81 A)
 &rst
  ixpk= 329, nxpk= 20, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 402, 403,
 &end
#
#   28 ASP  HA           28 ASP  HB-         3.50    (#    330:20  Unique         2.56, 2.81 A)
 &rst
  ixpk= 330, nxpk= 20, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 402, 403,
 &end
#
#  108 PHE  HA          108 PHE  HB-         4.50    (#    331:20  Unique         2.36, 2.69 A)
 &rst
  ixpk= 331, nxpk= 20, iat=1619,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1621,1622,
 &end
#
#   44 PHE  HA           44 PHE  HB-         3.50    (#    333:20  Unique         2.38, 2.69 A)
 &rst
  ixpk= 333, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 633, 634,
 &end
#
#   21 TYR  HA           21 TYR  HB+         3.50    (#    336:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 336, nxpk= 20, iat= 297,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 299, 300,
 &end
#
#  104 THR  HA          104 THR  HB          4.50    (#    337:20  Unique         2.32, 2.56 A)
 &rst
  ixpk= 337, nxpk= 20, iat=1567,1569, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:338     79 THR  HB          4.50    (#    338:20  Single Ambig)
 &rst
  ixpk= 338, nxpk= 20, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:339     79 THR  HB          3.50    (#    339:20  Single Ambig)
 &rst
  ixpk= 339, nxpk= 20, iat=  -1,1186, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 900, 901,1188,1189,1190,
 &end
#
#   26 ALA  MB           16 THR  HB          5.50    (#    340:20  Unique         3.02, 5.56 A)
 &rst
  ixpk= 340, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 373, 374, 375,
 &end
#
#   16 THR  HA           16 THR  HB          2.80    (#    341:20  Unique         2.39, 2.84 A)
 &rst
  ixpk= 341, nxpk= 20, iat= 230, 232, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  20-3:342     16 THR  HB          2.80    (#    342:20  Single Ambig)
 &rst
  ixpk= 342, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 238, 234, 235, 236,
 &end
#
#    0 AMB  20-3:343     16 THR  HB          5.50    (#    343:20  Single Ambig)
 &rst
  ixpk= 343, nxpk= 20, iat=  -1, 232, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806, 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:344    110 THR  HB          3.50    (#    344:20  Single Ambig)
 &rst
  ixpk= 344, nxpk= 20, iat=  -1,1655, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1661,1657,1658,1659,
 &end
#
#  105 PRO  HD+         104 THR  HB          4.50    (#    346:20  Unique         2.01, 4.14 A)
 &rst
  ixpk= 346, nxpk= 20, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1580,1581,
 &end
#
#    0 AMB  20-3:347    104 THR  HB          4.50    (#    347:20  Single Ambig)
 &rst
  ixpk= 347, nxpk= 20, iat=  -1,1569, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1575,1571,1572,1573,
 &end
#
#    0 AMB  20-3:350     12 THR  HB          2.80    (#    350:20  Single Ambig)
 &rst
  ixpk= 350, nxpk= 20, iat=  -1, 173, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 179, 175, 176, 177,
 &end
#
#   31 THR  HA           31 THR  HB          4.50    (#    352:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 352, nxpk= 20, iat= 442, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:353     31 THR  HB          3.50    (#    353:20  Single Ambig)
 &rst
  ixpk= 353, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 383, 384, 383, 384,
 &end
#
#   27 LEU  MDX          31 THR  HB          4.50    (#    354:20  Unique         2.05, 5.02 A)
 &rst
  ixpk= 354, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:355     31 THR  HB          3.50    (#    355:20  Single Ambig)
 &rst
  ixpk= 355, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 450, 446, 447, 448,
 &end
#
#   41 THR  HA           41 THR  HB          3.50    (#    356:20  Unique         2.37, 2.43 A)
 &rst
  ixpk= 356, nxpk= 20, iat= 593, 595, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 VAL  MGY          41 THR  HB          3.50    (#    357:20  Unique         2.99, 5.62 A)
 &rst
  ixpk= 357, nxpk= 20, iat=  -1, 595, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:358     41 THR  HB          2.80    (#    358:20  Single Ambig)
 &rst
  ixpk= 358, nxpk= 20, iat=  -1, 595, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 601, 597, 598, 599, 655, 656, 657, 659, 660, 661,
      
 &end
#
#   76 ILE  HB           40 VAL  HA          3.50    (#    359:20  Unique         1.99, 2.23 A)
 &rst
  ixpk= 359, nxpk= 20, iat=1133, 577, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:360     40 VAL  HA          2.80    (#    360:20  Single Ambig)
 &rst
  ixpk= 360, nxpk= 20, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1142,1143,1144, 581, 582, 583, 585, 586, 587, 503,
       504, 505, 507, 508, 509,
 &end
#
#   40 VAL  MGY          40 VAL  HA          3.50    (#    361:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 361, nxpk= 20, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:362      9 SER  HB-         5.50    (#    362:20  Single Ambig)
 &rst
  ixpk= 362, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.06, r4= 9.56,
 igr1= 900, 901, 104, 105, 106, 108, 109, 110,1103,1104,
      
 igr2= 125, 126,
 &end
#
#    0 AMB  20-3:363     54 VAL  HA          5.50    (#    363:20  Single Ambig)
 &rst
  ixpk= 363, nxpk= 20, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 812, 813, 230,
 &end
#
#   55 GLY  HA-          54 VAL  HA          7.00    (#    364:20  Unique         4.41, 4.47 A)
 &rst
  ixpk= 364, nxpk= 20, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 812, 813,
 &end
#
#   15 VAL  HB           54 VAL  HA          4.50    (#    365:20  Unique         2.00, 2.22 A)
 &rst
  ixpk= 365, nxpk= 20, iat= 216, 796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 VAL  HB           54 VAL  HA          4.50    (#    366:20  Unique         2.42, 2.81 A)
 &rst
  ixpk= 366, nxpk= 20, iat= 798, 796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:367     54 VAL  HA          2.80    (#    367:20  Single Ambig)
 &rst
  ixpk= 367, nxpk= 20, iat=  -1, 796, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806, 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:368      0 AMB  20-1:368    4.50    (#    368:20  Double Ambig)
 &rst
  ixpk= 368, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.63, r4=10.13,
 igr1= 850, 851, 852, 854, 855, 856, 138, 139, 140, 142,
       143, 144, 138, 139, 140, 142, 143, 144, 258, 259,
       260, 262, 263, 264,
 igr2= 787, 788, 125, 126,
 &end
#
#    0 AMB  20-3:369      9 SER  HB-         4.50    (#    369:20  Single Ambig)
 &rst
  ixpk= 369, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=  87,  88,  87,  88, 102,
 igr2= 125, 126,
 &end
#
#    9 SER  HA            9 SER  HB+         3.50    (#    370:20  Unique         2.24, 2.65 A)
 &rst
  ixpk= 370, nxpk= 20, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 125, 126,
 &end
#
#    0 AMB  20-3:372      0 AMB  20-1:372    4.50    (#    372:20  Double Ambig)
 &rst
  ixpk= 372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=  87,  88,  87,  88, 102,
 igr2= 125, 126, 125, 126, 125, 126,
 &end
#
#    0 AMB  20-3:375      0 AMB  20-1:375    3.50    (#    375:20  Double Ambig)
 &rst
  ixpk= 375, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 850, 851, 852, 854, 855, 856, 800, 801, 802, 804,
       805, 806, 218, 219, 220, 222, 223, 224,
 igr2= 787, 788, 787, 788, 787, 788,
 &end
#
#   18 LEU  MDX          53 SER  HB+         5.50    (#    376:20  Unique         4.40, 6.94 A)
 &rst
  ixpk= 376, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 258, 259, 260, 262, 263, 264,
 igr2= 787, 788,
 &end
#
#   58 VAL  MGX          53 SER  HB+         4.50    (#    377:20  Unique         3.57, 7.37 A)
 &rst
  ixpk= 377, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 850, 851, 852, 854, 855, 856,
 igr2= 787, 788,
 &end
#
#   53 SER  HA           53 SER  HB+         3.50    (#    378:20  Unique         2.29, 2.78 A)
 &rst
  ixpk= 378, nxpk= 20, iat= 785,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 787, 788,
 &end
#
#    0 AMB  20-3:381      0 AMB  20-1:381    2.80    (#    381:20  Double Ambig)
 &rst
  ixpk= 381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 123, 785,
 igr2= 125, 126, 787, 788,
 &end
#
#    0 AMB  20-3:383     53 SER  HB-         5.50    (#    383:20  Single Ambig)
 &rst
  ixpk= 383, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 819, 749,
 igr2= 787, 788,
 &end
#
#    0 AMB  20-3:386     51 HIS  HB-         4.50    (#    386:20  Single Ambig)
 &rst
  ixpk= 386, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 581, 582, 583, 585, 586, 587, 771,
 igr2= 751, 752,
 &end
#
#   51 HIS  HA           51 HIS  HB-         4.50    (#    387:20  Unique         2.51, 2.81 A)
 &rst
  ixpk= 387, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 751, 752,
 &end
#
#   62 VAL  HB            7 VAL  HA          3.50    (#    388:20  Unique         2.27, 4.03 A)
 &rst
  ixpk= 388, nxpk= 20, iat= 919, 100, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 VAL  MGX           7 VAL  HA          3.50    (#    390:20  Unique         2.28, 3.44 A)
 &rst
  ixpk= 390, nxpk= 20, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:391      7 VAL  HA          2.80    (#    391:20  Single Ambig)
 &rst
  ixpk= 391, nxpk= 20, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 921, 922, 923, 925, 926, 927, 104, 105, 106, 108,
       109, 110,
 &end
#
#   62 VAL  MGX           7 VAL  HA          2.80    (#    392:20  Unique         2.00, 3.95 A)
 &rst
  ixpk= 392, nxpk= 20, iat=  -1, 100, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   63 LEU  MDY          75 SER  HB+         3.50    (#    394:20  Unique         2.01, 4.08 A)
 &rst
  ixpk= 394, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-3:396     75 SER  HB-         5.50    (#    396:20  Single Ambig)
 &rst
  ixpk= 396, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 935, 936, 935, 936,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-3:397     75 SER  HB-         3.50    (#    397:20  Single Ambig)
 &rst
  ixpk= 397, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1176,1177,1178, 938,
 igr2=1122,1123,
 &end
#
#   63 LEU  MDY          75 SER  HB-         4.50    (#    398:20  Unique         2.01, 4.08 A)
 &rst
  ixpk= 398, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1122,1123,
 &end
#
#   63 LEU  MDX          75 SER  HB-         4.50    (#    399:20  Unique         2.01, 4.08 A)
 &rst
  ixpk= 399, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1122,1123,
 &end
#
#    0 AMB  20-3:401      0 AMB  20-1:401    4.50    (#    401:20  Double Ambig)
 &rst
  ixpk= 401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 935, 936, 935, 936,
 igr2=1092,1093,1092,1093,
 &end
#
#    0 AMB  20-3:402      0 AMB  20-1:402    3.50    (#    402:20  Double Ambig)
 &rst
  ixpk= 402, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.77, r4= 6.27,
 igr1= 954, 955, 956,1054,1055,
 igr2=1092,1093,1092,1093,
 &end
#
#   63 LEU  MDY          73 SER  HB+         4.50    (#    403:20  Unique         2.44, 5.34 A)
 &rst
  ixpk= 403, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-3:404     73 SER  HB-         4.50    (#    404:20  Single Ambig)
 &rst
  ixpk= 404, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 935, 936, 935, 936,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-3:405     73 SER  HB-         3.50    (#    405:20  Single Ambig)
 &rst
  ixpk= 405, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 954, 955, 956,1054,1055,
 igr2=1092,1093,
 &end
#
#   63 LEU  MDY          73 SER  HB-         4.50    (#    406:20  Unique         2.44, 5.34 A)
 &rst
  ixpk= 406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-3:407     73 SER  HB-         5.50    (#    407:20  Single Ambig)
 &rst
  ixpk= 407, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 940, 941, 942, 944, 945, 946, 921, 922, 923, 925,
       926, 927,
 igr2=1092,1093,
 &end
#
#    0 AMB  20-3:413      0 AMB  20-1:413    2.80    (#    413:20  Double Ambig)
 &rst
  ixpk= 413, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1556,1505,
 igr2=1558,1559,1558,1559,1507,1508,1507,1508,
 &end
#
#   15 VAL  MGY          15 VAL  HA          3.50    (#    416:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 416, nxpk= 20, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   15 VAL  MGX          15 VAL  HA          3.50    (#    417:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 417, nxpk= 20, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   25 VAL  MGX          15 VAL  HA          3.50    (#    418:20  Unique         1.99, 3.81 A)
 &rst
  ixpk= 418, nxpk= 20, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          15 VAL  HA          4.50    (#    419:20  Unique         1.99, 3.81 A)
 &rst
  ixpk= 419, nxpk= 20, iat=  -1, 214, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   37 ILE  QG2           0 AMB  20-1:420    5.50    (#    420:20  Single Ambig)
 &rst
  ixpk= 420, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 536, 537, 538,
 igr2= 553, 554, 553, 554,
 &end
#
#   22 GLY  HA-          37 ILE  HA          4.50    (#    421:20  Unique         2.85, 4.11 A)
 &rst
  ixpk= 421, nxpk= 20, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 318, 319,
 &end
#
#    0 AMB  20-3:422     37 ILE  HA          2.80    (#    422:20  Single Ambig)
 &rst
  ixpk= 422, nxpk= 20, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 540, 541, 540, 541, 534,
 &end
#
#   40 VAL  MGX          37 ILE  HA          2.80    (#    423:20  Unique         2.00, 4.17 A)
 &rst
  ixpk= 423, nxpk= 20, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:425     37 ILE  HA          3.50    (#    425:20  Single Ambig)
 &rst
  ixpk= 425, nxpk= 20, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 581, 582, 583, 585, 586, 587, 712, 713, 714,
 &end
#
#   36 HIS  HA           36 HIS  HB+         4.50    (#    427:20  Unique         2.52, 2.81 A)
 &rst
  ixpk= 427, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#    0 AMB  20-3:428     31 THR  HA          2.80    (#    428:20  Single Ambig)
 &rst
  ixpk= 428, nxpk= 20, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 450, 446, 447, 448,
 &end
#
#   42 HIS  HA           42 HIS  HB+         4.50    (#    432:20  Unique         2.37, 2.62 A)
 &rst
  ixpk= 432, nxpk= 20, iat= 607,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 609, 610,
 &end
#
#   31 THR  HB           31 THR  HA          4.50    (#    433:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 433, nxpk= 20, iat= 444, 442, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:434      0 AMB  20-1:434    3.50    (#    434:20  Double Ambig)
 &rst
  ixpk= 434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1586,1587,1361,1362,1421,1422,
 igr2=1589,1364,1424,
 &end
#
#    0 AMB  20-3:436      0 AMB  20-1:436    5.50    (#    436:20  Double Ambig)
 &rst
  ixpk= 436, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1580,1581,1355,1356,1415,1416,
 igr2=1589,1364,1424,
 &end
#
#    0 AMB  20-3:437      0 AMB  20-1:437    2.80    (#    437:20  Double Ambig)
 &rst
  ixpk= 437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1586,1587,1361,1362,1421,1422,
 igr2=1589,1364,1424,
 &end
#
#    0 AMB  20-3:441     83 PRO  HA          3.50    (#    441:20  Single Ambig)
 &rst
  ixpk= 441, nxpk= 20, iat=  -1,1243, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1240,1241,1254,1255,
 &end
#
#   62 VAL  HB           62 VAL  HA          5.50    (#    443:20  Unique         2.42, 2.66 A)
 &rst
  ixpk= 443, nxpk= 20, iat= 919, 917, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 VAL  MGY          62 VAL  HA          3.50    (#    444:20  Unique         2.26, 3.35 A)
 &rst
  ixpk= 444, nxpk= 20, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-3:445     62 VAL  HA          5.50    (#    445:20  Single Ambig)
 &rst
  ixpk= 445, nxpk= 20, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 938,1106, 897, 898,
 &end
#
#    0 AMB  20-3:446     62 VAL  HA          2.80    (#    446:20  Single Ambig)
 &rst
  ixpk= 446, nxpk= 20, iat=  -1, 917, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1108,1109,1110,1112,1113,1114, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  20-3:452    110 THR  HA          3.50    (#    452:20  Single Ambig)
 &rst
  ixpk= 452, nxpk= 20, iat=  -1,1653, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1657,1658,1659,1661,
 &end
#
#   98 VAL  HB           98 VAL  HA          5.50    (#    453:20  Unique         2.42, 2.64 A)
 &rst
  ixpk= 453, nxpk= 20, iat=1491,1489, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:454     98 VAL  HA          4.50    (#    454:20  Single Ambig)
 &rst
  ixpk= 454, nxpk= 20, iat=  -1,1489, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1493,1494,1495,1497,1498,1499,1493,1494,1495,1497,
      1498,1499,
 &end
#
#  119 ILE  HB          119 ILE  HA          4.50    (#    455:20  Unique         2.44, 2.64 A)
 &rst
  ixpk= 455, nxpk= 20, iat=1817,1815, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  119 ILE  HG1+        119 ILE  HA          5.50    (#    456:20  Unique         2.26, 3.15 A)
 &rst
  ixpk= 456, nxpk= 20, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1823,1824,
 &end
#
#  119 ILE  HG1-        119 ILE  HA          4.50    (#    457:20  Unique         2.26, 3.15 A)
 &rst
  ixpk= 457, nxpk= 20, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1823,1824,
 &end
#
#    0 AMB  20-3:458    119 ILE  HA          4.50    (#    458:20  Single Ambig)
 &rst
  ixpk= 458, nxpk= 20, iat=  -1,1815, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1826,1827,1828,1819,1820,1821,
 &end
#
#    0 AMB  20-3:459     16 THR  HA          3.50    (#    459:20  Single Ambig)
 &rst
  ixpk= 459, nxpk= 20, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806,
 &end
#
#   16 THR  HB           16 THR  HA          3.50    (#    461:20  Unique         2.39, 2.84 A)
 &rst
  ixpk= 461, nxpk= 20, iat= 232, 230, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:462     16 THR  HA          3.50    (#    462:20  Single Ambig)
 &rst
  ixpk= 462, nxpk= 20, iat=  -1, 230, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 234, 235, 236, 238,
 &end
#
#   72 ILE  HA           65 VAL  HA          3.50    (#    463:20  Unique         2.49, 2.86 A)
 &rst
  ixpk= 463, nxpk= 20, iat=1071, 962, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   72 ILE  HG1-         65 VAL  HA          4.50    (#    464:20  Unique         3.31, 4.84 A)
 &rst
  ixpk= 464, nxpk= 20, iat=  -1, 962, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1080,
 &end
#
#    0 AMB  20-3:465     65 VAL  HA          2.80    (#    465:20  Single Ambig)
 &rst
  ixpk= 465, nxpk= 20, iat=  -1, 962, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#    0 AMB  20-3:466     65 VAL  HA          4.50    (#    466:20  Single Ambig)
 &rst
  ixpk= 466, nxpk= 20, iat=  -1, 962, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1075,1076,1077, 921, 922, 923, 925, 926, 927,
 &end
#
#   65 VAL  HA           72 ILE  HA          4.50    (#    470:20  Unique         2.49, 2.86 A)
 &rst
  ixpk= 470, nxpk= 20, iat= 962,1071, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 ILE  HG1-         72 ILE  HA          4.50    (#    471:20  Unique         2.57, 3.02 A)
 &rst
  ixpk= 471, nxpk= 20, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1080,
 &end
#
#    0 AMB  20-3:472     72 ILE  HA          4.50    (#    472:20  Single Ambig)
 &rst
  ixpk= 472, nxpk= 20, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   72 ILE  QG2          72 ILE  HA          3.50    (#    473:20  Unique         2.30, 3.04 A)
 &rst
  ixpk= 473, nxpk= 20, iat=  -1,1071, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1075,1076,1077,
 &end
#
#   44 PHE  HA           45 VAL  HA          5.50    (#    474:20  Unique         4.36, 4.39 A)
 &rst
  ixpk= 474, nxpk= 20, iat= 631, 651, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:475     45 VAL  HA          3.50    (#    475:20  Single Ambig)
 &rst
  ixpk= 475, nxpk= 20, iat=  -1, 651, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 597, 598, 599, 655, 656, 657, 659, 660, 661, 601,
      
 &end
#
#   45 VAL  MGX          45 VAL  HA          3.50    (#    476:20  Unique         2.24, 3.40 A)
 &rst
  ixpk= 476, nxpk= 20, iat=  -1, 651, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#  118 TRP  HA            0 AMB  20-1:477    3.50    (#    477:20  Single Ambig)
 &rst
  ixpk= 477, nxpk= 20, iat=1791,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1793,1794,1793,1794,
 &end
#
#  128 ILE  HB          128 ILE  HA          5.50    (#    478:20  Unique         2.33, 2.46 A)
 &rst
  ixpk= 478, nxpk= 20, iat=1970,1968, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:479    128 ILE  HA          4.50    (#    479:20  Single Ambig)
 &rst
  ixpk= 479, nxpk= 20, iat=  -1,1968, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1979,1980,1981,1972,1973,1974,
 &end
#
#   25 VAL  MGX          25 VAL  HA          4.50    (#    481:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 481, nxpk= 20, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          25 VAL  HA          4.50    (#    482:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 482, nxpk= 20, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:483     38 SER  HA          3.50    (#    483:20  Single Ambig)
 &rst
  ixpk= 483, nxpk= 20, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 553, 554, 553, 554,
 &end
#
#    0 AMB  20-3:484     38 SER  HA          5.50    (#    484:20  Single Ambig)
 &rst
  ixpk= 484, nxpk= 20, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 536, 537, 538, 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:489      0 AMB  20-1:489    2.80    (#    489:20  Double Ambig)
 &rst
  ixpk= 489, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1819,1820,1821,1826,1827,1828,
 igr2=1823,1824,1823,1824,
 &end
#
#  119 ILE  HA          119 ILE  HG1-        5.50    (#    490:20  Unique         2.26, 3.15 A)
 &rst
  ixpk= 490, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1823,1824,
 &end
#
#    0 AMB  20-3:491    119 ILE  HG1-        2.80    (#    491:20  Single Ambig)
 &rst
  ixpk= 491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1819,1820,1821,1826,1827,1828,
 igr2=1823,1824,
 &end
#
#    0 AMB  20-3:515      0 AMB  20-1:515    4.50    (#    515:20  Double Ambig)
 &rst
  ixpk= 515, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1=1891,1667,1949,
 igr2=1896,1897,1896,1897,1672,1954,
 &end
#
#    0 AMB  20-3:516      0 AMB  20-1:516    4.50    (#    516:20  Double Ambig)
 &rst
  ixpk= 516, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1899,1900,1899,1900,1899,1900,
 igr2=1896,1897,1896,1897,1896,1897,
 &end
#
#   52 LEU  HB+          52 LEU  HG          2.80    (#    524:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 524, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 768, 769,
 &end
#
#   27 LEU  HB+          27 LEU  HG          3.50    (#    529:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 529, nxpk= 20, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 383, 384,
 &end
#
#   51 HIS  HB-          52 LEU  HG          7.00    (#    530:20  Unique         2.70, 3.36 A)
 &rst
  ixpk= 530, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 751, 752,
 &end
#
#   51 HIS  HB+          52 LEU  HG          7.00    (#    531:20  Unique         2.70, 3.36 A)
 &rst
  ixpk= 531, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 751, 752,
 &end
#
#   52 LEU  HB-          52 LEU  HG          3.50    (#    532:20  Unique         2.44, 2.77 A)
 &rst
  ixpk= 532, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 768, 769,
 &end
#
#   76 ILE  QG2          52 LEU  HG          5.50    (#    533:20  Unique         2.52, 5.12 A)
 &rst
  ixpk= 533, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1135,1136,1137,
 &end
#
#    0 AMB  20-3:534     52 LEU  HG          2.80    (#    534:20  Single Ambig)
 &rst
  ixpk= 534, nxpk= 20, iat=  -1, 771, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 773, 774, 775, 777, 778, 779, 581, 582, 583, 585,
       586, 587,
 &end
#
#    0 AMB  20-3:539     27 LEU  HG          4.50    (#    539:20  Single Ambig)
 &rst
  ixpk= 539, nxpk= 20, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1= 883, 884, 885, 887, 888, 889,1075,1076,1077, 921,
       922, 923, 925, 926, 927,
 &end
#
#   27 LEU  MDY          27 LEU  HG          3.50    (#    540:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 540, nxpk= 20, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  MDX          27 LEU  HG          3.50    (#    541:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 541, nxpk= 20, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   49 ASN  HB-          18 LEU  MDY         7.00    (#    543:20  Unique         2.01, 5.21 A)
 &rst
  ixpk= 543, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 722, 723,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#    0 AMB  20-3:544     18 LEU  MDY         3.50    (#    544:20  Single Ambig)
 &rst
  ixpk= 544, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 720, 785,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   18 LEU  HB+          18 LEU  MDY         3.50    (#    545:20  Unique         2.00, 3.26 A)
 &rst
  ixpk= 545, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 253, 254,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   18 LEU  HG           18 LEU  MDY         2.80    (#    546:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 546, nxpk= 20, iat= 256,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   36 HIS  HB+          34 LEU  MDX         4.50    (#    549:20  Unique         3.51, 6.72 A)
 &rst
  ixpk= 549, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 517, 518,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HB+          34 LEU  MDX         2.80    (#    550:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 550, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 482, 483,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HG           34 LEU  MDX         2.80    (#    553:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 553, nxpk= 20, iat= 485,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   33 GLY  HA-          74 LEU  MDY         4.50    (#    554:20  Unique         2.06, 4.68 A)
 &rst
  ixpk= 554, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 473, 474,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   60 VAL  HB           74 LEU  MDY         4.50    (#    555:20  Unique         2.17, 4.49 A)
 &rst
  ixpk= 555, nxpk= 20, iat= 881,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HB+          74 LEU  MDY         4.50    (#    556:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1103,1104,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  20-3:557     74 LEU  MDY         2.80    (#    557:20  Single Ambig)
 &rst
  ixpk= 557, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1106, 357,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HB-          74 LEU  MDY         3.50    (#    558:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 558, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1103,1104,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  20-3:559     74 LEU  MDY         4.50    (#    559:20  Single Ambig)
 &rst
  ixpk= 559, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 921, 922, 923, 925, 926, 927, 503, 504, 505, 507,
       508, 509,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   25 VAL  MGY          74 LEU  MDY         4.50    (#    561:20  Unique         2.89, 6.81 A)
 &rst
  ixpk= 561, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   27 LEU  MDY          74 LEU  MDY         4.50    (#    562:20  Unique         3.11, 6.73 A)
 &rst
  ixpk= 562, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   27 LEU  MDX          74 LEU  MDY         4.50    (#    563:20  Unique         3.11, 6.73 A)
 &rst
  ixpk= 563, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  20-3:568     63 LEU  MDY         4.50    (#    568:20  Single Ambig)
 &rst
  ixpk= 568, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 906, 907, 906, 907,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:569      0 AMB  20-1:569    3.50    (#    569:20  Double Ambig)
 &rst
  ixpk= 569, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 318, 319, 933,
 igr2= 487, 488, 489, 491, 492, 493, 940, 941, 942, 944,
       945, 946,
 &end
#
#    0 AMB  20-3:570     63 LEU  MDY         3.50    (#    570:20  Single Ambig)
 &rst
  ixpk= 570, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1122,1123,1092,1093,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:571      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= 8.58, r4= 9.08,
 igr1=1122,1123, 318, 319,
 igr2= 940, 941, 942, 944, 945, 946, 487, 488, 489, 491,
       492, 493,
 &end
#
#    0 AMB  20-3:574      0 AMB  20-1:574    5.50    (#    574:20  Double Ambig)
 &rst
  ixpk= 574, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 275, 276,1133,
 igr2= 487, 488, 489, 491, 492, 493, 940, 941, 942, 944,
       945, 946,
 &end
#
#    0 AMB  20-3:575     63 LEU  MDY         2.80    (#    575:20  Single Ambig)
 &rst
  ixpk= 575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 938,1176,1177,1178,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:597     18 LEU  MDX         4.50    (#    597:20  Single Ambig)
 &rst
  ixpk= 597, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 720, 785,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   54 VAL  HA           18 LEU  MDX         5.50    (#    598:20  Unique         2.70, 5.25 A)
 &rst
  ixpk= 598, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   18 LEU  HB+          18 LEU  MDX         3.50    (#    599:20  Unique         2.00, 3.26 A)
 &rst
  ixpk= 599, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 253, 254,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   52 LEU  HB+          18 LEU  MDX         3.50    (#    600:20  Unique         2.00, 4.15 A)
 &rst
  ixpk= 600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 768, 769,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   52 LEU  HB-          18 LEU  MDX         2.80    (#    601:20  Unique         2.00, 4.15 A)
 &rst
  ixpk= 601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 768, 769,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   23 ALA  MB           18 LEU  MDX         2.80    (#    602:20  Unique         2.00, 4.80 A)
 &rst
  ixpk= 602, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 327, 328, 329,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   46 LYS  HA            0 AMB  20-1:606    4.50    (#    606:20  Single Ambig)
 &rst
  ixpk= 606, nxpk= 20, iat= 667,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 672, 673, 672, 673,
 &end
#
#   44 PHE  HB-           0 AMB  20-1:607    4.50    (#    607:20  Single Ambig)
 &rst
  ixpk= 607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 633, 634,
 igr2= 672, 673, 672, 673,
 &end
#
#    0 AMB  20-3:609      0 AMB  20-1:609    4.50    (#    609:20  Double Ambig)
 &rst
  ixpk= 609, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 203, 204, 203, 204,
 igr2= 197, 198, 197, 198,
 &end
#
#    4 LYS  HA            4 LYS  HG+         4.50    (#    611:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 611, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  48,  49,
 &end
#
#    0 AMB  20-3:612      0 AMB  20-1:612    5.50    (#    612:20  Double Ambig)
 &rst
  ixpk= 612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.00, r4=11.50,
 igr1=  54,  55,  54,  55, 906, 907, 906, 907,
 igr2=  48,  49,  48,  49, 900, 901, 900, 901,
 &end
#
#    4 LYS  HB-           4 LYS  HG+         3.50    (#    613:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  45,  46,
 igr2=  48,  49,
 &end
#
#    0 AMB  20-3:614      0 AMB  20-1:614    4.50    (#    614:20  Double Ambig)
 &rst
  ixpk= 614, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1949,1667,
 igr2=1956,1957,1958,1960,1961,1962,1674,1675,1676,1678,
      1679,1680,
 &end
#
#    0 AMB  20-3:617     77 ARG  HG-         5.50    (#    617:20  Single Ambig)
 &rst
  ixpk= 617, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 903, 904, 903, 904, 897, 898,
 igr2=1155,1156,
 &end
#
#    0 AMB  20-3:618      4 LYS  HG-         4.50    (#    618:20  Single Ambig)
 &rst
  ixpk= 618, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  54,  55,  54,  55,
 igr2=  48,  49,
 &end
#
#   89 LYS  HA            0 AMB  20-1:621    7.00    (#    621:20  Single Ambig)
 &rst
  ixpk= 621, nxpk= 20, iat=1334,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1339,1340,1339,1340,
 &end
#
#    0 AMB  20-3:626     14 LYS  HG-         3.50    (#    626:20  Single Ambig)
 &rst
  ixpk= 626, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 203, 204, 203, 204,
 igr2= 197, 198,
 &end
#
#   27 LEU  HA           27 LEU  MDX         5.50    (#    631:20  Unique         1.99, 3.90 A)
 &rst
  ixpk= 631, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   31 THR  HB           27 LEU  MDX         5.50    (#    632:20  Unique         2.05, 5.02 A)
 &rst
  ixpk= 632, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:635     27 LEU  MDX         5.50    (#    635:20  Single Ambig)
 &rst
  ixpk= 635, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1= 185, 186, 473, 474,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:636     27 LEU  MDX         5.50    (#    636:20  Single Ambig)
 &rst
  ixpk= 636, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=  67,  68, 867, 868,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   72 ILE  HB           27 LEU  MDX         5.50    (#    637:20  Unique         3.15, 7.33 A)
 &rst
  ixpk= 637, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:638     27 LEU  MDX         2.80    (#    638:20  Single Ambig)
 &rst
  ixpk= 638, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 446, 447, 448, 386,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:639     27 LEU  MDX         4.50    (#    639:20  Single Ambig)
 &rst
  ixpk= 639, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:640     27 LEU  MDX         2.80    (#    640:20  Single Ambig)
 &rst
  ixpk= 640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.93, r4= 6.43,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077, 883,
       884, 885, 887, 888, 889,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   25 VAL  MGY          27 LEU  MDX         3.50    (#    641:20  Unique         2.64, 7.32 A)
 &rst
  ixpk= 641, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   33 GLY  HA-          74 LEU  MDX         5.50    (#    651:20  Unique         2.06, 4.68 A)
 &rst
  ixpk= 651, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 473, 474,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   62 VAL  HA           74 LEU  MDX         3.50    (#    652:20  Unique         2.00, 4.41 A)
 &rst
  ixpk= 652, nxpk= 20, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HB+          74 LEU  MDX         4.50    (#    654:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 654, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1103,1104,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HG           74 LEU  MDX         4.50    (#    655:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 655, nxpk= 20, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HB-          74 LEU  MDX         3.50    (#    656:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 656, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1103,1104,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   62 VAL  MGY          74 LEU  MDX         4.50    (#    657:20  Unique         2.00, 5.75 A)
 &rst
  ixpk= 657, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 921, 922, 923, 925, 926, 927,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   27 LEU  MDY          74 LEU  MDX         4.50    (#    659:20  Unique         3.11, 6.73 A)
 &rst
  ixpk= 659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   27 LEU  MDX          74 LEU  MDX         3.50    (#    660:20  Unique         3.11, 6.73 A)
 &rst
  ixpk= 660, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   76 ILE  HA           60 VAL  MGY         4.50    (#    661:20  Unique         2.91, 6.00 A)
 &rst
  ixpk= 661, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:662     60 VAL  MGY         4.50    (#    662:20  Single Ambig)
 &rst
  ixpk= 662, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 848, 501,1133,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:663     60 VAL  MGY         2.80    (#    663:20  Single Ambig)
 &rst
  ixpk= 663, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1139,1140,1139,1140, 881,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:664     60 VAL  MGY         3.50    (#    664:20  Single Ambig)
 &rst
  ixpk= 664, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1103,1104,1188,1189,1190,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:665     60 VAL  MGY         4.50    (#    665:20  Single Ambig)
 &rst
  ixpk= 665, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
 igr1=1142,1143,1144, 503, 504, 505, 507, 508, 509,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   25 VAL  MGY          60 VAL  MGY         3.50    (#    666:20  Unique         2.20, 5.36 A)
 &rst
  ixpk= 666, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   27 LEU  MDY          60 VAL  MGY         5.50    (#    667:20  Unique         3.32, 7.64 A)
 &rst
  ixpk= 667, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:669     40 VAL  MGX         4.50    (#    669:20  Single Ambig)
 &rst
  ixpk= 669, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 709, 710, 709, 710,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:670     60 VAL  MGY         5.50    (#    670:20  Single Ambig)
 &rst
  ixpk= 670, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 357, 773, 774, 775, 777, 778, 779,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:672     52 LEU  MDX         5.50    (#    672:20  Single Ambig)
 &rst
  ixpk= 672, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 749, 499,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   51 HIS  HB-          52 LEU  MDX         5.50    (#    673:20  Unique         3.77, 5.49 A)
 &rst
  ixpk= 673, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 751, 752,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:674     52 LEU  MDX         4.50    (#    674:20  Single Ambig)
 &rst
  ixpk= 674, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 751, 752, 821, 822,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   56 ASP  HB-          52 LEU  MDX         5.50    (#    675:20  Unique         5.33, 8.28 A)
 &rst
  ixpk= 675, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 821, 822,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:676     52 LEU  MDX         5.50    (#    676:20  Single Ambig)
 &rst
  ixpk= 676, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=1203,1204,1203,1204,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:677     52 LEU  MDX         7.00    (#    677:20  Single Ambig)
 &rst
  ixpk= 677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1=1133, 848, 501,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:678     52 LEU  MDX         7.00    (#    678:20  Single Ambig)
 &rst
  ixpk= 678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1=1139,1140,1139,1140,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   52 LEU  HB-          52 LEU  MDX         3.50    (#    680:20  Unique         2.09, 3.26 A)
 &rst
  ixpk= 680, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 768, 769,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:681     52 LEU  MDX         2.80    (#    681:20  Single Ambig)
 &rst
  ixpk= 681, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 581, 582, 583, 585, 586, 587, 771,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   25 VAL  MGY          52 LEU  MDX         5.50    (#    682:20  Unique         3.97, 7.44 A)
 &rst
  ixpk= 682, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:689      0 AMB  20-1:689    3.50    (#    689:20  Double Ambig)
 &rst
  ixpk= 689, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1949,1667,
 igr2=1956,1957,1958,1960,1961,1962,1674,1675,1676,1678,
      1679,1680,
 &end
#
#   64 ALA  HA            7 VAL  MGX         2.80    (#    691:20  Unique         2.04, 4.24 A)
 &rst
  ixpk= 691, nxpk= 20, iat= 952,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    7 VAL  HA            7 VAL  MGX         2.80    (#    692:20  Unique         2.28, 3.44 A)
 &rst
  ixpk= 692, nxpk= 20, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:693      7 VAL  MGX         2.80    (#    693:20  Single Ambig)
 &rst
  ixpk= 693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 102,  87,  88,  87,  88,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   24 PHE  HB+          16 THR  MG2         4.50    (#    697:20  Unique         2.07, 5.11 A)
 &rst
  ixpk= 697, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 337, 338,
 igr2= 234, 235, 236,
 &end
#
#   16 THR  HA           16 THR  MG2         2.80    (#    698:20  Unique         2.11, 3.09 A)
 &rst
  ixpk= 698, nxpk= 20, iat= 230,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 234, 235, 236,
 &end
#
#   16 THR  HB           16 THR  MG2         2.80    (#    699:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 699, nxpk= 20, iat= 232,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 234, 235, 236,
 &end
#
#    0 AMB  20-3:700     16 THR  MG2         4.50    (#    700:20  Single Ambig)
 &rst
  ixpk= 700, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 461, 462, 461, 462,
 igr2= 234, 235, 236,
 &end
#
#    0 AMB  20-3:701     16 THR  MG2         3.50    (#    701:20  Single Ambig)
 &rst
  ixpk= 701, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 194, 195, 194, 195,
 igr2= 234, 235, 236,
 &end
#
#   26 ALA  MB           16 THR  MG2         2.80    (#    702:20  Unique         2.19, 5.28 A)
 &rst
  ixpk= 702, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 373, 374, 375,
 igr2= 234, 235, 236,
 &end
#
#    0 AMB  20-3:703     16 THR  MG2         4.50    (#    703:20  Single Ambig)
 &rst
  ixpk= 703, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.75, r4= 9.25,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806, 800, 801, 802, 804, 805, 806,
 igr2= 234, 235, 236,
 &end
#
#   25 VAL  MGY          16 THR  MG2         5.50    (#    704:20  Unique         4.49, 8.32 A)
 &rst
  ixpk= 704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 234, 235, 236,
 &end
#
#    8 GLY  HA-           7 VAL  MGX         4.50    (#    705:20  Unique         3.42, 5.63 A)
 &rst
  ixpk= 705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 116, 117,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   64 ALA  MB            7 VAL  MGX         3.50    (#    707:20  Unique         2.92, 6.39 A)
 &rst
  ixpk= 707, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 954, 955, 956,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:709      0 AMB  20-1:709    3.50    (#    709:20  Double Ambig)
 &rst
  ixpk= 709, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 933, 214,
 igr2= 104, 105, 106, 108, 109, 110, 218, 219, 220, 222,
       223, 224,
 &end
#
#   54 VAL  HA           15 VAL  MGY         4.50    (#    710:20  Unique         2.03, 3.57 A)
 &rst
  ixpk= 710, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   56 ASP  HB+          15 VAL  MGY         3.50    (#    711:20  Unique         2.95, 5.79 A)
 &rst
  ixpk= 711, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 821, 822,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   15 VAL  HB           15 VAL  MGY         2.80    (#    712:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 712, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   25 VAL  MGY          15 VAL  MGY         4.50    (#    713:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 713, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   48 ILE  QD1          23 ALA  MB          2.80    (#    715:20  Unique         2.05, 4.39 A)
 &rst
  ixpk= 715, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 712, 713, 714,
 igr2= 327, 328, 329,
 &end
#
#   34 LEU  MDY          23 ALA  MB          5.50    (#    716:20  Unique         4.71, 8.12 A)
 &rst
  ixpk= 716, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 327, 328, 329,
 &end
#
#    0 AMB  20-3:717     23 ALA  MB          5.50    (#    717:20  Single Ambig)
 &rst
  ixpk= 717, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 253, 254,1139,1140,
 igr2= 327, 328, 329,
 &end
#
#    0 AMB  20-3:718     23 ALA  MB          3.50    (#    718:20  Single Ambig)
 &rst
  ixpk= 718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 253, 254, 768, 769,
 igr2= 327, 328, 329,
 &end
#
#    0 AMB  20-3:719     54 VAL  MGY         4.50    (#    719:20  Single Ambig)
 &rst
  ixpk= 719, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 230, 812, 813,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   17 GLY  HA+          54 VAL  MGY         3.50    (#    720:20  Unique         1.99, 4.21 A)
 &rst
  ixpk= 720, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 244, 245,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   53 SER  HB+          54 VAL  MGY         7.00    (#    721:20  Unique         4.13, 6.98 A)
 &rst
  ixpk= 721, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 787, 788,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   54 VAL  HA           54 VAL  MGY         2.80    (#    722:20  Unique         2.24, 3.25 A)
 &rst
  ixpk= 722, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   54 VAL  HB           54 VAL  MGY         2.80    (#    723:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 723, nxpk= 20, iat= 798,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:736     79 THR  MG2         7.00    (#    736:20  Single Ambig)
 &rst
  ixpk= 736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 906, 907, 906, 907,
 igr2=1188,1189,1190,
 &end
#
#   59 GLN  HG+          79 THR  MG2         5.50    (#    737:20  Unique         2.35, 6.88 A)
 &rst
  ixpk= 737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 867, 868,
 igr2=1188,1189,1190,
 &end
#
#   60 VAL  MGY          79 THR  MG2         4.50    (#    738:20  Unique         2.62, 6.62 A)
 &rst
  ixpk= 738, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 883, 884, 885, 887, 888, 889,
 igr2=1188,1189,1190,
 &end
#
#   76 ILE  HA           79 THR  MG2         4.50    (#    739:20  Unique         1.99, 2.89 A)
 &rst
  ixpk= 739, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1188,1189,1190,
 &end
#
#    0 AMB  20-3:740     79 THR  MG2         2.80    (#    740:20  Single Ambig)
 &rst
  ixpk= 740, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1186,1184,
 igr2=1188,1189,1190,
 &end
#
#   59 GLN  HG-          79 THR  MG2         5.50    (#    741:20  Unique         2.35, 6.88 A)
 &rst
  ixpk= 741, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 867, 868,
 igr2=1188,1189,1190,
 &end
#
#    0 AMB  20-3:742     79 THR  MG2         4.50    (#    742:20  Single Ambig)
 &rst
  ixpk= 742, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 864, 865,1133,
 igr2=1188,1189,1190,
 &end
#
#   59 GLN  HB-          79 THR  MG2         4.50    (#    743:20  Unique         3.17, 6.79 A)
 &rst
  ixpk= 743, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 864, 865,
 igr2=1188,1189,1190,
 &end
#
#   61 LYS  HB+          79 THR  MG2         4.50    (#    744:20  Unique         3.12, 5.94 A)
 &rst
  ixpk= 744, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 897, 898,
 igr2=1188,1189,1190,
 &end
#
#    0 AMB  20-3:745     79 THR  MG2         3.50    (#    745:20  Single Ambig)
 &rst
  ixpk= 745, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 897, 898,1176,1177,1178,
 igr2=1188,1189,1190,
 &end
#
#   76 ILE  QD1          79 THR  MG2         3.50    (#    746:20  Unique         2.83, 5.59 A)
 &rst
  ixpk= 746, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1142,1143,1144,
 igr2=1188,1189,1190,
 &end
#
#    0 AMB  20-3:747     79 THR  MG2         2.80    (#    747:20  Single Ambig)
 &rst
  ixpk= 747, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144, 850, 851, 852, 854, 855, 856,
 igr2=1188,1189,1190,
 &end
#
#    0 AMB  20-3:748     54 VAL  MGY         4.50    (#    748:20  Single Ambig)
 &rst
  ixpk= 748, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 785, 720,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   17 GLY  HA-          54 VAL  MGY         4.50    (#    749:20  Unique         1.99, 4.21 A)
 &rst
  ixpk= 749, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 244, 245,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   15 VAL  HB           54 VAL  MGY         4.50    (#    750:20  Unique         3.12, 4.97 A)
 &rst
  ixpk= 750, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   18 LEU  HG           54 VAL  MGY         3.50    (#    751:20  Unique         2.00, 5.23 A)
 &rst
  ixpk= 751, nxpk= 20, iat= 256,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   18 LEU  HB-          54 VAL  MGY         4.50    (#    752:20  Unique         2.22, 5.57 A)
 &rst
  ixpk= 752, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 253, 254,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   15 VAL  HB           15 VAL  MGX         2.80    (#    753:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 753, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   56 ASP  HB-          58 VAL  MGY         4.50    (#    755:20  Unique         2.67, 5.84 A)
 &rst
  ixpk= 755, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 821, 822,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:756     58 VAL  MGY         5.50    (#    756:20  Single Ambig)
 &rst
  ixpk= 756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 819, 749,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   56 ASP  HB+          58 VAL  MGY         4.50    (#    757:20  Unique         2.67, 5.84 A)
 &rst
  ixpk= 757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 821, 822,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  HB           58 VAL  MGY         2.80    (#    758:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 758, nxpk= 20, iat= 848,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   15 VAL  HA           15 VAL  MGX         2.80    (#    760:20  Unique         2.27, 3.11 A)
 &rst
  ixpk= 760, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   56 ASP  HB+          15 VAL  MGX         4.50    (#    761:20  Unique         2.95, 5.79 A)
 &rst
  ixpk= 761, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 821, 822,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   54 VAL  HA           15 VAL  MGX         2.80    (#    765:20  Unique         2.03, 3.57 A)
 &rst
  ixpk= 765, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   59 GLN  HG-          58 VAL  MGY         7.00    (#    766:20  Unique         3.10, 6.61 A)
 &rst
  ixpk= 766, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 867, 868,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   62 VAL  HA           62 VAL  MGX         3.50    (#    767:20  Unique         2.26, 3.35 A)
 &rst
  ixpk= 767, nxpk= 20, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    7 VAL  HA           62 VAL  MGX         3.50    (#    768:20  Unique         2.00, 3.95 A)
 &rst
  ixpk= 768, nxpk= 20, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   62 VAL  HB           62 VAL  MGX         3.50    (#    769:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 769, nxpk= 20, iat= 919,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-3:770     35 VAL  MGX         7.00    (#    770:20  Single Ambig)
 &rst
  ixpk= 770, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 567, 568, 567, 568,
 igr2= 503, 504, 505, 507, 508, 509,
 &end
#
#    0 AMB  20-3:771     62 VAL  MGX         4.50    (#    771:20  Single Ambig)
 &rst
  ixpk= 771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 964, 102,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-3:772      0 AMB  20-1:772    2.80    (#    772:20  Double Ambig)
 &rst
  ixpk= 772, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.32, r4= 6.82,
 igr1=1103,1104, 327, 328, 329, 104, 105, 106, 108, 109,
       110,
 igr2= 503, 504, 505, 507, 508, 509, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  20-3:774     27 LEU  MDY         5.50    (#    774:20  Single Ambig)
 &rst
  ixpk= 774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 458, 459, 836, 837, 429, 430, 848,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   72 ILE  HB           27 LEU  MDY         5.50    (#    775:20  Unique         3.15, 7.33 A)
 &rst
  ixpk= 775, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   25 VAL  HB           27 LEU  MDY         4.50    (#    776:20  Unique         3.23, 6.19 A)
 &rst
  ixpk= 776, nxpk= 20, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  HA           27 LEU  MDY         2.80    (#    777:20  Unique         1.99, 3.90 A)
 &rst
  ixpk= 777, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   11 TYR  HB+          27 LEU  MDY         4.50    (#    778:20  Unique         2.04, 4.76 A)
 &rst
  ixpk= 778, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 152, 153,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:779     27 LEU  MDY         4.50    (#    779:20  Single Ambig)
 &rst
  ixpk= 779, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 185, 186, 473, 474,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  HG           27 LEU  MDY         3.50    (#    780:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 780, nxpk= 20, iat= 386,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:781     27 LEU  MDY         4.50    (#    781:20  Single Ambig)
 &rst
  ixpk= 781, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:782     27 LEU  MDY         2.80    (#    782:20  Single Ambig)
 &rst
  ixpk= 782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.27, r4= 6.77,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077, 883,
       884, 885, 887, 888, 889, 921, 922, 923, 925, 926,
       927,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  HB+          27 LEU  MDY         2.80    (#    783:20  Unique         1.96, 3.27 A)
 &rst
  ixpk= 783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 383, 384,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   25 VAL  MGY          27 LEU  MDY         3.50    (#    784:20  Unique         2.64, 7.32 A)
 &rst
  ixpk= 784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   12 THR  HB           12 THR  MG2         2.80    (#    786:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 786, nxpk= 20, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 175, 176, 177,
 &end
#
#   13 GLY  HA-          12 THR  MG2         4.50    (#    787:20  Unique         3.49, 5.26 A)
 &rst
  ixpk= 787, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 185, 186,
 igr2= 175, 176, 177,
 &end
#
#   57 GLU  HG+          12 THR  MG2         3.50    (#    788:20  Unique         2.00, 3.88 A)
 &rst
  ixpk= 788, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 836, 837,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:789     12 THR  MG2         3.50    (#    789:20  Single Ambig)
 &rst
  ixpk= 789, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 836, 837, 864, 865,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:799    110 THR  MG2         2.80    (#    799:20  Single Ambig)
 &rst
  ixpk= 799, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1653,1655,
 igr2=1657,1658,1659,
 &end
#
#   31 THR  HA           31 THR  MG2         2.80    (#    801:20  Unique         2.34, 3.11 A)
 &rst
  ixpk= 801, nxpk= 20, iat= 442,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 446, 447, 448,
 &end
#
#   31 THR  HB           31 THR  MG2         3.50    (#    802:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 802, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 446, 447, 448,
 &end
#
#   72 ILE  HG1+         31 THR  MG2         4.50    (#    803:20  Unique         2.45, 4.60 A)
 &rst
  ixpk= 803, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1079,1080,
 igr2= 446, 447, 448,
 &end
#
#   72 ILE  QD1          31 THR  MG2         2.80    (#    804:20  Unique         2.01, 3.91 A)
 &rst
  ixpk= 804, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1=1082,1083,1084,
 igr2= 446, 447, 448,
 &end
#
#   27 LEU  HB-          31 THR  MG2         3.50    (#    805:20  Unique         3.62, 5.96 A)
 &rst
  ixpk= 805, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 383, 384,
 igr2= 446, 447, 448,
 &end
#
#   27 LEU  MDX          31 THR  MG2         2.80    (#    806:20  Unique         2.13, 5.86 A)
 &rst
  ixpk= 806, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 446, 447, 448,
 &end
#
#    9 SER  HA            0 AMB  20-1:807    4.50    (#    807:20  Single Ambig)
 &rst
  ixpk= 807, nxpk= 20, iat= 123,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:808      0 AMB  20-1:808    4.50    (#    808:20  Double Ambig)
 &rst
  ixpk= 808, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 906, 907, 906, 907, 906, 907,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:809      0 AMB  20-1:809    3.50    (#    809:20  Double Ambig)
 &rst
  ixpk= 809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 897, 898, 897, 898,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   61 LYS  HB-           0 AMB  20-1:810    2.80    (#    810:20  Single Ambig)
 &rst
  ixpk= 810, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 897, 898,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   61 LYS  HG-           0 AMB  20-1:811    3.50    (#    811:20  Single Ambig)
 &rst
  ixpk= 811, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 900, 901,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   25 VAL  HA           25 VAL  MGX         3.50    (#    812:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 812, nxpk= 20, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   15 VAL  HA           25 VAL  MGX         3.50    (#    813:20  Unique         1.99, 3.81 A)
 &rst
  ixpk= 813, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:814     25 VAL  MGX         4.50    (#    814:20  Single Ambig)
 &rst
  ixpk= 814, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 848, 501,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:815     25 VAL  MGX         4.50    (#    815:20  Single Ambig)
 &rst
  ixpk= 815, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1=1139,1140,1139,1140, 200, 201, 200, 201,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  HB           25 VAL  MGX         2.80    (#    816:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 816, nxpk= 20, iat= 357,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   15 VAL  MGY          25 VAL  MGX         2.80    (#    817:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 817, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 218, 219, 220, 222, 223, 224,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   35 VAL  MGY          25 VAL  MGX         3.50    (#    818:20  Unique         2.04, 6.74 A)
 &rst
  ixpk= 818, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 503, 504, 505, 507, 508, 509,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:819     25 VAL  MGX         2.80    (#    819:20  Single Ambig)
 &rst
  ixpk= 819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 503, 504, 505, 507, 508, 509, 883, 884, 885, 887,
       888, 889,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   22 GLY  HA+          34 LEU  MDY         3.50    (#    822:20  Unique         2.08, 5.49 A)
 &rst
  ixpk= 822, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 318, 319,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   22 GLY  HA-          34 LEU  MDY         4.50    (#    823:20  Unique         2.08, 5.49 A)
 &rst
  ixpk= 823, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 318, 319,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:824     34 LEU  MDY         4.50    (#    824:20  Single Ambig)
 &rst
  ixpk= 824, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1060,1061,1060,1061,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:825     34 LEU  MDY         4.50    (#    825:20  Single Ambig)
 &rst
  ixpk= 825, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 501, 275, 276,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HB+          34 LEU  MDY         4.50    (#    826:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 826, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 482, 483,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HB-          34 LEU  MDY         4.50    (#    827:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 827, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 482, 483,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HG           34 LEU  MDY         3.50    (#    828:20  Unique         2.21, 2.63 A)
 &rst
  ixpk= 828, nxpk= 20, iat= 485,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:830     34 LEU  MDY         4.50    (#    830:20  Single Ambig)
 &rst
  ixpk= 830, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 515, 499,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   64 ALA  HA           64 ALA  MB          2.80    (#    833:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 833, nxpk= 20, iat= 952,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 954, 955, 956,
 &end
#
#    0 AMB  20-3:834     64 ALA  MB          2.80    (#    834:20  Single Ambig)
 &rst
  ixpk= 834, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1092,1093,1092,1093,
 igr2= 954, 955, 956,
 &end
#
#    0 AMB  20-3:835     64 ALA  MB          5.50    (#    835:20  Single Ambig)
 &rst
  ixpk= 835, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 102, 964,
 igr2= 954, 955, 956,
 &end
#
#    0 AMB  20-3:836     64 ALA  MB          3.50    (#    836:20  Single Ambig)
 &rst
  ixpk= 836, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 935, 936, 935, 936,
 igr2= 954, 955, 956,
 &end
#
#    7 VAL  MGX          64 ALA  MB          4.50    (#    837:20  Unique         2.92, 6.39 A)
 &rst
  ixpk= 837, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 104, 105, 106, 108, 109, 110,
 igr2= 954, 955, 956,
 &end
#
#    0 AMB  20-3:838     64 ALA  MB          3.50    (#    838:20  Single Ambig)
 &rst
  ixpk= 838, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 104, 105, 106, 108, 109, 110, 966, 967, 968, 970,
       971, 972, 966, 967, 968, 970, 971, 972,
 igr2= 954, 955, 956,
 &end
#
#   63 LEU  MDX          64 ALA  MB          4.50    (#    839:20  Unique         2.02, 6.07 A)
 &rst
  ixpk= 839, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 954, 955, 956,
 &end
#
#  104 THR  HA          104 THR  MG2         4.50    (#    841:20  Unique         2.06, 3.42 A)
 &rst
  ixpk= 841, nxpk= 20, iat=1567,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1571,1572,1573,
 &end
#
#   27 LEU  MDY          31 THR  MG2         4.50    (#    845:20  Unique         2.13, 5.86 A)
 &rst
  ixpk= 845, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 446, 447, 448,
 &end
#
#   62 VAL  HA           62 VAL  MGY         3.50    (#    846:20  Unique         2.26, 3.35 A)
 &rst
  ixpk= 846, nxpk= 20, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   62 VAL  HB           62 VAL  MGY         2.80    (#    847:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 847, 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
#
#    5 PHE  HB-          62 VAL  MGY         3.50    (#    848:20  Unique         3.15, 7.35 A)
 &rst
  ixpk= 848, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  67,  68,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    5 PHE  HB+          62 VAL  MGY         3.50    (#    849:20  Unique         3.15, 7.35 A)
 &rst
  ixpk= 849, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  67,  68,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-3:850     62 VAL  MGY         4.50    (#    850:20  Single Ambig)
 &rst
  ixpk= 850, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1103,1104, 897, 898,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   27 LEU  MDY          62 VAL  MGY         4.50    (#    852:20  Unique         3.34, 8.57 A)
 &rst
  ixpk= 852, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   27 LEU  MDX          62 VAL  MGY         4.50    (#    853:20  Unique         3.34, 8.57 A)
 &rst
  ixpk= 853, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    9 SER  HB-           0 AMB  20-1:855    4.50    (#    855:20  Single Ambig)
 &rst
  ixpk= 855, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 125, 126,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:856      0 AMB  20-1:856    4.50    (#    856:20  Double Ambig)
 &rst
  ixpk= 856, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 152, 153, 152, 153,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:857      0 AMB  20-1:857    3.50    (#    857:20  Double Ambig)
 &rst
  ixpk= 857, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1186,1184,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   10 VAL  HB            0 AMB  20-1:858    2.80    (#    858:20  Single Ambig)
 &rst
  ixpk= 858, nxpk= 20, iat= 136,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  20-3:859      0 AMB  20-1:859    2.80    (#    859:20  Double Ambig)
 &rst
  ixpk= 859, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 900, 901, 900, 901,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   64 ALA  MB            7 VAL  MGY         3.50    (#    862:20  Unique         2.92, 6.39 A)
 &rst
  ixpk= 862, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 954, 955, 956,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    7 VAL  HA            0 AMB  20-1:863    2.80    (#    863:20  Single Ambig)
 &rst
  ixpk= 863, nxpk= 20, iat= 100,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 921, 922, 923, 925, 926, 927, 104, 105, 106, 108,
       109, 110,
 &end
#
#    0 AMB  20-3:864      7 VAL  MGY         3.50    (#    864:20  Single Ambig)
 &rst
  ixpk= 864, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 933, 952,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    8 GLY  HA-           7 VAL  MGY         4.50    (#    865:20  Unique         3.42, 5.63 A)
 &rst
  ixpk= 865, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 116, 117,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:866      7 VAL  MGY         2.80    (#    866:20  Single Ambig)
 &rst
  ixpk= 866, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 102,  87,  88,  87,  88,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   72 ILE  HA            7 VAL  MGY         7.00    (#    867:20  Unique         6.38, 9.42 A)
 &rst
  ixpk= 867, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   55 GLY  HA-          54 VAL  MGX         4.50    (#    869:20  Unique         3.25, 5.30 A)
 &rst
  ixpk= 869, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 812, 813,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   54 VAL  HA           54 VAL  MGX         3.50    (#    870:20  Unique         2.24, 3.25 A)
 &rst
  ixpk= 870, nxpk= 20, iat= 796,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   54 VAL  HB           54 VAL  MGX         2.80    (#    871:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 871, nxpk= 20, iat= 798,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   59 GLN  HG-           0 AMB  20-1:873    4.50    (#    873:20  Single Ambig)
 &rst
  ixpk= 873, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 867, 868,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   25 VAL  MGY          63 LEU  MDX         7.00    (#    876:20  Unique         9.45,13.84 A)
 &rst
  ixpk= 876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=12.72, r4=13.22,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   63 LEU  HA           63 LEU  MDX         2.80    (#    877:20  Unique         2.83, 4.59 A)
 &rst
  ixpk= 877, nxpk= 20, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   62 VAL  HA           63 LEU  MDX         5.50    (#    878:20  Unique         2.78, 5.42 A)
 &rst
  ixpk= 878, nxpk= 20, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:879     63 LEU  MDX         4.50    (#    879:20  Single Ambig)
 &rst
  ixpk= 879, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1122,1123,1092,1093,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    8 GLY  HA-          63 LEU  MDX         5.50    (#    880:20  Unique         4.53, 9.27 A)
 &rst
  ixpk= 880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 116, 117,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   75 SER  HB-          63 LEU  MDX         4.50    (#    881:20  Unique         2.01, 4.08 A)
 &rst
  ixpk= 881, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1122,1123,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:882     63 LEU  MDX         4.50    (#    882:20  Single Ambig)
 &rst
  ixpk= 882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 906, 907, 906, 907,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:883     63 LEU  MDX         2.80    (#    883:20  Single Ambig)
 &rst
  ixpk= 883, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.22, r4= 5.72,
 igr1= 954, 955, 956, 938,1176,1177,1178,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:884     63 LEU  MDX         4.50    (#    884:20  Single Ambig)
 &rst
  ixpk= 884, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 900, 901,1103,1104,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:885     40 VAL  MGY         4.50    (#    885:20  Single Ambig)
 &rst
  ixpk= 885, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1135,1136,1137, 327, 328, 329,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:886     40 VAL  MGY         4.50    (#    886:20  Single Ambig)
 &rst
  ixpk= 886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 318, 319, 593,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   41 THR  HB           40 VAL  MGY         3.50    (#    887:20  Unique         2.99, 5.62 A)
 &rst
  ixpk= 887, nxpk= 20, iat= 595,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   37 ILE  HA           40 VAL  MGY         4.50    (#    888:20  Unique         2.00, 4.17 A)
 &rst
  ixpk= 888, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   40 VAL  HA           40 VAL  MGY         3.50    (#    889:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 889, nxpk= 20, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   51 HIS  HB+          40 VAL  MGY         4.50    (#    891:20  Unique         2.66, 5.55 A)
 &rst
  ixpk= 891, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 751, 752,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   40 VAL  HB           40 VAL  MGY         2.80    (#    892:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 892, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:893     40 VAL  MGY         4.50    (#    893:20  Single Ambig)
 &rst
  ixpk= 893, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1139,1140,1139,1140,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   52 LEU  MDY          40 VAL  MGY         3.50    (#    894:20  Unique         2.00, 5.79 A)
 &rst
  ixpk= 894, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 773, 774, 775, 777, 778, 779,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   52 LEU  HB-          40 VAL  MGY         5.50    (#    895:20  Unique         3.29, 6.85 A)
 &rst
  ixpk= 895, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 768, 769,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:897     40 VAL  MGY         3.50    (#    897:20  Single Ambig)
 &rst
  ixpk= 897, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 258, 259, 260, 262, 263, 264, 543, 544, 545,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   40 VAL  HB           45 VAL  MGY         4.50    (#    899:20  Unique         2.45, 5.27 A)
 &rst
  ixpk= 899, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   44 PHE  HA           45 VAL  MGX         4.50    (#    901:20  Unique         3.80, 5.72 A)
 &rst
  ixpk= 901, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   45 VAL  HA           45 VAL  MGX         2.80    (#    902:20  Unique         2.24, 3.40 A)
 &rst
  ixpk= 902, nxpk= 20, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   40 VAL  HB           45 VAL  MGX         3.50    (#    903:20  Unique         2.45, 5.27 A)
 &rst
  ixpk= 903, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   45 VAL  HB           45 VAL  MGX         2.80    (#    904:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 904, nxpk= 20, iat= 653,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:905     45 VAL  MGX         4.50    (#    905:20  Single Ambig)
 &rst
  ixpk= 905, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 540, 541, 540, 541,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   40 VAL  MGX          45 VAL  MGX         4.50    (#    906:20  Unique         2.54, 6.57 A)
 &rst
  ixpk= 906, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 581, 582, 583, 585, 586, 587,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:913      0 AMB  20-1:913    3.50    (#    913:20  Double Ambig)
 &rst
  ixpk= 913, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1=1079,1080,1079,1080, 253, 254,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972, 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:914      0 AMB  20-1:914    4.50    (#    914:20  Double Ambig)
 &rst
  ixpk= 914, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 256, 954, 955, 956,
 igr2= 800, 801, 802, 804, 805, 806, 104, 105, 106, 108,
       109, 110,
 &end
#
#    0 AMB  20-3:915      0 AMB  20-1:915    2.80    (#    915:20  Double Ambig)
 &rst
  ixpk= 915, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.86, r4= 7.36,
 igr1= 104, 105, 106, 108, 109, 110, 218, 219, 220, 222,
       223, 224,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972, 800, 801, 802, 804, 805, 806,
 &end
#
#   65 VAL  HA            0 AMB  20-1:916    2.80    (#    916:20  Single Ambig)
 &rst
  ixpk= 916, nxpk= 20, iat= 962,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#    0 AMB  20-3:917     45 VAL  MGY         5.50    (#    917:20  Single Ambig)
 &rst
  ixpk= 917, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 667, 553, 554, 553, 554,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:918     45 VAL  MGY         4.50    (#    918:20  Single Ambig)
 &rst
  ixpk= 918, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 709, 710, 709, 710,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   45 VAL  HA           45 VAL  MGY         2.80    (#    919:20  Unique         2.24, 3.40 A)
 &rst
  ixpk= 919, nxpk= 20, iat= 651,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   37 ILE  HA           45 VAL  MGY         4.50    (#    920:20  Unique         3.66, 6.49 A)
 &rst
  ixpk= 920, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:921     45 VAL  MGY         7.00    (#    921:20  Single Ambig)
 &rst
  ixpk= 921, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.89, r4=12.39,
 igr1= 751, 752, 691, 692,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:922     45 VAL  MGY         2.80    (#    922:20  Single Ambig)
 &rst
  ixpk= 922, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 653, 703,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:923     45 VAL  MGY         3.50    (#    923:20  Single Ambig)
 &rst
  ixpk= 923, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 540, 541, 540, 541,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:924     45 VAL  MGY         5.50    (#    924:20  Single Ambig)
 &rst
  ixpk= 924, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=1135,1136,1137,1152,1153, 327, 328, 329,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   37 ILE  QD1          45 VAL  MGY         3.50    (#    925:20  Unique         2.10, 5.62 A)
 &rst
  ixpk= 925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 543, 544, 545,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   25 VAL  HA           25 VAL  MGY         3.50    (#    927:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 927, nxpk= 20, iat= 355,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   15 VAL  HA           25 VAL  MGY         4.50    (#    928:20  Unique         1.99, 3.81 A)
 &rst
  ixpk= 928, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:929      0 AMB  20-1:929    5.50    (#    929:20  Double Ambig)
 &rst
  ixpk= 929, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 381, 667, 553, 554,
 igr2= 359, 360, 361, 363, 364, 365, 655, 656, 657, 659,
       660, 661,
 &end
#
#   13 GLY  HA-          25 VAL  MGY         3.50    (#    930:20  Unique         2.03, 5.28 A)
 &rst
  ixpk= 930, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 185, 186,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:931      0 AMB  20-1:931    2.80    (#    931:20  Double Ambig)
 &rst
  ixpk= 931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 357, 672, 673,
 igr2= 359, 360, 361, 363, 364, 365, 655, 656, 657, 659,
       660, 661,
 &end
#
#   15 VAL  MGY          25 VAL  MGY         3.50    (#    932:20  Unique         2.06, 5.42 A)
 &rst
  ixpk= 932, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 218, 219, 220, 222, 223, 224,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   27 LEU  MDY          25 VAL  MGY         3.50    (#    933:20  Unique         2.64, 7.32 A)
 &rst
  ixpk= 933, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:935      0 AMB  20-1:935    5.50    (#    935:20  Double Ambig)
 &rst
  ixpk= 935, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.22, r4=11.72,
 igr1=1042,1043,1042,1043,1042,1043,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   67 GLU  HG-           0 AMB  20-1:936    4.50    (#    936:20  Single Ambig)
 &rst
  ixpk= 936, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 995, 996,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   17 GLY  HA-          54 VAL  MGX         4.50    (#    938:20  Unique         1.99, 4.21 A)
 &rst
  ixpk= 938, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 244, 245,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   77 ARG  HG+          78 ALA  MB          3.50    (#    946:20  Unique         2.99, 4.55 A)
 &rst
  ixpk= 946, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1155,1156,
 igr2=1176,1177,1178,
 &end
#
#   78 ALA  HA           78 ALA  MB          5.50    (#    953:20  Unique         2.24, 2.63 A)
 &rst
  ixpk= 953, nxpk= 20, iat=1174,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1176,1177,1178,
 &end
#
#   75 SER  HB+          78 ALA  MB          4.50    (#    954:20  Unique         2.08, 4.00 A)
 &rst
  ixpk= 954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1122,1123,
 igr2=1176,1177,1178,
 &end
#
#   75 SER  HB-          78 ALA  MB          3.50    (#    955:20  Unique         2.08, 4.00 A)
 &rst
  ixpk= 955, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1122,1123,
 igr2=1176,1177,1178,
 &end
#
#    0 AMB  20-3:956     78 ALA  MB          4.50    (#    956:20  Single Ambig)
 &rst
  ixpk= 956, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 906, 907, 906, 907,
 igr2=1176,1177,1178,
 &end
#
#   61 LYS  HG-          78 ALA  MB          3.50    (#    957:20  Unique         2.70, 5.12 A)
 &rst
  ixpk= 957, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 900, 901,
 igr2=1176,1177,1178,
 &end
#
#   63 LEU  MDX          78 ALA  MB          4.50    (#    958:20  Unique         2.63, 6.18 A)
 &rst
  ixpk= 958, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2=1176,1177,1178,
 &end
#
#    2 ALA  HA            2 ALA  MB          4.50    (#    968:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 968, nxpk= 20, iat=  23,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  25,  26,  27,
 &end
#
#    5 PHE  HA            3 ALA  MB          5.50    (#    970:20  Unique         4.15, 6.57 A)
 &rst
  ixpk= 970, nxpk= 20, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=  35,  36,  37,
 &end
#
#    3 ALA  HA            3 ALA  MB          2.80    (#    971:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 971, nxpk= 20, iat=  33,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=  35,  36,  37,
 &end
#
#    0 AMB  20-3:972      3 ALA  MB          5.50    (#    972:20  Single Ambig)
 &rst
  ixpk= 972, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2=  35,  36,  37,
 &end
#
#   26 ALA  HA           26 ALA  MB          2.80    (#    980:20  Unique         2.37, 2.63 A)
 &rst
  ixpk= 980, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 373, 374, 375,
 &end
#
#    0 AMB  20-3:987     26 ALA  MB          5.50    (#    987:20  Single Ambig)
 &rst
  ixpk= 987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 230, 812, 813,
 igr2= 373, 374, 375,
 &end
#
#    0 AMB  20-3:988      0 AMB  20-1:988    2.80    (#    988:20  Double Ambig)
 &rst
  ixpk= 988, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1462, 232,
 igr2=1464,1465,1466, 373, 374, 375,
 &end
#
#   11 TYR  HB+          60 VAL  MGX         4.50    (#    989:20  Unique         2.80, 6.11 A)
 &rst
  ixpk= 989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 152, 153,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   11 TYR  HB-          60 VAL  MGX         4.50    (#    990:20  Unique         2.80, 6.11 A)
 &rst
  ixpk= 990, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 152, 153,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:991     60 VAL  MGX         2.80    (#    991:20  Single Ambig)
 &rst
  ixpk= 991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1=1139,1140,1139,1140, 881,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   25 VAL  MGY          60 VAL  MGX         3.50    (#    992:20  Unique         2.20, 5.36 A)
 &rst
  ixpk= 992, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   27 LEU  MDY          60 VAL  MGX         3.50    (#    993:20  Unique         3.32, 7.64 A)
 &rst
  ixpk= 993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   12 THR  HB           60 VAL  MGX         5.50    (#    996:20  Unique         5.87, 8.84 A)
 &rst
  ixpk= 996, nxpk= 20, iat= 173,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   76 ILE  HA           60 VAL  MGX         7.00    (#    997:20  Unique         2.91, 6.00 A)
 &rst
  ixpk= 997, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   13 GLY  HA-          60 VAL  MGX         5.50    (#    998:20  Unique         2.78, 7.15 A)
 &rst
  ixpk= 998, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 185, 186,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:999     60 VAL  MGX         5.50    (#    999:20  Single Ambig)
 &rst
  ixpk= 999, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.25, r4=10.75,
 igr1= 357, 773, 774, 775, 777, 778, 779,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   74 LEU  HB-          60 VAL  MGX         3.50    (#   1000:20  Unique         2.00, 4.74 A)
 &rst
  ixpk= 1000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1103,1104,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   27 LEU  MDX          60 VAL  MGX         4.50    (#   1001:20  Unique         3.32, 7.64 A)
 &rst
  ixpk= 1001, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   52 LEU  MDY          58 VAL  MGX         4.50    (#   1002:20  Unique         2.05, 5.41 A)
 &rst
  ixpk= 1002, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 773, 774, 775, 777, 778, 779,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:1003    58 VAL  MGX         5.50    (#   1003:20  Single Ambig)
 &rst
  ixpk= 1003, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 185, 186, 796,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  HB           58 VAL  MGX         2.80    (#   1004:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1004, nxpk= 20, iat= 848,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:1005    58 VAL  MGX         4.50    (#   1005:20  Single Ambig)
 &rst
  ixpk= 1005, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1188,1189,1190, 175, 176, 177,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   15 VAL  MGY          58 VAL  MGX         2.80    (#   1006:20  Unique         2.00, 5.35 A)
 &rst
  ixpk= 1006, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 218, 219, 220, 222, 223, 224,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   52 LEU  MDX          58 VAL  MGX         2.80    (#   1007:20  Unique         2.05, 5.41 A)
 &rst
  ixpk= 1007, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 773, 774, 775, 777, 778, 779,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:1010    58 VAL  MGX         3.50    (#   1010:20  Single Ambig)
 &rst
  ixpk= 1010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1=1139,1140,1139,1140, 194, 195, 194, 195,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   21 TYR  HB-          20 ALA  MB          4.50    (#   1012:20  Unique         4.09, 6.07 A)
 &rst
  ixpk= 1012, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 299, 300,
 igr2= 289, 290, 291,
 &end
#
#    0 AMB  20-3:1013    20 ALA  MB          4.50    (#   1013:20  Single Ambig)
 &rst
  ixpk= 1013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 272, 273, 669, 670,
 igr2= 289, 290, 291,
 &end
#
#    0 AMB  20-3:1014    20 ALA  MB          4.50    (#   1014:20  Single Ambig)
 &rst
  ixpk= 1014, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 297, 270,
 igr2= 289, 290, 291,
 &end
#
#   20 ALA  HA           20 ALA  MB          2.80    (#   1015:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1015, nxpk= 20, iat= 287,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 289, 290, 291,
 &end
#
#   48 ILE  QG2          20 ALA  MB          4.50    (#   1016:20  Unique         3.21, 6.02 A)
 &rst
  ixpk= 1016, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 705, 706, 707,
 igr2= 289, 290, 291,
 &end
#
#    0 AMB  20-3:1017    41 THR  MG2         4.50    (#   1017:20  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 631, 607,
 igr2= 597, 598, 599,
 &end
#
#    0 AMB  20-3:1018    41 THR  MG2         4.50    (#   1018:20  Single Ambig)
 &rst
  ixpk= 1018, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 593, 551,
 igr2= 597, 598, 599,
 &end
#
#   41 THR  HB           41 THR  MG2         2.80    (#   1019:20  Unique         2.23, 2.64 A)
 &rst
  ixpk= 1019, nxpk= 20, iat= 595,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 597, 598, 599,
 &end
#
#    0 AMB  20-3:1020    41 THR  MG2         4.50    (#   1020:20  Single Ambig)
 &rst
  ixpk= 1020, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 609, 610, 751, 752, 633, 634,
 igr2= 597, 598, 599,
 &end
#
#   25 VAL  MGY          58 VAL  MGX         2.80    (#   1021:20  Unique         2.00, 5.83 A)
 &rst
  ixpk= 1021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 359, 360, 361, 363, 364, 365,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   82 ALA  HA           82 ALA  MB          2.80    (#   1027:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1027, nxpk= 20, iat=1225,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1227,1228,1229,
 &end
#
#   72 ILE  HA           72 ILE  QG2         3.50    (#   1029:20  Unique         2.30, 3.04 A)
 &rst
  ixpk= 1029, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1075,1076,1077,
 &end
#
#   65 VAL  HA           72 ILE  QG2         4.50    (#   1030:20  Unique         3.20, 4.76 A)
 &rst
  ixpk= 1030, nxpk= 20, iat= 962,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1075,1076,1077,
 &end
#
#   62 VAL  HA           72 ILE  QG2         4.50    (#   1031:20  Unique         3.93, 5.00 A)
 &rst
  ixpk= 1031, nxpk= 20, iat= 917,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1075,1076,1077,
 &end
#
#   33 GLY  HA-          72 ILE  QG2         4.50    (#   1032:20  Unique         2.35, 4.49 A)
 &rst
  ixpk= 1032, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 473, 474,
 igr2=1075,1076,1077,
 &end
#
#   72 ILE  HB           72 ILE  QG2         2.80    (#   1033:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1033, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1075,1076,1077,
 &end
#
#   74 LEU  HG           72 ILE  QG2         4.50    (#   1034:20  Unique         2.45, 3.84 A)
 &rst
  ixpk= 1034, nxpk= 20, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1075,1076,1077,
 &end
#
#   72 ILE  HG1-         72 ILE  QG2         2.80    (#   1035:20  Unique         2.33, 3.50 A)
 &rst
  ixpk= 1035, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1079,1080,
 igr2=1075,1076,1077,
 &end
#
#    0 AMB  20-3:1036    72 ILE  QG2         3.50    (#   1036:20  Single Ambig)
 &rst
  ixpk= 1036, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972,
 igr2=1075,1076,1077,
 &end
#
#   27 LEU  MDY          72 ILE  QG2         5.50    (#   1037:20  Unique         3.11, 7.03 A)
 &rst
  ixpk= 1037, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1075,1076,1077,
 &end
#
#   27 LEU  MDX          72 ILE  QG2         4.50    (#   1038:20  Unique         3.11, 7.03 A)
 &rst
  ixpk= 1038, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1075,1076,1077,
 &end
#
#  128 ILE  HA          128 ILE  QG2         4.50    (#   1039:20  Unique         2.31, 3.57 A)
 &rst
  ixpk= 1039, nxpk= 20, iat=1968,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1972,1973,1974,
 &end
#
#  128 ILE  HG1+        128 ILE  QG2         5.50    (#   1040:20  Unique         2.02, 3.35 A)
 &rst
  ixpk= 1040, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1976,1977,
 igr2=1972,1973,1974,
 &end
#
#  128 ILE  HB          128 ILE  QG2         4.50    (#   1047:20  Unique         2.23, 2.63 A)
 &rst
  ixpk= 1047, nxpk= 20, iat=1970,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1972,1973,1974,
 &end
#
#  128 ILE  HG1-        128 ILE  QG2         7.00    (#   1048:20  Unique         2.02, 3.35 A)
 &rst
  ixpk= 1048, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1976,1977,
 igr2=1972,1973,1974,
 &end
#
#  119 ILE  HG1+        119 ILE  QG2         4.50    (#   1050:20  Unique         2.05, 3.36 A)
 &rst
  ixpk= 1050, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1823,1824,
 igr2=1819,1820,1821,
 &end
#
#  119 ILE  HA          119 ILE  QG2         4.50    (#   1053:20  Unique         2.28, 3.46 A)
 &rst
  ixpk= 1053, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1819,1820,1821,
 &end
#
#  119 ILE  HB          119 ILE  QG2         3.50    (#   1054:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1054, nxpk= 20, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1819,1820,1821,
 &end
#
#   76 ILE  HA           76 ILE  QG2         3.50    (#   1056:20  Unique         2.23, 3.07 A)
 &rst
  ixpk= 1056, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2=1135,1136,1137,
 &end
#
#   77 ARG  HA           76 ILE  QG2         4.50    (#   1058:20  Unique         3.76, 4.87 A)
 &rst
  ixpk= 1058, nxpk= 20, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1135,1136,1137,
 &end
#
#   40 VAL  HA           76 ILE  QG2         4.50    (#   1059:20  Unique         3.71, 4.68 A)
 &rst
  ixpk= 1059, nxpk= 20, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1135,1136,1137,
 &end
#
#    0 AMB  20-3:1060    76 ILE  QG2         4.50    (#   1060:20  Single Ambig)
 &rst
  ixpk= 1060, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1139,1140,1139,1140,
 igr2=1135,1136,1137,
 &end
#
#    0 AMB  20-3:1061    76 ILE  QG2         2.80    (#   1061:20  Single Ambig)
 &rst
  ixpk= 1061, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 773, 774, 775, 777, 778, 779,1142,1143,1144,
 igr2=1135,1136,1137,
 &end
#
#    0 AMB  20-3:1062    76 ILE  QG2         4.50    (#   1062:20  Single Ambig)
 &rst
  ixpk= 1062, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1203,1204,1203,1204,
 igr2=1135,1136,1137,
 &end
#
#   76 ILE  HB           76 ILE  QG2         2.80    (#   1063:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1063, nxpk= 20, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1135,1136,1137,
 &end
#
#    0 AMB  20-3:1064    76 ILE  QG2         3.50    (#   1064:20  Single Ambig)
 &rst
  ixpk= 1064, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.45, r4= 6.95,
 igr1= 771, 581, 582, 583, 585, 586, 587, 883, 884, 885,
       887, 888, 889,
 igr2=1135,1136,1137,
 &end
#
#   52 LEU  MDX          52 LEU  HB+         4.50    (#   1067:20  Unique         2.09, 3.26 A)
 &rst
  ixpk= 1067, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 773, 774, 775, 777, 778, 779,
 igr2= 768, 769,
 &end
#
#    0 AMB  20-3:1068     0 AMB  20-1:1068   3.50    (#   1068:20  Double Ambig)
 &rst
  ixpk= 1068, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 igr2= 768, 769, 768, 769,
 &end
#
#    0 AMB  20-3:1069     0 AMB  20-1:1069   3.50    (#   1069:20  Double Ambig)
 &rst
  ixpk= 1069, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.10, r4= 6.60,
 igr1= 771, 581, 582, 583, 585, 586, 587,
 igr2= 768, 769, 768, 769,
 &end
#
#    0 AMB  20-3:1070    52 LEU  HB-         4.50    (#   1070:20  Single Ambig)
 &rst
  ixpk= 1070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 igr2= 768, 769,
 &end
#
#    0 AMB  20-3:1071    52 LEU  HB-         4.50    (#   1071:20  Single Ambig)
 &rst
  ixpk= 1071, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.99, r4= 7.49,
 igr1= 771, 581, 582, 583, 585, 586, 587,
 igr2= 768, 769,
 &end
#
#   52 LEU  MDX          52 LEU  HB-         3.50    (#   1073:20  Unique         2.09, 3.26 A)
 &rst
  ixpk= 1073, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 773, 774, 775, 777, 778, 779,
 igr2= 768, 769,
 &end
#
#    0 AMB  20-3:1074    48 ILE  QG2         5.50    (#   1074:20  Single Ambig)
 &rst
  ixpk= 1074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 722, 723, 691, 692,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  20-3:1075    48 ILE  QG2         4.50    (#   1075:20  Single Ambig)
 &rst
  ixpk= 1075, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 720, 689,
 igr2= 705, 706, 707,
 &end
#
#   20 ALA  HA           48 ILE  QG2         4.50    (#   1076:20  Unique         2.08, 3.80 A)
 &rst
  ixpk= 1076, nxpk= 20, iat= 287,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 705, 706, 707,
 &end
#
#   37 ILE  HA           48 ILE  QG2         7.00    (#   1077:20  Unique         4.65, 6.96 A)
 &rst
  ixpk= 1077, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  20-3:1078    48 ILE  QG2         2.80    (#   1078:20  Single Ambig)
 &rst
  ixpk= 1078, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 253, 254, 703,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  20-3:1079    48 ILE  QG2         4.50    (#   1079:20  Single Ambig)
 &rst
  ixpk= 1079, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 256, 289, 290, 291,
 igr2= 705, 706, 707,
 &end
#
#    0 AMB  20-3:1080    48 ILE  QG2         2.80    (#   1080:20  Single Ambig)
 &rst
  ixpk= 1080, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 712, 713, 714, 258, 259, 260, 262, 263, 264,
 igr2= 705, 706, 707,
 &end
#
#   23 ALA  MB           48 ILE  QG2         5.50    (#   1082:20  Unique         4.02, 6.64 A)
 &rst
  ixpk= 1082, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 327, 328, 329,
 igr2= 705, 706, 707,
 &end
#
#   74 LEU  MDY          74 LEU  HB+         3.50    (#   1084:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 1084, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1108,1109,1110,1112,1113,1114,
 igr2=1103,1104,
 &end
#
#    0 AMB  20-3:1085     0 AMB  20-1:1085   3.50    (#   1085:20  Double Ambig)
 &rst
  ixpk= 1085, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 883, 884, 885, 887, 888, 889, 503, 504, 505, 507,
       508, 509,1108,1109,1110,1112,1113,1114,
 igr2=1103,1104,1103,1104,1103,1104,
 &end
#
#   74 LEU  HG           74 LEU  HB+         4.50    (#   1086:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 1086, nxpk= 20, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1103,1104,
 &end
#
#   74 LEU  HG           74 LEU  HB-         5.50    (#   1087:20  Unique         2.41, 2.76 A)
 &rst
  ixpk= 1087, nxpk= 20, iat=1106,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1103,1104,
 &end
#
#   60 VAL  HB           74 LEU  HB-         5.50    (#   1088:20  Unique         2.21, 3.33 A)
 &rst
  ixpk= 1088, nxpk= 20, iat= 881,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1103,1104,
 &end
#
#    0 AMB  20-3:1090    74 LEU  HB-         3.50    (#   1090:20  Single Ambig)
 &rst
  ixpk= 1090, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 883, 884, 885, 887, 888, 889, 503, 504, 505, 507,
       508, 509,1108,1109,1110,1112,1113,1114,
 igr2=1103,1104,
 &end
#
#   74 LEU  MDY          74 LEU  HB-         4.50    (#   1091:20  Unique         2.14, 3.26 A)
 &rst
  ixpk= 1091, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1108,1109,1110,1112,1113,1114,
 igr2=1103,1104,
 &end
#
#    0 AMB  20-3:1093    37 ILE  QG2         4.50    (#   1093:20  Single Ambig)
 &rst
  ixpk= 1093, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 551, 318, 319,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:1094    37 ILE  QG2         4.50    (#   1094:20  Single Ambig)
 &rst
  ixpk= 1094, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 553, 554, 553, 554,
 igr2= 536, 537, 538,
 &end
#
#   37 ILE  HA           37 ILE  QG2         4.50    (#   1095:20  Unique         3.52, 3.89 A)
 &rst
  ixpk= 1095, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:1096    37 ILE  QG2         4.50    (#   1096:20  Single Ambig)
 &rst
  ixpk= 1096, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 517, 518, 299, 300,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:1097    37 ILE  QG2         4.50    (#   1097:20  Single Ambig)
 &rst
  ixpk= 1097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 299, 300, 633, 634, 564, 565,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:1098    37 ILE  QG2         4.50    (#   1098:20  Single Ambig)
 &rst
  ixpk= 1098, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 653, 703, 675, 676, 675, 676,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:1099    37 ILE  QG2         2.80    (#   1099:20  Single Ambig)
 &rst
  ixpk= 1099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 540, 541, 540, 541, 534,
 igr2= 536, 537, 538,
 &end
#
#   76 ILE  HA           76 ILE  QD1         4.50    (#   1100:20  Unique         2.03, 3.53 A)
 &rst
  ixpk= 1100, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1142,1143,1144,
 &end
#
#   40 VAL  HA           76 ILE  QD1         5.50    (#   1101:20  Unique         2.17, 4.77 A)
 &rst
  ixpk= 1101, nxpk= 20, iat= 577,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1142,1143,1144,
 &end
#
#    0 AMB  20-3:1102    76 ILE  QD1         3.50    (#   1102:20  Single Ambig)
 &rst
  ixpk= 1102, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1133, 501,
 igr2=1142,1143,1144,
 &end
#
#    0 AMB  20-3:1103    76 ILE  QD1         3.50    (#   1103:20  Single Ambig)
 &rst
  ixpk= 1103, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1139,1140,1139,1140, 881,
 igr2=1142,1143,1144,
 &end
#
#   79 THR  MG2          76 ILE  QD1         3.50    (#   1104:20  Unique         2.83, 5.59 A)
 &rst
  ixpk= 1104, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1188,1189,1190,
 igr2=1142,1143,1144,
 &end
#
#    0 AMB  20-3:1105    76 ILE  QD1         2.80    (#   1105:20  Single Ambig)
 &rst
  ixpk= 1105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 503, 504, 505, 507, 508, 509, 883, 884, 885, 887,
       888, 889,
 igr2=1142,1143,1144,
 &end
#
#    0 AMB  20-3:1106    76 ILE  QD1         2.80    (#   1106:20  Single Ambig)
 &rst
  ixpk= 1106, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 883, 884, 885, 887, 888, 889, 581, 582, 583, 585,
       586, 587,
 igr2=1142,1143,1144,
 &end
#
#    0 AMB  20-3:1107    76 ILE  QD1         5.50    (#   1107:20  Single Ambig)
 &rst
  ixpk= 1107, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 768, 769,1155,1156,
 igr2=1142,1143,1144,
 &end
#
#   47 ASP  HA           37 ILE  QD1         5.50    (#   1109:20  Unique         4.48, 6.90 A)
 &rst
  ixpk= 1109, nxpk= 20, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 543, 544, 545,
 &end
#
#   21 TYR  HA           37 ILE  QD1         5.50    (#   1110:20  Unique         2.71, 4.47 A)
 &rst
  ixpk= 1110, nxpk= 20, iat= 297,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 543, 544, 545,
 &end
#
#   37 ILE  HA           37 ILE  QD1         4.50    (#   1111:20  Unique         3.15, 4.32 A)
 &rst
  ixpk= 1111, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 543, 544, 545,
 &end
#
#   22 GLY  HA-          37 ILE  QD1         4.50    (#   1112:20  Unique         4.44, 6.40 A)
 &rst
  ixpk= 1112, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 318, 319,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:1113    37 ILE  QD1         4.50    (#   1113:20  Single Ambig)
 &rst
  ixpk= 1113, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 703, 653,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:1114    37 ILE  QD1         5.50    (#   1114:20  Single Ambig)
 &rst
  ixpk= 1114, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.14, r4= 9.64,
 igr1= 709, 710, 709, 710, 289, 290, 291,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:1115    37 ILE  QD1         2.80    (#   1115:20  Single Ambig)
 &rst
  ixpk= 1115, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 540, 541, 540, 541,
 igr2= 543, 544, 545,
 &end
#
#   45 VAL  MGY          37 ILE  QD1         2.80    (#   1116:20  Unique         2.10, 5.62 A)
 &rst
  ixpk= 1116, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 655, 656, 657, 659, 660, 661,
 igr2= 543, 544, 545,
 &end
#
#   45 VAL  MGX          37 ILE  QD1         4.50    (#   1117:20  Unique         2.10, 5.62 A)
 &rst
  ixpk= 1117, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 655, 656, 657, 659, 660, 661,
 igr2= 543, 544, 545,
 &end
#
#   22 GLY  HA-          48 ILE  QD1         4.50    (#   1119:20  Unique         2.22, 4.20 A)
 &rst
  ixpk= 1119, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 318, 319,
 igr2= 712, 713, 714,
 &end
#
#   23 ALA  MB           48 ILE  QD1         3.50    (#   1120:20  Unique         2.05, 4.39 A)
 &rst
  ixpk= 1120, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 327, 328, 329,
 igr2= 712, 713, 714,
 &end
#
#   22 GLY  HA+          48 ILE  QD1         4.50    (#   1121:20  Unique         2.22, 4.20 A)
 &rst
  ixpk= 1121, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 318, 319,
 igr2= 712, 713, 714,
 &end
#
#   37 ILE  HA           48 ILE  QD1         5.50    (#   1122:20  Unique         2.12, 4.34 A)
 &rst
  ixpk= 1122, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 712, 713, 714,
 &end
#
#   48 ILE  HB           48 ILE  QD1         3.50    (#   1123:20  Unique         2.20, 3.12 A)
 &rst
  ixpk= 1123, nxpk= 20, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 712, 713, 714,
 &end
#
#    0 AMB  20-3:1124    48 ILE  QD1         2.80    (#   1124:20  Single Ambig)
 &rst
  ixpk= 1124, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 256, 709, 710, 709, 710,
 igr2= 712, 713, 714,
 &end
#
#    0 AMB  20-3:1125    48 ILE  QD1         2.80    (#   1125:20  Single Ambig)
 &rst
  ixpk= 1125, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.85, r4= 5.35,
 igr1= 705, 706, 707, 581, 582, 583, 585, 586, 587,
 igr2= 712, 713, 714,
 &end
#
#   72 ILE  HA           72 ILE  QD1         4.50    (#   1128:20  Unique         2.03, 4.23 A)
 &rst
  ixpk= 1128, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1082,1083,1084,
 &end
#
#   65 VAL  HB           72 ILE  QD1         5.50    (#   1129:20  Unique         2.58, 5.20 A)
 &rst
  ixpk= 1129, nxpk= 20, iat= 964,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1082,1083,1084,
 &end
#
#   72 ILE  HB           72 ILE  QD1         2.80    (#   1130:20  Unique         2.42, 3.34 A)
 &rst
  ixpk= 1130, nxpk= 20, iat=1073,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-3:1131    72 ILE  QD1         5.50    (#   1131:20  Single Ambig)
 &rst
  ixpk= 1131, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 962, 442,
 igr2=1082,1083,1084,
 &end
#
#   33 GLY  HA-          72 ILE  QD1         5.50    (#   1132:20  Unique         2.82, 4.94 A)
 &rst
  ixpk= 1132, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 473, 474,
 igr2=1082,1083,1084,
 &end
#
#    5 PHE  HB-          72 ILE  QD1         5.50    (#   1133:20  Unique         4.00, 9.25 A)
 &rst
  ixpk= 1133, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=  67,  68,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-3:1134    72 ILE  QD1         5.50    (#   1134:20  Single Ambig)
 &rst
  ixpk= 1134, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  67,  68, 995, 996,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-3:1135    72 ILE  QD1         2.80    (#   1135:20  Single Ambig)
 &rst
  ixpk= 1135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1= 446, 447, 448,1079,1080,
 igr2=1082,1083,1084,
 &end
#
#    0 AMB  20-3:1136    72 ILE  QD1         2.80    (#   1136:20  Single Ambig)
 &rst
  ixpk= 1136, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2=1082,1083,1084,
 &end
#
#   27 LEU  MDX          72 ILE  QD1         3.50    (#   1137:20  Unique         2.00, 6.59 A)
 &rst
  ixpk= 1137, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=1082,1083,1084,
 &end
#
#   34 LEU  MDX          34 LEU  HB+         3.50    (#   1139:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 1139, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 482, 483,
 &end
#
#   34 LEU  MDY          34 LEU  HB+         4.50    (#   1140:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 1140, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 482, 483,
 &end
#
#   34 LEU  HG           34 LEU  HB+         3.50    (#   1141:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 1141, nxpk= 20, iat= 485,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 482, 483,
 &end
#
#   34 LEU  MDX          34 LEU  HB-         3.50    (#   1142:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 1142, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 482, 483,
 &end
#
#   34 LEU  MDY          34 LEU  HB-         4.50    (#   1143:20  Unique         2.20, 3.28 A)
 &rst
  ixpk= 1143, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 487, 488, 489, 491, 492, 493,
 igr2= 482, 483,
 &end
#
#   34 LEU  HG           34 LEU  HB-         3.50    (#   1145:20  Unique         2.44, 2.74 A)
 &rst
  ixpk= 1145, nxpk= 20, iat= 485,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 482, 483,
 &end
#
#  119 ILE  HA          119 ILE  QD1         4.50    (#   1149:20  Unique         2.07, 4.18 A)
 &rst
  ixpk= 1149, nxpk= 20, iat=1815,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1826,1827,1828,
 &end
#
#  119 ILE  HB          119 ILE  QD1         4.50    (#   1150:20  Unique         2.14, 3.15 A)
 &rst
  ixpk= 1150, nxpk= 20, iat=1817,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1826,1827,1828,
 &end
#
#  119 ILE  HG1+        119 ILE  QD1         3.50    (#   1152:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 1152, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1823,1824,
 igr2=1826,1827,1828,
 &end
#
#  119 ILE  HG1-        119 ILE  QD1         2.80    (#   1153:20  Unique         2.21, 2.62 A)
 &rst
  ixpk= 1153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1823,1824,
 igr2=1826,1827,1828,
 &end
#
#  128 ILE  HG1-        128 ILE  QD1         4.50    (#   1157:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1157, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1976,1977,
 igr2=1979,1980,1981,
 &end
#
#    0 AMB  20-3:1159     0 AMB  20-1:1159   3.50    (#   1159:20  Double Ambig)
 &rst
  ixpk= 1159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 709, 710, 709, 710, 256,
 igr2= 253, 254, 253, 254, 253, 254,
 &end
#
#    0 AMB  20-3:1161     0 AMB  20-1:1161   3.50    (#   1161:20  Double Ambig)
 &rst
  ixpk= 1161, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.67, r4= 7.17,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 igr2= 253, 254, 253, 254,
 &end
#
#    0 AMB  20-3:1162    18 LEU  HB-         4.50    (#   1162:20  Single Ambig)
 &rst
  ixpk= 1162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 705, 706, 707, 800, 801, 802, 804, 805, 806, 800,
       801, 802, 804, 805, 806,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-3:1164    18 LEU  HB-         3.50    (#   1164:20  Single Ambig)
 &rst
  ixpk= 1164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-3:1167     0 AMB  20-1:1167   4.50    (#   1167:20  Double Ambig)
 &rst
  ixpk= 1167, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 607, 562,
 igr2=1158,1159,1158,1159,
 &end
#
#   77 ARG  HB+          77 ARG  HD+         4.50    (#   1168:20  Unique         2.14, 2.93 A)
 &rst
  ixpk= 1168, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1152,1153,
 igr2=1158,1159,
 &end
#
#    0 AMB  20-3:1169     0 AMB  20-1:1169   4.50    (#   1169:20  Double Ambig)
 &rst
  ixpk= 1169, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1152,1153,1155,1156,
 igr2=1158,1159,1158,1159,
 &end
#
#   77 ARG  HG+          77 ARG  HD+         4.50    (#   1170:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 1170, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1155,1156,
 igr2=1158,1159,
 &end
#
#    0 AMB  20-3:1171    77 ARG  HD-         4.50    (#   1171:20  Single Ambig)
 &rst
  ixpk= 1171, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 607, 562,
 igr2=1158,1159,
 &end
#
#   77 ARG  HG+          77 ARG  HD-         4.50    (#   1173:20  Unique         2.23, 2.68 A)
 &rst
  ixpk= 1173, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1155,1156,
 igr2=1158,1159,
 &end
#
#   77 ARG  HB+          77 ARG  HD-         4.50    (#   1174:20  Unique         2.14, 2.93 A)
 &rst
  ixpk= 1174, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1152,1153,
 igr2=1158,1159,
 &end
#
#    0 AMB  20-3:1175    77 ARG  HD-         4.50    (#   1175:20  Single Ambig)
 &rst
  ixpk= 1175, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1152,1153,1155,1156,
 igr2=1158,1159,
 &end
#
#   27 LEU  MDY          11 TYR  HB-         4.50    (#   1176:20  Unique         2.04, 4.76 A)
 &rst
  ixpk= 1176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 152, 153,
 &end
#
#    0 AMB  20-3:1177    11 TYR  HB-         4.50    (#   1177:20  Single Ambig)
 &rst
  ixpk= 1177, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 921, 922, 923, 925, 926, 927, 883, 884, 885, 887,
       888, 889,
 igr2= 152, 153,
 &end
#
#   63 LEU  HA            0 AMB  20-1:1180   5.50    (#   1180:20  Single Ambig)
 &rst
  ixpk= 1180, nxpk= 20, iat= 933,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 935, 936, 935, 936,
 &end
#
#   47 ASP  HA           47 ASP  HB+         3.50    (#   1181:20  Unique         2.33, 2.73 A)
 &rst
  ixpk= 1181, nxpk= 20, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 691, 692,
 &end
#
#   50 GLU  HG+          47 ASP  HB+         4.50    (#   1182:20  Unique         1.99, 3.03 A)
 &rst
  ixpk= 1182, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 739, 740,
 igr2= 691, 692,
 &end
#
#   47 ASP  HA           47 ASP  HB-         4.50    (#   1184:20  Unique         2.33, 2.73 A)
 &rst
  ixpk= 1184, nxpk= 20, iat= 689,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 691, 692,
 &end
#
#   50 GLU  HG+          47 ASP  HB-         4.50    (#   1185:20  Unique         1.99, 3.03 A)
 &rst
  ixpk= 1185, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 739, 740,
 igr2= 691, 692,
 &end
#
#    0 AMB  20-3:1192     0 AMB  20-1:1192   3.50    (#   1192:20  Double Ambig)
 &rst
  ixpk= 1192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1667,1949,
 igr2=1669,1670,1669,1670,1951,1952,1951,1952,
 &end
#
#   27 LEU  MDX          27 LEU  HB+         4.50    (#   1195:20  Unique         1.96, 3.27 A)
 &rst
  ixpk= 1195, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 383, 384,
 &end
#
#   27 LEU  HA           27 LEU  HB+         4.50    (#   1196:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 1196, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 LEU  HG           27 LEU  HB+         4.50    (#   1197:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 1197, nxpk= 20, iat= 386,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 LEU  MDY          27 LEU  HB+         4.50    (#   1198:20  Unique         1.96, 3.27 A)
 &rst
  ixpk= 1198, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 383, 384,
 &end
#
#   27 LEU  MDX          27 LEU  HB-         4.50    (#   1199:20  Unique         1.96, 3.27 A)
 &rst
  ixpk= 1199, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 383, 384,
 &end
#
#   27 LEU  HG           27 LEU  HB-         4.50    (#   1200:20  Unique         2.37, 2.76 A)
 &rst
  ixpk= 1200, nxpk= 20, iat= 386,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 LEU  HA           27 LEU  HB-         4.50    (#   1202:20  Unique         2.32, 2.73 A)
 &rst
  ixpk= 1202, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 LEU  MDY          27 LEU  HB-         4.50    (#   1203:20  Unique         1.96, 3.27 A)
 &rst
  ixpk= 1203, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2= 383, 384,
 &end
#
#    0 AMB  20-3:1206     0 AMB  20-1:1206   4.50    (#   1206:20  Double Ambig)
 &rst
  ixpk= 1206, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.02, r4= 8.52,
 igr1= 197, 198,1054,1055,
 igr2= 203, 204, 203, 204,1060,1061,1060,1061,
 &end
#
#   69 LYS  HB-           0 AMB  20-1:1207   4.50    (#   1207:20  Single Ambig)
 &rst
  ixpk= 1207, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1022,1023,
 igr2=1060,1061,1060,1061,
 &end
#
#    0 AMB  20-3:1208     0 AMB  20-1:1208   4.50    (#   1208:20  Double Ambig)
 &rst
  ixpk= 1208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1022,1023,1022,1023,1022,1023,
 igr2= 980, 981,1060,1061,1060,1061,
 &end
#
#    0 AMB  20-3:1209     0 AMB  20-1:1209   4.50    (#   1209:20  Double Ambig)
 &rst
  ixpk= 1209, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1051,1052,1051,1052,1051,1052,
 igr2=1060,1061,1060,1061, 980, 981,
 &end
#
#    0 AMB  20-3:1212     0 AMB  20-1:1212   3.50    (#   1212:20  Double Ambig)
 &rst
  ixpk= 1212, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 897, 898, 897, 898,
 igr2= 906, 907, 906, 907,
 &end
#
#    0 AMB  20-3:1213     0 AMB  20-1:1213   4.50    (#   1213:20  Double Ambig)
 &rst
  ixpk= 1213, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 116, 117, 116, 117,
 igr2= 906, 907, 906, 907,
 &end
#
#    8 GLY  HA-           0 AMB  20-1:1215   4.50    (#   1215:20  Single Ambig)
 &rst
  ixpk= 1215, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 116, 117,
 igr2= 906, 907, 906, 907,
 &end
#
#    0 AMB  20-3:1217     0 AMB  20-1:1217   3.50    (#   1217:20  Double Ambig)
 &rst
  ixpk= 1217, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1= 900, 901, 900, 901,
 igr2= 906, 907, 906, 907,
 &end
#
#   61 LYS  HG-           0 AMB  20-1:1218   3.50    (#   1218:20  Single Ambig)
 &rst
  ixpk= 1218, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 900, 901,
 igr2= 906, 907, 906, 907,
 &end
#
#    0 AMB  20-3:1221    66 ASP  HB-         4.50    (#   1221:20  Single Ambig)
 &rst
  ixpk= 1221, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1051,1052,1057,1058,1057,1058,
 igr2= 980, 981,
 &end
#
#   15 VAL  MGY          56 ASP  HB+         4.50    (#   1224:20  Unique         2.95, 5.79 A)
 &rst
  ixpk= 1224, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 218, 219, 220, 222, 223, 224,
 igr2= 821, 822,
 &end
#
#   56 ASP  HA           56 ASP  HB+         4.50    (#   1225:20  Unique         2.60, 2.84 A)
 &rst
  ixpk= 1225, nxpk= 20, iat= 819,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 821, 822,
 &end
#
#    0 AMB  20-3:1226     0 AMB  20-1:1226   4.50    (#   1226:20  Double Ambig)
 &rst
  ixpk= 1226, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 850, 851, 852, 854, 855, 856, 218, 219, 220, 222,
       223, 224,
 igr2= 821, 822, 821, 822,
 &end
#
#  126 ASP  HA            0 AMB  20-1:1227   3.50    (#   1227:20  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 20, iat=1937,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1939,1940,1939,1940,
 &end
#
#   56 ASP  HA           56 ASP  HB-         4.50    (#   1228:20  Unique         2.60, 2.84 A)
 &rst
  ixpk= 1228, nxpk= 20, iat= 819,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 821, 822,
 &end
#
#   15 VAL  MGY          56 ASP  HB-         4.50    (#   1229:20  Unique         2.95, 5.79 A)
 &rst
  ixpk= 1229, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 218, 219, 220, 222, 223, 224,
 igr2= 821, 822,
 &end
#
#   58 VAL  MGY          56 ASP  HB-         4.50    (#   1231:20  Unique         2.67, 5.84 A)
 &rst
  ixpk= 1231, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 850, 851, 852, 854, 855, 856,
 igr2= 821, 822,
 &end
#
#   72 ILE  HG1-         72 ILE  HB          4.50    (#   1233:20  Unique         2.44, 2.67 A)
 &rst
  ixpk= 1233, nxpk= 20, iat=  -1,1073, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1080,
 &end
#
#   33 GLY  HA-          72 ILE  HB          4.50    (#   1236:20  Unique         2.04, 2.92 A)
 &rst
  ixpk= 1236, nxpk= 20, iat=  -1,1073, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 473, 474,
 &end
#
#   72 ILE  QG2          72 ILE  HB          2.80    (#   1237:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1237, nxpk= 20, iat=  -1,1073, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1075,1076,1077,
 &end
#
#   72 ILE  HA           72 ILE  HB          5.50    (#   1238:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 1238, nxpk= 20, iat=1071,1073, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:1239    72 ILE  HB          5.50    (#   1239:20  Single Ambig)
 &rst
  ixpk= 1239, nxpk= 20, iat=  -1,1073, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972, 966, 967, 968, 970, 971, 972,
 &end
#
#   44 PHE  HA           44 PHE  HB+         4.50    (#   1240:20  Unique         2.38, 2.69 A)
 &rst
  ixpk= 1240, nxpk= 20, iat= 631,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 633, 634,
 &end
#
#    5 PHE  HA            5 PHE  HB-         4.50    (#   1242:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 1242, nxpk= 20, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  67,  68,
 &end
#
#    0 AMB  20-3:1243     5 PHE  HB-         5.50    (#   1243:20  Single Ambig)
 &rst
  ixpk= 1243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1=1075,1076,1077, 883, 884, 885, 887, 888, 889,1108,
      1109,1110,1112,1113,1114,
 igr2=  67,  68,
 &end
#
#   62 VAL  MGY           5 PHE  HB-         5.50    (#   1244:20  Unique         3.15, 7.35 A)
 &rst
  ixpk= 1244, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927,
 igr2=  67,  68,
 &end
#
#   62 VAL  MGY           5 PHE  HB+         4.50    (#   1247:20  Unique         3.15, 7.35 A)
 &rst
  ixpk= 1247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 921, 922, 923, 925, 926, 927,
 igr2=  67,  68,
 &end
#
#    5 PHE  HA            5 PHE  HB+         4.50    (#   1248:20  Unique         2.37, 2.77 A)
 &rst
  ixpk= 1248, nxpk= 20, iat=  65,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  67,  68,
 &end
#
#   40 VAL  HA           76 ILE  HB          4.50    (#   1251:20  Unique         1.99, 2.23 A)
 &rst
  ixpk= 1251, nxpk= 20, iat= 577,1133, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1252    76 ILE  HB          5.50    (#   1252:20  Single Ambig)
 &rst
  ixpk= 1252, nxpk= 20, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:1253    76 ILE  HB          3.50    (#   1253:20  Single Ambig)
 &rst
  ixpk= 1253, nxpk= 20, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1= 581, 582, 583, 585, 586, 587,1142,1143,1144, 773,
       774, 775, 777, 778, 779,
 &end
#
#   40 VAL  MGY          76 ILE  HB          5.50    (#   1254:20  Unique         2.00, 4.05 A)
 &rst
  ixpk= 1254, nxpk= 20, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#   76 ILE  QG2          76 ILE  HB          3.50    (#   1255:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1255, nxpk= 20, iat=  -1,1133, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1135,1136,1137,
 &end
#
#    0 AMB  20-3:1256    48 ILE  HB          3.50    (#   1256:20  Single Ambig)
 &rst
  ixpk= 1256, nxpk= 20, iat=  -1, 703, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 709, 710, 709, 710,
 &end
#
#   48 ILE  QD1          48 ILE  HB          3.50    (#   1257:20  Unique         2.20, 3.12 A)
 &rst
  ixpk= 1257, nxpk= 20, iat=  -1, 703, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 712, 713, 714,
 &end
#
#   45 VAL  MGY          48 ILE  HB          5.50    (#   1258:20  Unique         2.52, 5.12 A)
 &rst
  ixpk= 1258, nxpk= 20, iat=  -1, 703, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#   21 TYR  HA           37 ILE  HB          4.50    (#   1259:20  Unique         2.60, 3.06 A)
 &rst
  ixpk= 1259, nxpk= 20, iat= 297, 534, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HA           37 ILE  HB          4.50    (#   1260:20  Unique         2.42, 2.44 A)
 &rst
  ixpk= 1260, nxpk= 20, iat= 532, 534, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1261    37 ILE  HB          3.50    (#   1261:20  Single Ambig)
 &rst
  ixpk= 1261, nxpk= 20, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 536, 537, 538, 712, 713, 714,
 &end
#
#   37 ILE  QD1          37 ILE  HB          3.50    (#   1262:20  Unique         2.12, 2.95 A)
 &rst
  ixpk= 1262, nxpk= 20, iat=  -1, 534, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 543, 544, 545,
 &end
#
#    0 AMB  20-3:1263     0 AMB  20-1:1263   3.50    (#   1263:20  Double Ambig)
 &rst
  ixpk= 1263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 720,1639,
 igr2= 722, 723,1641,1642,
 &end
#
#  119 ILE  HG1-        119 ILE  HB          5.50    (#   1264:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 1264, nxpk= 20, iat=  -1,1817, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1823,1824,
 &end
#
#  119 ILE  HG1+        119 ILE  HB          3.50    (#   1266:20  Unique         2.29, 2.74 A)
 &rst
  ixpk= 1266, nxpk= 20, iat=  -1,1817, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1823,1824,
 &end
#
#    0 AMB  20-3:1267     0 AMB  20-1:1267   2.80    (#   1267:20  Double Ambig)
 &rst
  ixpk= 1267, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 543, 544, 545,1826,1827,1828,1819,1820,1821, 705,
       706, 707,
 igr2= 703,1817,
 &end
#
#   49 ASN  HA           49 ASN  HB-         3.50    (#   1270:20  Unique         2.30, 2.57 A)
 &rst
  ixpk= 1270, nxpk= 20, iat= 720,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 722, 723,
 &end
#
#  128 ILE  HG1+        128 ILE  HB          5.50    (#   1271:20  Unique         2.29, 2.70 A)
 &rst
  ixpk= 1271, nxpk= 20, iat=  -1,1970, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1976,1977,
 &end
#
#    0 AMB  20-3:1272   128 ILE  HB          4.50    (#   1272:20  Single Ambig)
 &rst
  ixpk= 1272, nxpk= 20, iat=  -1,1970, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1979,1980,1981,1972,1973,1974,
 &end
#
#   21 TYR  HA           21 TYR  HB-         3.50    (#   1274:20  Unique         2.37, 2.72 A)
 &rst
  ixpk= 1274, nxpk= 20, iat= 297,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 299, 300,
 &end
#
#   57 GLU  HB-          57 GLU  HG+         2.80    (#   1276:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 1276, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 833, 834,
 igr2= 836, 837,
 &end
#
#    0 AMB  20-3:1277     0 AMB  20-1:1277   4.50    (#   1277:20  Double Ambig)
 &rst
  ixpk= 1277, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 175, 176, 177, 197, 198,
 igr2= 836, 837, 836, 837,
 &end
#
#    0 AMB  20-3:1279    57 GLU  HG-         4.50    (#   1279:20  Single Ambig)
 &rst
  ixpk= 1279, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 175, 176, 177, 197, 198,
 igr2= 836, 837,
 &end
#
#   50 GLU  HB-          50 GLU  HG+         4.50    (#   1281:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1281, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 736, 737,
 igr2= 739, 740,
 &end
#
#    0 AMB  20-3:1282    50 GLU  HG-         4.50    (#   1282:20  Single Ambig)
 &rst
  ixpk= 1282, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 691, 692, 691, 692,
 igr2= 739, 740,
 &end
#
#   50 GLU  HB+          50 GLU  HG-         2.80    (#   1284:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1284, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 736, 737,
 igr2= 739, 740,
 &end
#
#   50 GLU  HB-          50 GLU  HG-         4.50    (#   1285:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 1285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 736, 737,
 igr2= 739, 740,
 &end
#
#    0 AMB  20-3:1287    67 GLU  HG-         4.50    (#   1287:20  Single Ambig)
 &rst
  ixpk= 1287, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2= 995, 996,
 &end
#
#   50 GLU  HA           50 GLU  HG-         4.50    (#   1288:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 1288, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 739, 740,
 &end
#
#   28 ASP  HA            0 AMB  20-1:1289   4.50    (#   1289:20  Single Ambig)
 &rst
  ixpk= 1289, nxpk= 20, iat= 400,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 417, 418, 417, 418,
 &end
#
#    0 AMB  20-3:1291     0 AMB  20-1:1291   2.80    (#   1291:20  Double Ambig)
 &rst
  ixpk= 1291, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1=1005, 412, 990,
 igr2=1010,1011, 417, 418, 417, 418, 995, 996,
 &end
#
#   28 ASP  HB-           0 AMB  20-1:1292   4.50    (#   1292:20  Single Ambig)
 &rst
  ixpk= 1292, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 402, 403,
 igr2= 417, 418, 417, 418,
 &end
#
#   67 GLU  HA           67 GLU  HG+         3.50    (#   1294:20  Unique         2.28, 3.00 A)
 &rst
  ixpk= 1294, nxpk= 20, iat= 990,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 995, 996,
 &end
#
#   14 LYS  HG-           0 AMB  20-1:1309   5.50    (#   1309:20  Single Ambig)
 &rst
  ixpk= 1309, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 197, 198,
 igr2= 194, 195, 194, 195,
 &end
#
#   61 LYS  HG-          61 LYS  HB+         4.50    (#   1310:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 1310, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 900, 901,
 igr2= 897, 898,
 &end
#
#    0 AMB  20-3:1311     0 AMB  20-1:1311   4.50    (#   1311:20  Double Ambig)
 &rst
  ixpk= 1311, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 900, 901,1188,1189,1190,
 igr2= 897, 898, 897, 898,
 &end
#
#    0 AMB  20-3:1312     0 AMB  20-1:1312   5.50    (#   1312:20  Double Ambig)
 &rst
  ixpk= 1312, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 igr2= 897, 898, 897, 898,
 &end
#
#    0 AMB  20-3:1313    61 LYS  HB-         4.50    (#   1313:20  Single Ambig)
 &rst
  ixpk= 1313, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 900, 901,1188,1189,1190,
 igr2= 897, 898,
 &end
#
#    0 AMB  20-3:1314    61 LYS  HB-         4.50    (#   1314:20  Single Ambig)
 &rst
  ixpk= 1314, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 igr2= 897, 898,
 &end
#
#   61 LYS  HG-          61 LYS  HB-         4.50    (#   1315:20  Unique         2.21, 2.71 A)
 &rst
  ixpk= 1315, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 900, 901,
 igr2= 897, 898,
 &end
#
#   74 LEU  HB-          60 VAL  HB          4.50    (#   1316:20  Unique         2.21, 3.33 A)
 &rst
  ixpk= 1316, nxpk= 20, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1103,1104,
 &end
#
#   74 LEU  MDX          60 VAL  HB          2.80    (#   1317:20  Unique         2.17, 4.49 A)
 &rst
  ixpk= 1317, nxpk= 20, iat=  -1, 881, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1108,1109,1110,1112,1113,1114,
 &end
#
#   25 VAL  HA           25 VAL  HB          4.50    (#   1318:20  Unique         3.01, 3.02 A)
 &rst
  ixpk= 1318, nxpk= 20, iat= 355, 357, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1319    25 VAL  HB          4.50    (#   1319:20  Single Ambig)
 &rst
  ixpk= 1319, nxpk= 20, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 386, 218, 219, 220, 222, 223, 224, 327, 328, 329,
      
 &end
#
#    0 AMB  20-3:1320    25 VAL  HB          4.50    (#   1320:20  Single Ambig)
 &rst
  ixpk= 1320, nxpk= 20, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 883, 884, 885, 887, 888, 889, 503, 504, 505, 507,
       508, 509,
 &end
#
#    0 AMB  20-3:1321    25 VAL  HB          2.80    (#   1321:20  Single Ambig)
 &rst
  ixpk= 1321, nxpk= 20, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 359, 360, 361, 363, 364, 365,1108,1109,1110,1112,
      1113,1114, 883, 884, 885, 887, 888, 889,
 &end
#
#   25 VAL  MGY          25 VAL  HB          3.50    (#   1322:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1322, nxpk= 20, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:1323    58 VAL  HB          4.50    (#   1323:20  Single Ambig)
 &rst
  ixpk= 1323, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 773, 774, 775, 777, 778, 779,1142,1143,1144,
 &end
#
#   15 VAL  MGY          58 VAL  HB          4.50    (#   1324:20  Unique         2.36, 5.44 A)
 &rst
  ixpk= 1324, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1325    58 VAL  HB          4.50    (#   1325:20  Single Ambig)
 &rst
  ixpk= 1325, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 773, 774, 775, 777, 778, 779,1142,1143,1144,
 &end
#
#   58 VAL  MGY          58 VAL  HB          3.50    (#   1326:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1326, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  MGX          58 VAL  HB          3.50    (#   1327:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1327, nxpk= 20, iat=  -1, 848, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:1328    65 VAL  HB          5.50    (#   1328:20  Single Ambig)
 &rst
  ixpk= 1328, nxpk= 20, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 921, 922, 923, 925, 926, 927,1075,1076,1077,
 &end
#
#   65 VAL  HA           65 VAL  HB          4.50    (#   1329:20  Unique         2.42, 2.42 A)
 &rst
  ixpk= 1329, nxpk= 20, iat= 962, 964, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 VAL  MGX          65 VAL  HB          4.50    (#   1330:20  Unique         3.23, 6.19 A)
 &rst
  ixpk= 1330, nxpk= 20, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:1331    65 VAL  HB          2.80    (#   1331:20  Single Ambig)
 &rst
  ixpk= 1331, nxpk= 20, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972, 966, 967, 968, 970, 971, 972,
 &end
#
#   66 ASP  HB-          71 LYS  HB+         5.50    (#   1332:20  Unique         2.39, 3.80 A)
 &rst
  ixpk= 1332, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 980, 981,
 igr2=1051,1052,
 &end
#
#   71 LYS  HA           71 LYS  HB+         4.50    (#   1334:20  Unique         2.41, 2.78 A)
 &rst
  ixpk= 1334, nxpk= 20, iat=1049,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1051,1052,
 &end
#
#    0 AMB  20-3:1335     0 AMB  20-1:1335   3.50    (#   1335:20  Double Ambig)
 &rst
  ixpk= 1335, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1054,1055,1025,1026,1025,1026,
 igr2=1051,1052,1051,1052,1051,1052,
 &end
#
#   71 LYS  HG-          71 LYS  HB+         4.50    (#   1336:20  Unique         2.25, 2.69 A)
 &rst
  ixpk= 1336, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1054,1055,
 igr2=1051,1052,
 &end
#
#    0 AMB  20-3:1337     0 AMB  20-1:1337   4.50    (#   1337:20  Double Ambig)
 &rst
  ixpk= 1337, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1060,1061,1060,1061, 980, 981,
 igr2=1051,1052,1051,1052,1051,1052,
 &end
#
#   71 LYS  HA           71 LYS  HB-         4.50    (#   1338:20  Unique         2.41, 2.78 A)
 &rst
  ixpk= 1338, nxpk= 20, iat=1049,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1051,1052,
 &end
#
#    0 AMB  20-3:1340    71 LYS  HB-         3.50    (#   1340:20  Single Ambig)
 &rst
  ixpk= 1340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1054,1055,1025,1026,1025,1026,
 igr2=1051,1052,
 &end
#
#    0 AMB  20-3:1341    71 LYS  HB-         4.50    (#   1341:20  Single Ambig)
 &rst
  ixpk= 1341, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1060,1061,1060,1061, 980, 981,
 igr2=1051,1052,
 &end
#
#   71 LYS  HG-          71 LYS  HB-         4.50    (#   1342:20  Unique         2.25, 2.69 A)
 &rst
  ixpk= 1342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1054,1055,
 igr2=1051,1052,
 &end
#
#   66 ASP  HB-          71 LYS  HB-         5.50    (#   1343:20  Unique         2.39, 3.80 A)
 &rst
  ixpk= 1343, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 980, 981,
 igr2=1051,1052,
 &end
#
#   59 GLN  HB-          59 GLN  HG+         3.50    (#   1344:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 1344, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 864, 865,
 igr2= 867, 868,
 &end
#
#    0 AMB  20-3:1345     0 AMB  20-1:1345   4.50    (#   1345:20  Double Ambig)
 &rst
  ixpk= 1345, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.82, r4=10.32,
 igr1= 850, 851, 852, 854, 855, 856, 138, 139, 140, 142,
       143, 144, 138, 139, 140, 142, 143, 144,
 igr2= 867, 868, 867, 868, 867, 868,
 &end
#
#    0 AMB  20-3:1346    59 GLN  HG-         3.50    (#   1346:20  Single Ambig)
 &rst
  ixpk= 1346, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 864, 865, 836, 837,
 igr2= 867, 868,
 &end
#
#   59 GLN  HB-          59 GLN  HG-         4.50    (#   1347:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 1347, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 864, 865,
 igr2= 867, 868,
 &end
#
#    0 AMB  20-3:1348    59 GLN  HG-         4.50    (#   1348:20  Single Ambig)
 &rst
  ixpk= 1348, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 850, 851, 852, 854, 855, 856, 138, 139, 140, 142,
       143, 144, 138, 139, 140, 142, 143, 144,
 igr2= 867, 868,
 &end
#
#   26 ALA  HA            0 AMB  20-1:1356   3.50    (#   1356:20  Single Ambig)
 &rst
  ixpk= 1356, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 461, 462, 461, 462,
 &end
#
#    0 AMB  20-3:1357     0 AMB  20-1:1357   4.50    (#   1357:20  Double Ambig)
 &rst
  ixpk= 1357, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.80, r4= 9.30,
 igr1= 373, 374, 375,  45,  46,  45,  46,
 igr2= 461, 462, 461, 462,  90,  91,  90,  91,
 &end
#
#  106 GLN  HA            0 AMB  20-1:1358   5.50    (#   1358:20  Single Ambig)
 &rst
  ixpk= 1358, nxpk= 20, iat=1595,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1600,1601,1600,1601,
 &end
#
#   97 GLN  HA            0 AMB  20-1:1359   5.50    (#   1359:20  Single Ambig)
 &rst
  ixpk= 1359, nxpk= 20, iat=1472,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1477,1478,1477,1478,
 &end
#
#    0 AMB  20-3:1367     0 AMB  20-1:1367   2.80    (#   1367:20  Double Ambig)
 &rst
  ixpk= 1367, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1200,1201,1200,1201,1200,1201,
 igr2=1203,1204,1203,1204,1203,1204,
 &end
#
#    0 AMB  20-3:1370     0 AMB  20-1:1370   4.50    (#   1370:20  Double Ambig)
 &rst
  ixpk= 1370, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.00, r4= 9.50,
 igr1=1028,1029,1028,1029,1057,1058,1057,1058,
 igr2=1022,1023,1022,1023,1022,1023,1022,1023,
 &end
#
#   71 LYS  HG+          69 LYS  HB+         3.50    (#   1372:20  Unique         2.82, 5.81 A)
 &rst
  ixpk= 1372, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1054,1055,
 igr2=1022,1023,
 &end
#
#   69 LYS  HA           69 LYS  HB+         3.50    (#   1373:20  Unique         2.48, 2.81 A)
 &rst
  ixpk= 1373, nxpk= 20, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1022,1023,
 &end
#
#   46 LYS  HA            0 AMB  20-1:1374   2.80    (#   1374:20  Single Ambig)
 &rst
  ixpk= 1374, nxpk= 20, iat= 667,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 669, 670, 669, 670,
 &end
#
#    0 AMB  20-3:1375    10 VAL  HB          2.80    (#   1375:20  Single Ambig)
 &rst
  ixpk= 1375, nxpk= 20, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   69 LYS  HA           69 LYS  HB-         4.50    (#   1376:20  Unique         2.48, 2.81 A)
 &rst
  ixpk= 1376, nxpk= 20, iat=1020,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1022,1023,
 &end
#
#    0 AMB  20-3:1378    69 LYS  HB-         3.50    (#   1378:20  Single Ambig)
 &rst
  ixpk= 1378, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1025,1026,1025,1026,1054,1055,
 igr2=1022,1023,
 &end
#
#    4 LYS  HA            4 LYS  HB+         4.50    (#   1379:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 1379, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  45,  46,
 &end
#
#    4 LYS  HG+           4 LYS  HB+         3.50    (#   1381:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 1381, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  48,  49,
 igr2=  45,  46,
 &end
#
#    4 LYS  HA            4 LYS  HB-         4.50    (#   1382:20  Unique         2.35, 2.72 A)
 &rst
  ixpk= 1382, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  45,  46,
 &end
#
#    4 LYS  HG-           4 LYS  HB-         4.50    (#   1384:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 1384, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  48,  49,
 igr2=  45,  46,
 &end
#
#    4 LYS  HG+           4 LYS  HB-         3.50    (#   1385:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 1385, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  48,  49,
 igr2=  45,  46,
 &end
#
#   51 HIS  HA           51 HIS  HB+         5.50    (#   1386:20  Unique         2.51, 2.81 A)
 &rst
  ixpk= 1386, nxpk= 20, iat= 749,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 751, 752,
 &end
#
#    0 AMB  20-3:1388     0 AMB  20-1:1388   4.50    (#   1388:20  Double Ambig)
 &rst
  ixpk= 1388, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 581, 582, 583, 585, 586, 587, 771,
 igr2= 751, 752, 751, 752,
 &end
#
#   45 VAL  HA           45 VAL  HB          4.50    (#   1389:20  Unique         2.43, 2.58 A)
 &rst
  ixpk= 1389, nxpk= 20, iat= 651, 653, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1390    45 VAL  HB          4.50    (#   1390:20  Single Ambig)
 &rst
  ixpk= 1390, nxpk= 20, iat=  -1, 653, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 540, 541, 540, 541,
 &end
#
#    0 AMB  20-3:1391    45 VAL  HB          2.80    (#   1391:20  Single Ambig)
 &rst
  ixpk= 1391, nxpk= 20, iat=  -1, 653, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1= 597, 598, 599, 655, 656, 657, 659, 660, 661, 601,
      
 &end
#
#   19 GLN  HB-          19 GLN  HG-         3.50    (#   1395:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1395, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 272, 273,
 igr2= 275, 276,
 &end
#
#   19 GLN  HA           19 GLN  HG-         4.50    (#   1396:20  Unique         2.11, 3.03 A)
 &rst
  ixpk= 1396, nxpk= 20, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 275, 276,
 &end
#
#   98 VAL  HA           98 VAL  HB          5.50    (#   1400:20  Unique         2.42, 2.64 A)
 &rst
  ixpk= 1400, nxpk= 20, iat=1489,1491, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HB-          19 GLN  HG+         2.80    (#   1401:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1401, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 272, 273,
 igr2= 275, 276,
 &end
#
#  129 LYS  HA          129 LYS  HB+         2.80    (#   1404:20  Unique         2.39, 2.66 A)
 &rst
  ixpk= 1404, nxpk= 20, iat=1987,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1989,1990,
 &end
#
#  121 MET  HA            0 AMB  20-1:1405   4.50    (#   1405:20  Single Ambig)
 &rst
  ixpk= 1405, nxpk= 20, iat=1849,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1854,1855,1854,1855,
 &end
#
#    0 AMB  20-3:1406     0 AMB  20-1:1406   3.50    (#   1406:20  Double Ambig)
 &rst
  ixpk= 1406, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 270, 499,
 igr2= 275, 276, 501,
 &end
#
#    0 AMB  20-3:1407    35 VAL  HB          2.80    (#   1407:20  Single Ambig)
 &rst
  ixpk= 1407, nxpk= 20, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1103,1104, 327, 328, 329,
 &end
#
#    0 AMB  20-3:1408    35 VAL  HB          2.80    (#   1408:20  Single Ambig)
 &rst
  ixpk= 1408, nxpk= 20, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 4.40, r4= 4.90,
 igr1=1142,1143,1144, 581, 582, 583, 585, 586, 587, 503,
       504, 505, 507, 508, 509,
 &end
#
#    0 AMB  20-3:1409    35 VAL  HB          2.80    (#   1409:20  Single Ambig)
 &rst
  ixpk= 1409, nxpk= 20, iat=  -1, 501, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 503, 504, 505, 507, 508, 509,1108,1109,1110,1112,
      1113,1114,
 &end
#
#   26 ALA  MB           32 GLN  HB-         7.00    (#   1410:20  Unique         2.66, 5.04 A)
 &rst
  ixpk= 1410, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 373, 374, 375,
 igr2= 458, 459,
 &end
#
#   40 VAL  MGX          40 VAL  HB          2.80    (#   1411:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1411, nxpk= 20, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:1412    40 VAL  HB          2.80    (#   1412:20  Single Ambig)
 &rst
  ixpk= 1412, nxpk= 20, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 581, 582, 583, 585, 586, 587, 712, 713, 714,
 &end
#
#   45 VAL  MGX          40 VAL  HB          5.50    (#   1413:20  Unique         2.45, 5.27 A)
 &rst
  ixpk= 1413, nxpk= 20, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#   26 ALA  HA           32 GLN  HB+         5.50    (#   1414:20  Unique         1.95, 3.58 A)
 &rst
  ixpk= 1414, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 458, 459,
 &end
#
#   90 PRO  HD-           0 AMB  20-1:1416   4.50    (#   1416:20  Single Ambig)
 &rst
  ixpk= 1416, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1355,1356,
 igr2=1336,1337,1336,1337,
 &end
#
#    0 AMB  20-3:1420     0 AMB  20-1:1420   3.50    (#   1420:20  Double Ambig)
 &rst
  ixpk= 1420, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1854,1855,1854,1855,
 igr2=1851,1852,1851,1852,
 &end
#
#    0 AMB  20-3:1421   121 MET  HB-         3.50    (#   1421:20  Single Ambig)
 &rst
  ixpk= 1421, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1854,1855,1854,1855,
 igr2=1851,1852,
 &end
#
#   30 GLU  HA           30 GLU  HB+         3.50    (#   1422:20  Unique         2.37, 2.47 A)
 &rst
  ixpk= 1422, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 429, 430,
 &end
#
#   26 ALA  HA           32 GLN  HB-         5.50    (#   1423:20  Unique         1.95, 3.58 A)
 &rst
  ixpk= 1423, nxpk= 20, iat= 371,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 458, 459,
 &end
#
#   40 VAL  HA           40 VAL  HB          4.50    (#   1425:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 1425, nxpk= 20, iat= 577, 579, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1429     0 AMB  20-1:1429   2.80    (#   1429:20  Double Ambig)
 &rst
  ixpk= 1429, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1=1589,1364,1424,
 igr2=1586,1587,1361,1362,1421,1422,
 &end
#
#    0 AMB  20-3:1431     0 AMB  20-1:1431   5.50    (#   1431:20  Double Ambig)
 &rst
  ixpk= 1431, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1=1355,1356,1415,1416,1580,1581,
 igr2=1361,1362,1421,1422,1586,1587,
 &end
#
#    0 AMB  20-3:1434     0 AMB  20-1:1434   4.50    (#   1434:20  Double Ambig)
 &rst
  ixpk= 1434, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1355,1356,1415,1416,1580,1581,
 igr2=1361,1362,1421,1422,1586,1587,
 &end
#
#    0 AMB  20-3:1435     0 AMB  20-1:1435   7.00    (#   1435:20  Double Ambig)
 &rst
  ixpk= 1435, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=14.00, r4=14.50,
 igr1=1355,1356,1415,1416,1580,1581,1234,1235,
 igr2=1361,1362,1421,1422,1586,1587,1240,1241,
 &end
#
#    0 AMB  20-3:1437     0 AMB  20-1:1437   2.80    (#   1437:20  Double Ambig)
 &rst
  ixpk= 1437, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1243,1370,
 igr2=1240,1241,1361,1362,
 &end
#
#   54 VAL  HA           15 VAL  HB          4.50    (#   1440:20  Unique         2.00, 2.22 A)
 &rst
  ixpk= 1440, nxpk= 20, iat= 796, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 VAL  HA           15 VAL  HB          4.50    (#   1441:20  Unique         3.02, 3.02 A)
 &rst
  ixpk= 1441, nxpk= 20, iat= 214, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 VAL  MGY          15 VAL  HB          2.80    (#   1442:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1442, nxpk= 20, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1443    15 VAL  HB          2.80    (#   1443:20  Single Ambig)
 &rst
  ixpk= 1443, nxpk= 20, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806, 800, 801, 802, 804, 805, 806,
 &end
#
#   83 PRO  HA           83 PRO  HB-         3.50    (#   1446:20  Unique         2.30, 2.51 A)
 &rst
  ixpk= 1446, nxpk= 20, iat=1243,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1240,1241,
 &end
#
#    0 AMB  20-3:1447    83 PRO  HB-         2.80    (#   1447:20  Single Ambig)
 &rst
  ixpk= 1447, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1237,1238,1237,1238,
 igr2=1240,1241,
 &end
#
#    0 AMB  20-3:1450     0 AMB  20-1:1450   3.50    (#   1450:20  Double Ambig)
 &rst
  ixpk= 1450, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  65, 952,
 igr2=  87,  88,  87,  88,  87,  88,
 &end
#
#   56 ASP  HB+          15 VAL  HB          5.50    (#   1453:20  Unique         4.09, 4.58 A)
 &rst
  ixpk= 1453, nxpk= 20, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 821, 822,
 &end
#
#   19 GLN  HG+          19 GLN  HB+         3.50    (#   1454:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1454, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 275, 276,
 igr2= 272, 273,
 &end
#
#   19 GLN  HA           19 GLN  HB-         4.50    (#   1455:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 1455, nxpk= 20, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 272, 273,
 &end
#
#   36 HIS  HA           36 HIS  HB-         4.50    (#   1457:20  Unique         2.52, 2.81 A)
 &rst
  ixpk= 1457, nxpk= 20, iat= 515,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#    7 VAL  HA            7 VAL  HB          4.50    (#   1458:20  Unique         2.41, 2.52 A)
 &rst
  ixpk= 1458, nxpk= 20, iat= 100, 102, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 VAL  MGX           7 VAL  HB          2.80    (#   1459:20  Unique         2.22, 2.63 A)
 &rst
  ixpk= 1459, nxpk= 20, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  20-3:1460     7 VAL  HB          2.80    (#   1460:20  Single Ambig)
 &rst
  ixpk= 1460, nxpk= 20, iat=  -1, 102, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 104, 105, 106, 108, 109, 110, 921, 922, 923, 925,
       926, 927,
 &end
#
#   19 GLN  HA           19 GLN  HB+         4.50    (#   1461:20  Unique         2.39, 2.79 A)
 &rst
  ixpk= 1461, nxpk= 20, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 272, 273,
 &end
#
#   19 GLN  HG+          19 GLN  HB-         4.50    (#   1463:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 275, 276,
 igr2= 272, 273,
 &end
#
#   19 GLN  HG-          19 GLN  HB-         4.50    (#   1464:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 1464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 275, 276,
 igr2= 272, 273,
 &end
#
#    0 AMB  20-3:1469    62 VAL  HB          3.50    (#   1469:20  Single Ambig)
 &rst
  ixpk= 1469, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 104, 105, 106, 108, 109, 110, 921, 922, 923, 925,
       926, 927,
 &end
#
#    0 AMB  20-3:1470    62 VAL  HB          3.50    (#   1470:20  Single Ambig)
 &rst
  ixpk= 1470, nxpk= 20, iat=  -1, 919, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1108,1109,1110,1112,1113,1114, 921, 922, 923, 925,
       926, 927,
 &end
#
#   14 LYS  HG-          57 GLU  HB+         4.50    (#   1471:20  Unique         2.10, 4.18 A)
 &rst
  ixpk= 1471, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 197, 198,
 igr2= 833, 834,
 &end
#
#   54 VAL  HA           54 VAL  HB          4.50    (#   1472:20  Unique         2.42, 2.81 A)
 &rst
  ixpk= 1472, nxpk= 20, iat= 796, 798, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1473    54 VAL  HB          2.80    (#   1473:20  Single Ambig)
 &rst
  ixpk= 1473, nxpk= 20, iat=  -1, 798, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806,
 &end
#
#    0 AMB  20-3:1474    54 VAL  HB          7.00    (#   1474:20  Single Ambig)
 &rst
  ixpk= 1474, nxpk= 20, iat=  -1, 798, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 785, 720,
 &end
#
#   80 GLN  HA            0 AMB  20-1:1476   3.50    (#   1476:20  Single Ambig)
 &rst
  ixpk= 1476, nxpk= 20, iat=1198,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1200,1201,1200,1201,
 &end
#
#    0 AMB  20-3:1477     0 AMB  20-1:1477   4.50    (#   1477:20  Double Ambig)
 &rst
  ixpk= 1477, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1891,1370,
 igr2=1893,1894,1372,1373,1372,1373,
 &end
#
#    0 AMB  20-3:1482     0 AMB  20-1:1482   2.80    (#   1482:20  Double Ambig)
 &rst
  ixpk= 1482, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1=1203,1204,1203,1204,1203,1204,
 igr2=1200,1201,1200,1201,1200,1201,
 &end
#
#  100 GLU  HA          100 GLU  HB-         2.80    (#   1483:20  Unique         2.41, 2.68 A)
 &rst
  ixpk= 1483, nxpk= 20, iat=1516,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2=1518,1519,
 &end
#
#   87 GLU  HA           87 GLU  HB-         4.50    (#   1484:20  Unique         2.40, 2.76 A)
 &rst
  ixpk= 1484, nxpk= 20, iat=1308,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1310,1311,
 &end
#
#  117 GLU  HA            0 AMB  20-1:1485   2.80    (#   1485:20  Single Ambig)
 &rst
  ixpk= 1485, nxpk= 20, iat=1776,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2=1778,1779,1778,1779,
 &end
#
#    0 AMB  20-3:1487     0 AMB  20-1:1487   3.50    (#   1487:20  Double Ambig)
 &rst
  ixpk= 1487, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1516,1264,
 igr2=1518,1519,1251,1252,1251,1252,
 &end
#
#    0 AMB  20-3:1489     0 AMB  20-1:1489   2.80    (#   1489:20  Double Ambig)
 &rst
  ixpk= 1489, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1761,1249,
 igr2=1763,1764,1763,1764,1251,1252,1251,1252,
 &end
#
#   79 THR  MG2          59 GLN  HB+         4.50    (#   1491:20  Unique         3.17, 6.79 A)
 &rst
  ixpk= 1491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1188,1189,1190,
 igr2= 864, 865,
 &end
#
#    0 AMB  20-3:1493     0 AMB  20-1:1493   4.50    (#   1493:20  Double Ambig)
 &rst
  ixpk= 1493, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 igr2= 864, 865, 864, 865,
 &end
#
#   59 GLN  HG+          59 GLN  HB-         3.50    (#   1496:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 1496, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 867, 868,
 igr2= 864, 865,
 &end
#
#   79 THR  MG2          59 GLN  HB-         5.50    (#   1498:20  Unique         3.17, 6.79 A)
 &rst
  ixpk= 1498, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1188,1189,1190,
 igr2= 864, 865,
 &end
#
#    0 AMB  20-3:1499    59 GLN  HB-         4.50    (#   1499:20  Single Ambig)
 &rst
  ixpk= 1499, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 igr2= 864, 865,
 &end
#
#   37 ILE  HA            0 AMB  20-1:1500   4.50    (#   1500:20  Single Ambig)
 &rst
  ixpk= 1500, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 709, 710, 709, 710,
 &end
#
#    0 AMB  20-3:1501     0 AMB  20-1:1501   3.50    (#   1501:20  Double Ambig)
 &rst
  ixpk= 1501, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.80, r4= 7.30,
 igr1= 705, 706, 707, 581, 582, 583, 585, 586, 587,
 igr2= 709, 710, 709, 710, 709, 710,
 &end
#
#    0 AMB  20-3:1502     0 AMB  20-1:1502   2.80    (#   1502:20  Double Ambig)
 &rst
  ixpk= 1502, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.44, r4= 5.94,
 igr1= 581, 582, 583, 585, 586, 587, 712, 713, 714,
 igr2= 709, 710, 709, 710, 709, 710,
 &end
#
#   48 ILE  HB            0 AMB  20-1:1503   4.50    (#   1503:20  Single Ambig)
 &rst
  ixpk= 1503, nxpk= 20, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 709, 710, 709, 710,
 &end
#
#   69 LYS  HB-           0 AMB  20-1:1511   4.50    (#   1511:20  Single Ambig)
 &rst
  ixpk= 1511, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=1022,1023,
 igr2=1007,1008,1007,1008,
 &end
#
#    0 AMB  20-3:1513     0 AMB  20-1:1513   2.80    (#   1513:20  Double Ambig)
 &rst
  ixpk= 1513, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1834, 990,
 igr2=1836,1837, 992, 993,
 &end
#
#   59 GLN  HG-          59 GLN  HB-         2.80    (#   1517:20  Unique         2.25, 2.70 A)
 &rst
  ixpk= 1517, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 867, 868,
 igr2= 864, 865,
 &end
#
#    0 AMB  20-3:1528     0 AMB  20-1:1528   7.00    (#   1528:20  Double Ambig)
 &rst
  ixpk= 1528, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.90, r4=10.40,
 igr1= 562, 499,
 igr2= 564, 565, 564, 565,
 &end
#
#   76 ILE  HB            0 AMB  20-1:1530   5.50    (#   1530:20  Single Ambig)
 &rst
  ixpk= 1530, nxpk= 20, iat=1133,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 564, 565, 564, 565,
 &end
#
#    0 AMB  20-3:1534     0 AMB  20-1:1534   2.80    (#   1534:20  Double Ambig)
 &rst
  ixpk= 1534, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1005, 412,
 igr2=1007,1008,1007,1008, 414, 415,
 &end
#
#    0 AMB  20-3:1538     0 AMB  20-1:1538   3.50    (#   1538:20  Double Ambig)
 &rst
  ixpk= 1538, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2= 992, 993, 992, 993,1007,1008,
 &end
#
#   77 ARG  HD-          77 ARG  HB-         7.00    (#   1542:20  Unique         2.14, 2.93 A)
 &rst
  ixpk= 1542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1158,1159,
 igr2=1152,1153,
 &end
#
#  106 GLN  HA          106 GLN  HB-         4.50    (#   1543:20  Unique         2.37, 2.70 A)
 &rst
  ixpk= 1543, nxpk= 20, iat=1595,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1597,1598,
 &end
#
#   29 GLU  HA           29 GLU  HB-         2.80    (#   1544:20  Unique         2.38, 2.74 A)
 &rst
  ixpk= 1544, nxpk= 20, iat= 412,  -1, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr2= 414, 415,
 &end
#
#   50 GLU  HA           50 GLU  HB-         4.50    (#   1545:20  Unique         2.35, 2.68 A)
 &rst
  ixpk= 1545, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 737,
 &end
#
#    0 AMB  20-3:1549    50 GLU  HB-         3.50    (#   1549:20  Single Ambig)
 &rst
  ixpk= 1549, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1= 672, 673, 672, 673,
 igr2= 736, 737,
 &end
#
#   77 ARG  HA           77 ARG  HB+         4.50    (#   1551:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 1551, nxpk= 20, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1152,1153,
 &end
#
#   77 ARG  HD+          77 ARG  HB+         5.50    (#   1552:20  Unique         2.14, 2.93 A)
 &rst
  ixpk= 1552, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1158,1159,
 igr2=1152,1153,
 &end
#
#   77 ARG  HG+          77 ARG  HB+         4.50    (#   1553:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1553, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1155,1156,
 igr2=1152,1153,
 &end
#
#    0 AMB  20-3:1556    77 ARG  HB-         7.00    (#   1556:20  Single Ambig)
 &rst
  ixpk= 1556, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 607, 562,
 igr2=1152,1153,
 &end
#
#   77 ARG  HA           77 ARG  HB-         4.50    (#   1557:20  Unique         2.37, 2.45 A)
 &rst
  ixpk= 1557, nxpk= 20, iat=1150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1152,1153,
 &end
#
#   77 ARG  HD+          77 ARG  HB-         5.50    (#   1558:20  Unique         2.14, 2.93 A)
 &rst
  ixpk= 1558, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1158,1159,
 igr2=1152,1153,
 &end
#
#   77 ARG  HG+          77 ARG  HB-         5.50    (#   1560:20  Unique         2.24, 2.72 A)
 &rst
  ixpk= 1560, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1155,1156,
 igr2=1152,1153,
 &end
#
#    4 LYS  HA            0 AMB  20-1:1574   5.50    (#   1574:20  Single Ambig)
 &rst
  ixpk= 1574, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=  51,  52,  51,  52,
 &end
#
#    4 LYS  HB-           0 AMB  20-1:1575   3.50    (#   1575:20  Single Ambig)
 &rst
  ixpk= 1575, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=  45,  46,
 igr2=  51,  52,  51,  52,
 &end
#
#    4 LYS  HG-           0 AMB  20-1:1576   4.50    (#   1576:20  Single Ambig)
 &rst
  ixpk= 1576, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  48,  49,
 igr2=  51,  52,  51,  52,
 &end
#
#    0 AMB  20-3:1577     0 AMB  20-1:1577   3.50    (#   1577:20  Double Ambig)
 &rst
  ixpk= 1577, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  54,  55,  54,  55,  54,  55,
 igr2=  51,  52,  51,  52,  51,  52,
 &end
#
#    0 AMB  20-3:1578     0 AMB  20-1:1578   3.50    (#   1578:20  Double Ambig)
 &rst
  ixpk= 1578, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=  48,  49,  48,  49,
 igr2=  51,  52,  51,  52,
 &end
#
#    0 AMB  20-3:1580     0 AMB  20-1:1580   4.50    (#   1580:20  Double Ambig)
 &rst
  ixpk= 1580, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1=1188,1189,1190, 900, 901, 900, 901,
 igr2=1139,1140,1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:1582     0 AMB  20-1:1582   3.50    (#   1582:20  Double Ambig)
 &rst
  ixpk= 1582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 503, 504, 505, 507, 508, 509, 883, 884, 885, 887,
       888, 889,
 igr2=1139,1140,1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:1583     0 AMB  20-1:1583   4.50    (#   1583:20  Double Ambig)
 &rst
  ixpk= 1583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.39, r4= 8.89,
 igr1= 883, 884, 885, 887, 888, 889, 771,
 igr2=1139,1140,1139,1140,1139,1140,
 &end
#
#   76 ILE  HA            0 AMB  20-1:1584   4.50    (#   1584:20  Single Ambig)
 &rst
  ixpk= 1584, nxpk= 20, iat=1131,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1139,1140,1139,1140,
 &end
#
#    0 AMB  20-3:1586     0 AMB  20-1:1586   4.50    (#   1586:20  Double Ambig)
 &rst
  ixpk= 1586, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1049,1131,
 igr2=1057,1058,1057,1058,1139,1140,1139,1140,
 &end
#
#   71 LYS  HA            0 AMB  20-1:1587   4.50    (#   1587:20  Single Ambig)
 &rst
  ixpk= 1587, nxpk= 20, iat=1049,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1057,1058,1057,1058,
 &end
#
#   37 ILE  QD1           0 AMB  20-1:1591   2.80    (#   1591:20  Single Ambig)
 &rst
  ixpk= 1591, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 543, 544, 545,
 igr2= 540, 541, 540, 541,
 &end
#
#   37 ILE  HA            0 AMB  20-1:1593   3.50    (#   1593:20  Single Ambig)
 &rst
  ixpk= 1593, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2= 540, 541, 540, 541,
 &end
#
#   37 ILE  QG2           0 AMB  20-1:1594   3.50    (#   1594:20  Single Ambig)
 &rst
  ixpk= 1594, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 536, 537, 538,
 igr2= 540, 541, 540, 541,
 &end
#
#   40 VAL  MGX           0 AMB  20-1:1596   2.80    (#   1596:20  Single Ambig)
 &rst
  ixpk= 1596, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 581, 582, 583, 585, 586, 587,
 igr2= 540, 541, 540, 541,
 &end
#
#    0 AMB  20-3:1597     0 AMB  20-1:1597   5.50    (#   1597:20  Double Ambig)
 &rst
  ixpk= 1597, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 689, 720,
 igr2= 540, 541, 540, 541, 540, 541,
 &end
#
#   48 ILE  HB            0 AMB  20-1:1603   7.00    (#   1603:20  Single Ambig)
 &rst
  ixpk= 1603, nxpk= 20, iat= 703,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 540, 541, 540, 541,
 &end
#
#   72 ILE  HA           72 ILE  HG1+        5.50    (#   1605:20  Unique         2.57, 3.02 A)
 &rst
  ixpk= 1605, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:1607     0 AMB  20-1:1607   2.80    (#   1607:20  Double Ambig)
 &rst
  ixpk= 1607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.34, r4= 5.84,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2=1079,1080,1079,1080,
 &end
#
#   72 ILE  QD1          72 ILE  HG1+        3.50    (#   1608:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1608, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1082,1083,1084,
 igr2=1079,1080,
 &end
#
#   72 ILE  HA           72 ILE  HG1-        5.50    (#   1611:20  Unique         2.57, 3.02 A)
 &rst
  ixpk= 1611, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:1612    72 ILE  HG1-        2.80    (#   1612:20  Single Ambig)
 &rst
  ixpk= 1612, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2=1079,1080,
 &end
#
#   72 ILE  QD1          72 ILE  HG1-        3.50    (#   1613:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 1613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1082,1083,1084,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:1623    24 PHE  HA          4.50    (#   1623:20  Single Ambig)
 &rst
  ixpk= 1623, nxpk= 20, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 497, 228,
 &end
#
#    0 AMB  20-3:1624    73 SER  HA          5.50    (#   1624:20  Single Ambig)
 &rst
  ixpk= 1624, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1069,1118,
 &end
#
#   24 PHE  HD           24 PHE  HA          4.50    (#   1625:20  Unique         2.52, 3.36 A)
 &rst
  ixpk= 1625, nxpk= 20, iat=  -1, 335, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 341, 349,
 &end
#
#   34 LEU  HA           24 PHE  HA          3.50    (#   1626:20  Unique         2.49, 2.83 A)
 &rst
  ixpk= 1626, nxpk= 20, iat= 480, 335, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 LEU  HN           73 SER  HA          4.50    (#   1627:20  Unique         3.11, 4.01 A)
 &rst
  ixpk= 1627, nxpk= 20, iat= 478,1090, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HN           73 SER  HA          3.50    (#   1628:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1628, nxpk= 20, iat=1099,1090, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   76 ILE  HN           75 SER  HA          4.50    (#   1629:20  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1629, nxpk= 20, iat=1129,1120, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1630    60 VAL  HA          3.50    (#   1630:20  Single Ambig)
 &rst
  ixpk= 1630, nxpk= 20, iat=  -1, 879, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 893, 877,
 &end
#
#   58 VAL  HN           57 GLU  HA          2.80    (#   1631:20  Unique         2.15, 2.15 A)
 &rst
  ixpk= 1631, nxpk= 20, iat= 844, 831, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   57 GLU  HN           57 GLU  HA          4.50    (#   1632:20  Unique         2.86, 2.86 A)
 &rst
  ixpk= 1632, nxpk= 20, iat= 829, 831, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 VAL  HN           57 GLU  HA          4.50    (#   1633:20  Unique         3.34, 3.57 A)
 &rst
  ixpk= 1633, nxpk= 20, iat= 212, 831, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 GLY  HN           59 GLN  HA          4.50    (#   1637:20  Unique         2.96, 3.47 A)
 &rst
  ixpk= 1637, nxpk= 20, iat= 183, 862, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 VAL  HN           59 GLN  HA          3.50    (#   1638:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 1638, nxpk= 20, iat= 877, 862, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   59 GLN  HN           59 GLN  HA          5.50    (#   1639:20  Unique         2.76, 2.90 A)
 &rst
  ixpk= 1639, nxpk= 20, iat= 860, 862, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:1640    32 GLN  HA          2.80    (#   1640:20  Single Ambig)
 &rst
  ixpk= 1640, nxpk= 20, iat=  -1, 456, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 471, 454,
 &end
#
#   27 LEU  HN           32 GLN  HA          4.50    (#   1641:20  Unique         2.38, 3.02 A)
 &rst
  ixpk= 1641, nxpk= 20, iat= 379, 456, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 VAL  HN           14 LYS  HA          3.50    (#   1642:20  Unique         2.14, 2.20 A)
 &rst
  ixpk= 1642, nxpk= 20, iat= 212, 192, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   14 LYS  HN           14 LYS  HA          4.50    (#   1643:20  Unique         2.90, 2.93 A)
 &rst
  ixpk= 1643, nxpk= 20, iat= 190, 192, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HA           14 LYS  HA          3.50    (#   1644:20  Unique         1.99, 2.17 A)
 &rst
  ixpk= 1644, nxpk= 20, iat= 831, 192, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   11 TYR  HN           61 LYS  HA          4.50    (#   1645:20  Unique         2.00, 2.89 A)
 &rst
  ixpk= 1645, nxpk= 20, iat= 148, 895, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 VAL  HN           61 LYS  HA          4.50    (#   1646:20  Unique         2.14, 2.25 A)
 &rst
  ixpk= 1646, nxpk= 20, iat= 915, 895, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 VAL  HA           61 LYS  HA          3.50    (#   1648:20  Unique         1.97, 2.36 A)
 &rst
  ixpk= 1648, nxpk= 20, iat= 134, 895, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 VAL  HN           34 LEU  HA          3.50    (#   1649:20  Unique         2.16, 2.20 A)
 &rst
  ixpk= 1649, nxpk= 20, iat= 497, 480, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 PHE  HA           34 LEU  HA          4.50    (#   1650:20  Unique         2.49, 2.83 A)
 &rst
  ixpk= 1650, nxpk= 20, iat= 335, 480, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 LEU  HN           74 LEU  HA          5.50    (#   1651:20  Unique         2.85, 3.13 A)
 &rst
  ixpk= 1651, nxpk= 20, iat= 931,1101, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 SER  HN           74 LEU  HA          4.50    (#   1652:20  Unique         2.19, 2.29 A)
 &rst
  ixpk= 1652, nxpk= 20, iat=1118,1101, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 GLU  HN           66 ASP  HA          4.50    (#   1654:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1654, nxpk= 20, iat= 988, 978, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 PHE  HN           23 ALA  HA          3.50    (#   1656:20  Unique         2.16, 2.30 A)
 &rst
  ixpk= 1656, nxpk= 20, iat= 333, 325, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:1657    23 ALA  HA          4.50    (#   1657:20  Single Ambig)
 &rst
  ixpk= 1657, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 268, 323,
 &end
#
#   18 LEU  HA           23 ALA  HA          3.50    (#   1659:20  Unique         2.00, 2.28 A)
 &rst
  ixpk= 1659, nxpk= 20, iat= 251, 325, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 GLY  HN           12 THR  HA          3.50    (#   1667:20  Unique         2.15, 2.20 A)
 &rst
  ixpk= 1667, nxpk= 20, iat= 183, 171, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 VAL  HN           12 THR  HA          4.50    (#   1668:20  Unique         2.73, 3.87 A)
 &rst
  ixpk= 1668, nxpk= 20, iat= 877, 171, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 VAL  HN           10 VAL  HA          5.50    (#   1671:20  Unique         2.89, 2.93 A)
 &rst
  ixpk= 1671, nxpk= 20, iat= 132, 134, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   11 TYR  HN           10 VAL  HA          3.50    (#   1672:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1672, nxpk= 20, iat= 148, 134, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  HN           10 VAL  HA          4.50    (#   1673:20  Unique         3.19, 3.87 A)
 &rst
  ixpk= 1673, nxpk= 20, iat= 915, 134, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 LEU  HA           35 VAL  HA          5.50    (#   1677:20  Unique         4.38, 4.40 A)
 &rst
  ixpk= 1677, nxpk= 20, iat= 480, 499, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   35 VAL  HN           35 VAL  HA          4.50    (#   1678:20  Unique         2.94, 2.95 A)
 &rst
  ixpk= 1678, nxpk= 20, iat= 497, 499, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 HIS  HN            0 AMB  20-1:1679   3.50    (#   1679:20  Single Ambig)
 &rst
  ixpk= 1679, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 499, 515,
 &end
#
#    0 AMB  20-3:1680     0 AMB  20-1:1680   4.50    (#   1680:20  Double Ambig)
 &rst
  ixpk= 1680, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1099, 560, 323,
 igr2= 499, 515,
 &end
#
#   37 ILE  HN           36 HIS  HA          3.50    (#   1681:20  Unique         2.17, 2.25 A)
 &rst
  ixpk= 1681, nxpk= 20, iat= 530, 515, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 GLU  HN           29 GLU  HA          4.50    (#   1683:20  Unique         2.27, 2.28 A)
 &rst
  ixpk= 1683, nxpk= 20, iat= 410, 412, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 GLU  HN           67 GLU  HA          4.50    (#   1684:20  Unique         3.42, 3.46 A)
 &rst
  ixpk= 1684, nxpk= 20, iat=1003, 990, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 HIS  HN           41 THR  HA          4.50    (#   1685:20  Unique         2.17, 2.36 A)
 &rst
  ixpk= 1685, nxpk= 20, iat= 605, 593, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   41 THR  HN           41 THR  HA          4.50    (#   1686:20  Unique         2.87, 2.91 A)
 &rst
  ixpk= 1686, nxpk= 20, iat= 591, 593, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   69 LYS  HN           68 GLU  HA          4.50    (#   1687:20  Unique         3.52, 3.56 A)
 &rst
  ixpk= 1687, nxpk= 20, iat=1018,1005, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 GLU  HN           68 GLU  HA          4.50    (#   1688:20  Unique         2.77, 2.85 A)
 &rst
  ixpk= 1688, nxpk= 20, iat=1003,1005, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   67 GLU  HN           67 GLU  HA          4.50    (#   1689:20  Unique         2.84, 2.88 A)
 &rst
  ixpk= 1689, nxpk= 20, iat= 988, 990, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 GLY  HN           67 GLU  HA          4.50    (#   1690:20  Unique         3.28, 3.70 A)
 &rst
  ixpk= 1690, nxpk= 20, iat=1040, 990, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1691    77 ARG  HA          4.50    (#   1691:20  Single Ambig)
 &rst
  ixpk= 1691, nxpk= 20, iat=  -1,1150, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1148, 605,
 &end
#
#  118 TRP  HD1         118 TRP  HA          5.50    (#   1693:20  Unique         2.63, 4.03 A)
 &rst
  ixpk= 1693, nxpk= 20, iat=1797,1791, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:1694     0 AMB  20-1:1694   4.50    (#   1694:20  Double Ambig)
 &rst
  ixpk= 1694, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1625,1633,1808,
 igr2=1619,1791,
 &end
#
#  119 ILE  HN          118 TRP  HA          4.50    (#   1695:20  Unique         2.14, 2.33 A)
 &rst
  ixpk= 1695, nxpk= 20, iat=1813,1791, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 VAL  HN           44 PHE  HA          2.80    (#   1698:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1698, nxpk= 20, iat= 649, 631, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   44 PHE  HD           44 PHE  HA          4.50    (#   1699:20  Unique         2.07, 3.58 A)
 &rst
  ixpk= 1699, nxpk= 20, iat=  -1, 631, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 637, 645,
 &end
#
#  108 PHE  HD          108 PHE  HA          5.50    (#   1700:20  Unique         2.17, 3.63 A)
 &rst
  ixpk= 1700, nxpk= 20, iat=  -1,1619, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1625,1633,
 &end
#
#   43 GLY  HN           42 HIS  HA          4.50    (#   1702:20  Unique         2.28, 3.34 A)
 &rst
  ixpk= 1702, nxpk= 20, iat= 622, 607, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  118 TRP  HN          117 GLU  HA          4.50    (#   1704:20  Unique         2.14, 2.48 A)
 &rst
  ixpk= 1704, nxpk= 20, iat=1789,1776, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 GLU  HN           50 GLU  HA          4.50    (#   1709:20  Unique         2.77, 2.84 A)
 &rst
  ixpk= 1709, nxpk= 20, iat= 732, 734, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   51 HIS  HN           50 GLU  HA          5.50    (#   1710:20  Unique         3.43, 3.46 A)
 &rst
  ixpk= 1710, nxpk= 20, iat= 747, 734, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   52 LEU  HN           51 HIS  HA          4.50    (#   1711:20  Unique         3.46, 3.54 A)
 &rst
  ixpk= 1711, nxpk= 20, iat= 764, 749, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PHE  HN            5 PHE  HA          4.50    (#   1712:20  Unique         2.28, 2.81 A)
 &rst
  ixpk= 1712, nxpk= 20, iat=  63,  65, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 GLU  HN            5 PHE  HA          3.50    (#   1714:20  Unique         2.14, 2.30 A)
 &rst
  ixpk= 1714, nxpk= 20, iat=  83,  65, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    5 PHE  HD            5 PHE  HA          4.50    (#   1715:20  Unique         2.02, 3.44 A)
 &rst
  ixpk= 1715, nxpk= 20, iat=  -1,  65, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  71,  79,
 &end
#
#    4 LYS  HN            4 LYS  HA          4.50    (#   1716:20  Unique         2.86, 2.93 A)
 &rst
  ixpk= 1716, nxpk= 20, iat=  41,  43, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PHE  HN            4 LYS  HA          3.50    (#   1717:20  Unique         3.09, 3.40 A)
 &rst
  ixpk= 1717, nxpk= 20, iat=  63,  43, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:1718     0 AMB  20-1:1718   3.50    (#   1718:20  Double Ambig)
 &rst
  ixpk= 1718, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1544,1935,1450,1913,
 igr2=1531,1915,1430,
 &end
#
#  112 LYS  HN          112 LYS  HA          4.50    (#   1720:20  Unique         2.28, 2.86 A)
 &rst
  ixpk= 1720, nxpk= 20, iat=1684,1686, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 GLU  HN           84 GLU  HA          4.50    (#   1721:20  Unique         2.27, 2.84 A)
 &rst
  ixpk= 1721, nxpk= 20, iat=1247,1249, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   85 LYS  HN           84 GLU  HA          4.50    (#   1722:20  Unique         2.16, 2.49 A)
 &rst
  ixpk= 1722, nxpk= 20, iat=1262,1249, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  130 LYS  HN          129 LYS  HA          4.50    (#   1723:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 1723, nxpk= 20, iat=2007,1987, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   87 GLU  HN           86 LYS  HA          4.50    (#   1724:20  Unique         2.14, 2.19 A)
 &rst
  ixpk= 1724, nxpk= 20, iat=1306,1286, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  115 LEU  HN          114 LYS  HA          3.50    (#   1725:20  Unique         2.14, 2.28 A)
 &rst
  ixpk= 1725, nxpk= 20, iat=1740,1720, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  114 LYS  HN          114 LYS  HA          4.50    (#   1726:20  Unique         2.77, 2.91 A)
 &rst
  ixpk= 1726, nxpk= 20, iat=1718,1720, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 GLU  HN           30 GLU  HA          4.50    (#   1727:20  Unique         2.91, 2.93 A)
 &rst
  ixpk= 1727, nxpk= 20, iat= 425, 427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 THR  HN           30 GLU  HA          4.50    (#   1728:20  Unique         3.53, 3.54 A)
 &rst
  ixpk= 1728, nxpk= 20, iat= 440, 427, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1729     0 AMB  20-1:1729   3.50    (#   1729:20  Double Ambig)
 &rst
  ixpk= 1729, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1392,1284,1262,
 igr2=1370,1264,
 &end
#
#   63 LEU  HN           63 LEU  HA          7.00    (#   1730:20  Unique         2.82, 2.92 A)
 &rst
  ixpk= 1730, nxpk= 20, iat= 931, 933, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   69 LYS  HN           69 LYS  HA          4.50    (#   1731:20  Unique         2.83, 2.89 A)
 &rst
  ixpk= 1731, nxpk= 20, iat=1018,1020, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   70 GLY  HN           69 LYS  HA          4.50    (#   1732:20  Unique         3.46, 3.50 A)
 &rst
  ixpk= 1732, nxpk= 20, iat=1040,1020, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           27 LEU  HA          4.50    (#   1734:20  Unique         2.88, 2.92 A)
 &rst
  ixpk= 1734, nxpk= 20, iat= 379, 381, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ASP  HN           56 ASP  HA          4.50    (#   1736:20  Unique         2.94, 2.95 A)
 &rst
  ixpk= 1736, nxpk= 20, iat= 817, 819, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HN           56 ASP  HA          2.80    (#   1738:20  Unique         2.18, 2.24 A)
 &rst
  ixpk= 1738, nxpk= 20, iat= 829, 819, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#  112 LYS  HN          111 LEU  HA          5.50    (#   1739:20  Unique         2.14, 2.42 A)
 &rst
  ixpk= 1739, nxpk= 20, iat=1684,1667, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  128 ILE  HN          127 LEU  HA          4.50    (#   1741:20  Unique         2.14, 2.24 A)
 &rst
  ixpk= 1741, nxpk= 20, iat=1966,1949, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 TYR  HN           21 TYR  HA          4.50    (#   1742:20  Unique         2.79, 2.91 A)
 &rst
  ixpk= 1742, nxpk= 20, iat= 295, 297, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 TYR  HD           21 TYR  HA          4.50    (#   1743:20  Unique         2.50, 3.61 A)
 &rst
  ixpk= 1743, nxpk= 20, iat=  -1, 297, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 303, 312,
 &end
#
#  114 LYS  HN          113 ASP  HA          4.50    (#   1744:20  Unique         2.14, 2.42 A)
 &rst
  ixpk= 1744, nxpk= 20, iat=1718,1708, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 GLN  HN           80 GLN  HA          4.50    (#   1745:20  Unique         2.83, 2.92 A)
 &rst
  ixpk= 1745, nxpk= 20, iat=1196,1198, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   81 ALA  HN           80 GLN  HA          3.50    (#   1746:20  Unique         2.17, 2.49 A)
 &rst
  ixpk= 1746, nxpk= 20, iat=1213,1198, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   40 VAL  HN           39 GLU  HA          5.50    (#   1747:20  Unique         2.85, 3.21 A)
 &rst
  ixpk= 1747, nxpk= 20, iat= 575, 562, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  127 LEU  HN          126 ASP  HA          5.50    (#   1751:20  Unique         2.14, 2.40 A)
 &rst
  ixpk= 1751, nxpk= 20, iat=1947,1937, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   28 ASP  HN           28 ASP  HA          4.50    (#   1755:20  Unique         2.94, 2.94 A)
 &rst
  ixpk= 1755, nxpk= 20, iat= 398, 400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   29 GLU  HN           28 ASP  HA          4.50    (#   1756:20  Unique         2.76, 2.89 A)
 &rst
  ixpk= 1756, nxpk= 20, iat= 410, 400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1757    78 ALA  HA          4.50    (#   1757:20  Single Ambig)
 &rst
  ixpk= 1757, nxpk= 20, iat=  -1,1174, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1172,1223,
 &end
#
#   19 GLN  HN           19 GLN  HA          4.50    (#   1758:20  Unique         2.86, 2.92 A)
 &rst
  ixpk= 1758, nxpk= 20, iat= 268, 270, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   20 ALA  HN           19 GLN  HA          4.50    (#   1759:20  Unique         2.28, 2.58 A)
 &rst
  ixpk= 1759, nxpk= 20, iat= 285, 270, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 ALA  HN           64 ALA  HA          4.50    (#   1760:20  Unique         2.80, 2.88 A)
 &rst
  ixpk= 1760, nxpk= 20, iat= 950, 952, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   65 VAL  HN           64 ALA  HA          2.80    (#   1761:20  Unique         2.17, 2.26 A)
 &rst
  ixpk= 1761, nxpk= 20, iat= 960, 952, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  20-3:1762     0 AMB  20-1:1762   3.50    (#   1762:20  Double Ambig)
 &rst
  ixpk= 1762, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=1223,1470,1460,1450,
 igr2=1215,1462,1452,
 &end
#
#    4 LYS  HN            3 ALA  HA          3.50    (#   1763:20  Unique         2.14, 2.26 A)
 &rst
  ixpk= 1763, nxpk= 20, iat=  41,  33, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 GLY  HN           70 GLY  HA+         3.50    (#   1765:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 1765, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1042,1043,
 &end
#
#   71 LYS  HN           70 GLY  HA+         4.50    (#   1766:20  Unique         2.55, 3.18 A)
 &rst
  ixpk= 1766, nxpk= 20, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1042,1043,
 &end
#
#   70 GLY  HN           70 GLY  HA-         4.50    (#   1767:20  Unique         2.30, 2.63 A)
 &rst
  ixpk= 1767, nxpk= 20, iat=1040,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1042,1043,
 &end
#
#   23 ALA  HN           22 GLY  HA+         4.50    (#   1769:20  Unique         2.16, 2.58 A)
 &rst
  ixpk= 1769, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   17 GLY  HN           17 GLY  HA+         4.50    (#   1770:20  Unique         2.62, 2.80 A)
 &rst
  ixpk= 1770, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 244, 245,
 &end
#
#   22 GLY  HN           22 GLY  HA-         4.50    (#   1771:20  Unique         2.48, 2.79 A)
 &rst
  ixpk= 1771, nxpk= 20, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   23 ALA  HN           22 GLY  HA-         4.50    (#   1772:20  Unique         2.16, 2.58 A)
 &rst
  ixpk= 1772, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   18 LEU  HN           17 GLY  HA+         3.50    (#   1773:20  Unique         2.14, 2.64 A)
 &rst
  ixpk= 1773, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 244, 245,
 &end
#
#   17 GLY  HN           17 GLY  HA-         4.50    (#   1774:20  Unique         2.62, 2.80 A)
 &rst
  ixpk= 1774, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 244, 245,
 &end
#
#   18 LEU  HN           17 GLY  HA-         4.50    (#   1775:20  Unique         2.14, 2.64 A)
 &rst
  ixpk= 1775, nxpk= 20, iat= 249,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 244, 245,
 &end
#
#    8 GLY  HN            8 GLY  HA+         4.50    (#   1776:20  Unique         2.33, 2.66 A)
 &rst
  ixpk= 1776, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 116, 117,
 &end
#
#    8 GLY  HN            8 GLY  HA+         4.50    (#   1777:20  Unique         2.33, 2.66 A)
 &rst
  ixpk= 1777, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 116, 117,
 &end
#
#    8 GLY  HN            8 GLY  HA-         4.50    (#   1778:20  Unique         2.33, 2.66 A)
 &rst
  ixpk= 1778, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 116, 117,
 &end
#
#   55 GLY  HN           55 GLY  HA+         4.50    (#   1779:20  Unique         2.29, 2.59 A)
 &rst
  ixpk= 1779, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 812, 813,
 &end
#
#   56 ASP  HN           55 GLY  HA+         7.00    (#   1780:20  Unique         2.95, 3.25 A)
 &rst
  ixpk= 1780, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 812, 813,
 &end
#
#   55 GLY  HN           55 GLY  HA-         4.50    (#   1781:20  Unique         2.29, 2.59 A)
 &rst
  ixpk= 1781, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 812, 813,
 &end
#
#   34 LEU  HN           33 GLY  HA-         4.50    (#   1782:20  Unique         2.33, 2.57 A)
 &rst
  ixpk= 1782, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 473, 474,
 &end
#
#   34 LEU  HA           33 GLY  HA-         4.50    (#   1783:20  Unique         4.33, 4.44 A)
 &rst
  ixpk= 1783, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 473, 474,
 &end
#
#    0 AMB  20-3:1784    33 GLY  HA-         4.50    (#   1784:20  Single Ambig)
 &rst
  ixpk= 1784, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 471,1069,
 igr2= 473, 474,
 &end
#
#    0 AMB  20-3:1786     0 AMB  20-1:1786   3.50    (#   1786:20  Double Ambig)
 &rst
  ixpk= 1786, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 629, 622,
 igr2= 624, 625, 624, 625, 624, 625,
 &end
#
#   13 GLY  HN           13 GLY  HA-         4.50    (#   1787:20  Unique         2.51, 2.78 A)
 &rst
  ixpk= 1787, nxpk= 20, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   14 LYS  HN           13 GLY  HA-         4.50    (#   1788:20  Unique         2.14, 2.59 A)
 &rst
  ixpk= 1788, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   13 GLY  HN           13 GLY  HA-         4.50    (#   1789:20  Unique         2.51, 2.78 A)
 &rst
  ixpk= 1789, nxpk= 20, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   12 THR  HN           11 TYR  HB+         4.50    (#   1790:20  Unique         2.12, 3.33 A)
 &rst
  ixpk= 1790, nxpk= 20, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 152, 153,
 &end
#
#   11 TYR  HD           11 TYR  HB+         3.50    (#   1791:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 1791, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 156, 165,
 igr2= 152, 153,
 &end
#
#   11 TYR  HN           11 TYR  HB+         4.50    (#   1792:20  Unique         2.07, 2.98 A)
 &rst
  ixpk= 1792, nxpk= 20, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 152, 153,
 &end
#
#   45 VAL  HN           44 PHE  HB-         7.00    (#   1793:20  Unique         3.02, 3.91 A)
 &rst
  ixpk= 1793, nxpk= 20, iat= 649,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 633, 634,
 &end
#
#   29 GLU  HN           28 ASP  HB+         4.50    (#   1794:20  Unique         4.07, 4.29 A)
 &rst
  ixpk= 1794, nxpk= 20, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 402, 403,
 &end
#
#   29 GLU  HN           28 ASP  HB-         4.50    (#   1795:20  Unique         4.07, 4.29 A)
 &rst
  ixpk= 1795, nxpk= 20, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 402, 403,
 &end
#
#   44 PHE  HD           44 PHE  HB-         4.50    (#   1796:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 1796, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 637, 645,
 igr2= 633, 634,
 &end
#
#   44 PHE  HN           44 PHE  HB-         7.00    (#   1797:20  Unique         2.32, 3.05 A)
 &rst
  ixpk= 1797, nxpk= 20, iat= 629,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 633, 634,
 &end
#
#   21 TYR  HD           21 TYR  HB+         3.50    (#   1798:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 1798, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 303, 312,
 igr2= 299, 300,
 &end
#
#    0 AMB  20-3:1799    12 THR  HB          4.50    (#   1799:20  Single Ambig)
 &rst
  ixpk= 1799, nxpk= 20, iat=  -1, 173, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 171, 862,
 &end
#
#   12 THR  HN           12 THR  HB          3.50    (#   1800:20  Unique         2.66, 2.83 A)
 &rst
  ixpk= 1800, nxpk= 20, iat= 169, 173, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HN           31 THR  HB          4.50    (#   1802:20  Unique         2.47, 2.66 A)
 &rst
  ixpk= 1802, nxpk= 20, iat= 440, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ASP  HN           31 THR  HB          4.50    (#   1803:20  Unique         3.52, 4.12 A)
 &rst
  ixpk= 1803, nxpk= 20, iat= 398, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:1804    31 THR  HB          7.00    (#   1804:20  Single Ambig)
 &rst
  ixpk= 1804, nxpk= 20, iat=  -1, 444, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=  71,  79, 341, 349,
 &end
#
#    0 AMB  20-3:1805    40 VAL  HA          4.50    (#   1805:20  Single Ambig)
 &rst
  ixpk= 1805, nxpk= 20, iat=  -1, 577, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1129, 575,
 &end
#
#   55 GLY  HN           54 VAL  HA          3.50    (#   1806:20  Unique         2.17, 2.23 A)
 &rst
  ixpk= 1806, nxpk= 20, iat= 810, 796, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 VAL  HN           54 VAL  HA          4.50    (#   1807:20  Unique         2.80, 2.84 A)
 &rst
  ixpk= 1807, nxpk= 20, iat= 794, 796, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ASP  HN           54 VAL  HA          7.00    (#   1808:20  Unique         3.24, 3.35 A)
 &rst
  ixpk= 1808, nxpk= 20, iat= 817, 796, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    5 PHE  HD            9 SER  HB+         3.50    (#   1809:20  Unique         2.28, 4.64 A)
 &rst
  ixpk= 1809, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=  71,  79,
 igr2= 125, 126,
 &end
#
#   15 VAL  HN           53 SER  HB+         7.00    (#   1811:20  Unique         6.09, 7.31 A)
 &rst
  ixpk= 1811, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 787, 788,
 &end
#
#   54 VAL  HN           53 SER  HB+         4.50    (#   1813:20  Unique         2.88, 3.81 A)
 &rst
  ixpk= 1813, nxpk= 20, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 787, 788,
 &end
#
#   53 SER  HN           53 SER  HB+         4.50    (#   1814:20  Unique         2.34, 3.09 A)
 &rst
  ixpk= 1814, nxpk= 20, iat= 783,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 787, 788,
 &end
#
#    9 SER  HN            9 SER  HB-         4.50    (#   1815:20  Unique         2.41, 3.15 A)
 &rst
  ixpk= 1815, nxpk= 20, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 125, 126,
 &end
#
#    5 PHE  HD            9 SER  HB-         4.50    (#   1816:20  Unique         2.28, 4.64 A)
 &rst
  ixpk= 1816, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  71,  79,
 igr2= 125, 126,
 &end
#
#   54 VAL  HN           53 SER  HB-         4.50    (#   1817:20  Unique         2.88, 3.81 A)
 &rst
  ixpk= 1817, nxpk= 20, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 787, 788,
 &end
#
#   53 SER  HN           53 SER  HB-         4.50    (#   1818:20  Unique         2.34, 3.09 A)
 &rst
  ixpk= 1818, nxpk= 20, iat= 783,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 787, 788,
 &end
#
#    0 AMB  20-3:1819    51 HIS  HB-         5.50    (#   1819:20  Single Ambig)
 &rst
  ixpk= 1819, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 764, 747,
 igr2= 751, 752,
 &end
#
#    9 SER  HN            7 VAL  HA          4.50    (#   1820:20  Unique         3.19, 3.38 A)
 &rst
  ixpk= 1820, nxpk= 20, iat= 121, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    7 VAL  HN            7 VAL  HA          4.50    (#   1822:20  Unique         2.75, 2.82 A)
 &rst
  ixpk= 1822, nxpk= 20, iat=  98, 100, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 SER  HA           75 SER  HB+         4.50    (#   1823:20  Unique         2.29, 2.66 A)
 &rst
  ixpk= 1823, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1122,1123,
 &end
#
#   75 SER  HA           75 SER  HB-         5.50    (#   1824:20  Unique         2.29, 2.66 A)
 &rst
  ixpk= 1824, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1122,1123,
 &end
#
#   75 SER  HN           75 SER  HB-         5.50    (#   1825:20  Unique         2.42, 3.24 A)
 &rst
  ixpk= 1825, nxpk= 20, iat=1118,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1122,1123,
 &end
#
#   73 SER  HN           73 SER  HB+         4.50    (#   1826:20  Unique         2.38, 3.14 A)
 &rst
  ixpk= 1826, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   74 LEU  HN           73 SER  HB+         4.50    (#   1827:20  Unique         3.03, 3.96 A)
 &rst
  ixpk= 1827, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   64 ALA  HN           73 SER  HB+         4.50    (#   1828:20  Unique         2.92, 4.51 A)
 &rst
  ixpk= 1828, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   73 SER  HA           73 SER  HB+         3.50    (#   1829:20  Unique         2.27, 2.67 A)
 &rst
  ixpk= 1829, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2=1092,1093,
 &end
#
#   64 ALA  HN           73 SER  HB-         4.50    (#   1831:20  Unique         2.92, 4.51 A)
 &rst
  ixpk= 1831, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   73 SER  HA           73 SER  HB-         4.50    (#   1832:20  Unique         2.27, 2.67 A)
 &rst
  ixpk= 1832, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   73 SER  HN           73 SER  HB-         4.50    (#   1833:20  Unique         2.38, 3.14 A)
 &rst
  ixpk= 1833, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1092,1093,
 &end
#
#   36 HIS  HN           36 HIS  HB+         4.50    (#   1834:20  Unique         2.10, 2.75 A)
 &rst
  ixpk= 1834, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#   15 VAL  HN           15 VAL  HA          4.50    (#   1835:20  Unique         2.81, 2.82 A)
 &rst
  ixpk= 1835, nxpk= 20, iat= 212, 214, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   16 THR  HN           15 VAL  HA          3.50    (#   1836:20  Unique         2.14, 2.22 A)
 &rst
  ixpk= 1836, nxpk= 20, iat= 228, 214, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 SER  HN            0 AMB  20-1:1837   4.50    (#   1837:20  Single Ambig)
 &rst
  ixpk= 1837, nxpk= 20, iat= 549,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 553, 554, 553, 554,
 &end
#
#   41 THR  HN            0 AMB  20-1:1838   7.00    (#   1838:20  Single Ambig)
 &rst
  ixpk= 1838, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 553, 554, 553, 554,
 &end
#
#   32 GLN  HN           31 THR  HA          3.50    (#   1840:20  Unique         2.15, 2.26 A)
 &rst
  ixpk= 1840, nxpk= 20, iat= 454, 442, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HN           31 THR  HA          4.50    (#   1841:20  Unique         2.89, 2.94 A)
 &rst
  ixpk= 1841, nxpk= 20, iat= 440, 442, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   91 ARG  HN           90 PRO  HA          4.50    (#   1842:20  Unique         2.16, 2.53 A)
 &rst
  ixpk= 1842, nxpk= 20, iat=1368,1364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   84 GLU  HN           83 PRO  HA          4.50    (#   1843:20  Unique         2.15, 2.79 A)
 &rst
  ixpk= 1843, nxpk= 20, iat=1247,1243, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 LEU  HN           62 VAL  HA          4.50    (#   1844:20  Unique         2.14, 2.17 A)
 &rst
  ixpk= 1844, nxpk= 20, iat= 931, 917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HA           62 VAL  HA          4.50    (#   1845:20  Unique         2.24, 2.58 A)
 &rst
  ixpk= 1845, nxpk= 20, iat=1101, 917, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  111 LEU  HN          110 THR  HA          4.50    (#   1848:20  Unique         2.14, 2.57 A)
 &rst
  ixpk= 1848, nxpk= 20, iat=1665,1653, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  119 ILE  HN          119 ILE  HA          5.50    (#   1850:20  Unique         2.28, 2.75 A)
 &rst
  ixpk= 1850, nxpk= 20, iat=1813,1815, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 THR  HN           16 THR  HA          4.50    (#   1852:20  Unique         2.91, 2.94 A)
 &rst
  ixpk= 1852, nxpk= 20, iat= 228, 230, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 GLY  HN           16 THR  HA          7.00    (#   1853:20  Unique         3.47, 3.50 A)
 &rst
  ixpk= 1853, nxpk= 20, iat= 242, 230, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   73 SER  HN           65 VAL  HA          7.00    (#   1855:20  Unique         2.90, 3.35 A)
 &rst
  ixpk= 1855, nxpk= 20, iat=1088, 962, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  20-3:1856    65 VAL  HA          2.80    (#   1856:20  Single Ambig)
 &rst
  ixpk= 1856, nxpk= 20, iat=  -1, 962, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 976, 960,
 &end
#
#  118 TRP  HN            0 AMB  20-1:1857   4.50    (#   1857:20  Single Ambig)
 &rst
  ixpk= 1857, nxpk= 20, iat=1789,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1793,1794,1793,1794,
 &end
#
#   73 SER  HN           72 ILE  HA          3.50    (#   1858:20  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1858, nxpk= 20, iat=1088,1071, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 ASP  HN           72 ILE  HA          5.50    (#   1859:20  Unique         2.73, 3.46 A)
 &rst
  ixpk= 1859, nxpk= 20, iat= 976,1071, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   45 VAL  HN           45 VAL  HA          4.50    (#   1860:20  Unique         2.88, 2.94 A)
 &rst
  ixpk= 1860, nxpk= 20, iat= 649, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  118 TRP  HE3           0 AMB  20-1:1862   4.50    (#   1862:20  Single Ambig)
 &rst
  ixpk= 1862, nxpk= 20, iat=1808,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1793,1794,1793,1794,
 &end
#
#  118 TRP  HD1           0 AMB  20-1:1863   4.50    (#   1863:20  Single Ambig)
 &rst
  ixpk= 1863, nxpk= 20, iat=1797,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1793,1794,1793,1794,
 &end
#
#  129 LYS  HN          128 ILE  HA          5.50    (#   1864:20  Unique         2.16, 2.22 A)
 &rst
  ixpk= 1864, nxpk= 20, iat=1985,1968, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   38 SER  HN           38 SER  HA          4.50    (#   1865:20  Unique         2.82, 2.87 A)
 &rst
  ixpk= 1865, nxpk= 20, iat= 549, 551, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  119 ILE  HN          119 ILE  HG1+        7.00    (#   1866:20  Unique         2.26, 3.83 A)
 &rst
  ixpk= 1866, nxpk= 20, iat=1813,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1823,1824,
 &end
#
#   27 LEU  HN           27 LEU  HG          5.50    (#   1870:20  Unique         2.19, 2.64 A)
 &rst
  ixpk= 1870, nxpk= 20, iat= 379, 386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   54 VAL  HN           18 LEU  MDY         4.50    (#   1871:20  Unique         2.00, 4.56 A)
 &rst
  ixpk= 1871, nxpk= 20, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   49 ASN  HN           18 LEU  MDY         7.00    (#   1872:20  Unique         2.76, 5.52 A)
 &rst
  ixpk= 1872, nxpk= 20, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   35 VAL  HN           34 LEU  MDX         4.50    (#   1873:20  Unique         1.95, 3.99 A)
 &rst
  ixpk= 1873, nxpk= 20, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HN           34 LEU  MDX         4.50    (#   1874:20  Unique         4.71, 5.53 A)
 &rst
  ixpk= 1874, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:1875    34 LEU  MDX         4.50    (#   1875:20  Single Ambig)
 &rst
  ixpk= 1875, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 280, 281, 316,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   21 TYR  HD           34 LEU  MDX         4.50    (#   1876:20  Unique         3.47, 8.46 A)
 &rst
  ixpk= 1876, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 303, 312,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   19 GLN  HE2-         34 LEU  MDX         4.50    (#   1877:20  Unique         4.72, 9.95 A)
 &rst
  ixpk= 1877, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 280, 281,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HA           34 LEU  MDX         3.50    (#   1878:20  Unique         2.10, 3.94 A)
 &rst
  ixpk= 1878, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   37 ILE  HN           34 LEU  MDX         4.50    (#   1879:20  Unique         4.88, 6.90 A)
 &rst
  ixpk= 1879, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   32 GLN  HE2+         34 LEU  MDX         4.50    (#   1880:20  Unique         8.30,11.65 A)
 &rst
  ixpk= 1880, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 466, 467,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   24 PHE  HA           34 LEU  MDX         4.50    (#   1881:20  Unique         2.34, 5.55 A)
 &rst
  ixpk= 1881, nxpk= 20, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:1882    74 LEU  MDY         4.50    (#   1882:20  Single Ambig)
 &rst
  ixpk= 1882, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 353, 471, 893,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HN           74 LEU  MDY         7.00    (#   1883:20  Unique         2.93, 4.46 A)
 &rst
  ixpk= 1883, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   34 LEU  HN           74 LEU  MDY         7.00    (#   1884:20  Unique         2.31, 4.45 A)
 &rst
  ixpk= 1884, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HA           74 LEU  MDY         5.50    (#   1885:20  Unique         2.24, 4.01 A)
 &rst
  ixpk= 1885, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  20-3:1886    74 LEU  MDY         4.50    (#   1886:20  Single Ambig)
 &rst
  ixpk= 1886, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 480, 879,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   63 LEU  HN           63 LEU  MDY         4.50    (#   1887:20  Unique         1.95, 3.87 A)
 &rst
  ixpk= 1887, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   23 ALA  HN           34 LEU  MDX         4.50    (#   1888:20  Unique         2.71, 5.94 A)
 &rst
  ixpk= 1888, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   64 ALA  HN           63 LEU  MDY         4.50    (#   1889:20  Unique         2.40, 4.59 A)
 &rst
  ixpk= 1889, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   74 LEU  HA           63 LEU  MDY         4.50    (#   1890:20  Unique         1.99, 4.71 A)
 &rst
  ixpk= 1890, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   75 SER  HA           63 LEU  MDY         4.50    (#   1891:20  Unique         3.41, 5.36 A)
 &rst
  ixpk= 1891, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   53 SER  HN           18 LEU  MDX         7.00    (#   1897:20  Unique         3.58, 5.55 A)
 &rst
  ixpk= 1897, nxpk= 20, iat= 783,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#    0 AMB  20-3:1898    18 LEU  MDX         4.50    (#   1898:20  Single Ambig)
 &rst
  ixpk= 1898, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 249, 794,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   19 GLN  HN           18 LEU  MDX         4.50    (#   1899:20  Unique         1.96, 5.14 A)
 &rst
  ixpk= 1899, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#    0 AMB  20-3:1900    18 LEU  MDX         4.50    (#   1900:20  Single Ambig)
 &rst
  ixpk= 1900, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 764, 242,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   23 ALA  HA           18 LEU  MDX         3.50    (#   1901:20  Unique         2.47, 5.47 A)
 &rst
  ixpk= 1901, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   14 LYS  HA           14 LYS  HG+         4.50    (#   1903:20  Unique         2.27, 2.95 A)
 &rst
  ixpk= 1903, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 197, 198,
 &end
#
#   57 GLU  HA           14 LYS  HG-         4.50    (#   1904:20  Unique         2.00, 3.09 A)
 &rst
  ixpk= 1904, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 197, 198,
 &end
#
#   33 GLY  HN           27 LEU  MDX         4.50    (#   1909:20  Unique         2.67, 5.14 A)
 &rst
  ixpk= 1909, nxpk= 20, iat= 471,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  HN           27 LEU  MDX         4.50    (#   1910:20  Unique         3.02, 4.52 A)
 &rst
  ixpk= 1910, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   14 LYS  HA           14 LYS  HG-         4.50    (#   1913:20  Unique         2.27, 2.95 A)
 &rst
  ixpk= 1913, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 197, 198,
 &end
#
#    0 AMB  20-3:1915    74 LEU  MDX         5.50    (#   1915:20  Single Ambig)
 &rst
  ixpk= 1915, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1=1090, 895, 335,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    5 PHE  HD           27 LEU  MDX         5.50    (#   1916:20  Unique         4.31, 8.34 A)
 &rst
  ixpk= 1916, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  71,  79,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   32 GLN  HA           27 LEU  MDX         5.50    (#   1917:20  Unique         3.64, 5.50 A)
 &rst
  ixpk= 1917, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   11 TYR  HD           27 LEU  MDX         5.50    (#   1918:20  Unique         2.00, 4.80 A)
 &rst
  ixpk= 1918, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 156, 165,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   40 VAL  HN           40 VAL  MGX         3.50    (#   1923:20  Unique         2.26, 3.93 A)
 &rst
  ixpk= 1923, nxpk= 20, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#    0 AMB  20-3:1925    74 LEU  MDX         4.50    (#   1925:20  Single Ambig)
 &rst
  ixpk= 1925, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 353, 471,1118,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HN           74 LEU  MDX         5.50    (#   1926:20  Unique         2.93, 4.46 A)
 &rst
  ixpk= 1926, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  20-3:1927    74 LEU  MDX         4.50    (#   1927:20  Single Ambig)
 &rst
  ixpk= 1927, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 480, 879,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   63 LEU  HN           74 LEU  MDX         4.50    (#   1928:20  Unique         3.39, 6.06 A)
 &rst
  ixpk= 1928, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   74 LEU  HA           74 LEU  MDX         3.50    (#   1929:20  Unique         2.24, 4.01 A)
 &rst
  ixpk= 1929, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2=1108,1109,1110,1112,1113,1114,
 &end
#
#   60 VAL  HN           60 VAL  MGY         4.50    (#   1930:20  Unique         2.07, 3.49 A)
 &rst
  ixpk= 1930, nxpk= 20, iat= 877,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:1931    60 VAL  MGY         2.80    (#   1931:20  Single Ambig)
 &rst
  ixpk= 1931, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 879, 171, 862,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   53 SER  HN           52 LEU  MDX         4.50    (#   1933:20  Unique         2.95, 5.04 A)
 &rst
  ixpk= 1933, nxpk= 20, iat= 783,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   52 LEU  HN           52 LEU  MDX         5.50    (#   1934:20  Unique         3.52, 4.82 A)
 &rst
  ixpk= 1934, nxpk= 20, iat= 764,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#    0 AMB  20-3:1943     7 VAL  MGX         2.80    (#   1943:20  Single Ambig)
 &rst
  ixpk= 1943, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  98, 960,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   16 THR  HN           16 THR  MG2         3.50    (#   1945:20  Unique         1.96, 4.26 A)
 &rst
  ixpk= 1945, nxpk= 20, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 234, 235, 236,
 &end
#
#   17 GLY  HN           16 THR  MG2         4.50    (#   1946:20  Unique         2.12, 4.61 A)
 &rst
  ixpk= 1946, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 234, 235, 236,
 &end
#
#    0 AMB  20-3:1947     0 AMB  20-1:1947   4.50    (#   1947:20  Double Ambig)
 &rst
  ixpk= 1947, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 114, 228,
 igr2= 104, 105, 106, 108, 109, 110, 218, 219, 220, 222,
       223, 224,
 &end
#
#   64 ALA  HN            7 VAL  MGX         4.50    (#   1948:20  Unique         3.08, 5.75 A)
 &rst
  ixpk= 1948, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   15 VAL  HN           15 VAL  MGY         3.50    (#   1949:20  Unique         1.96, 3.69 A)
 &rst
  ixpk= 1949, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1950     0 AMB  20-1:1950   4.50    (#   1950:20  Double Ambig)
 &rst
  ixpk= 1950, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 810, 931,
 igr2= 218, 219, 220, 222, 223, 224, 104, 105, 106, 108,
       109, 110,
 &end
#
#   14 LYS  HA           15 VAL  MGY         7.00    (#   1952:20  Unique         3.62, 5.59 A)
 &rst
  ixpk= 1952, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   56 ASP  HN           15 VAL  MGY         4.50    (#   1953:20  Unique         2.73, 4.52 A)
 &rst
  ixpk= 1953, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1954    15 VAL  MGY         4.50    (#   1954:20  Single Ambig)
 &rst
  ixpk= 1954, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 831, 335,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   27 LEU  HN           16 THR  MG2         7.00    (#   1955:20  Unique         6.17, 8.39 A)
 &rst
  ixpk= 1955, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2= 234, 235, 236,
 &end
#
#   24 PHE  HN           23 ALA  MB          3.50    (#   1956:20  Unique         2.43, 3.49 A)
 &rst
  ixpk= 1956, nxpk= 20, iat= 333,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 327, 328, 329,
 &end
#
#   23 ALA  HA           23 ALA  MB          2.80    (#   1957:20  Unique         2.25, 2.63 A)
 &rst
  ixpk= 1957, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2= 327, 328, 329,
 &end
#
#   17 GLY  HN           54 VAL  MGY         5.50    (#   1958:20  Unique         3.02, 5.01 A)
 &rst
  ixpk= 1958, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   61 LYS  HN           79 THR  MG2         4.50    (#   1965:20  Unique         2.63, 4.32 A)
 &rst
  ixpk= 1965, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1188,1189,1190,
 &end
#
#   79 THR  HN           79 THR  MG2         4.50    (#   1966:20  Unique         1.96, 2.93 A)
 &rst
  ixpk= 1966, nxpk= 20, iat=1182,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1188,1189,1190,
 &end
#
#   60 VAL  HA           79 THR  MG2         2.80    (#   1967:20  Unique         2.16, 3.96 A)
 &rst
  ixpk= 1967, nxpk= 20, iat= 879,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1188,1189,1190,
 &end
#
#   55 GLY  HN           54 VAL  MGY         4.50    (#   1968:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 1968, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:1969    54 VAL  MGY         2.80    (#   1969:20  Single Ambig)
 &rst
  ixpk= 1969, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 794, 249,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   55 GLY  HN           15 VAL  MGX         4.50    (#   1970:20  Unique         2.72, 4.43 A)
 &rst
  ixpk= 1970, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   56 ASP  HN           15 VAL  MGX         4.50    (#   1971:20  Unique         2.73, 4.52 A)
 &rst
  ixpk= 1971, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   17 GLY  HN           15 VAL  MGX         3.50    (#   1972:20  Unique         2.03, 4.49 A)
 &rst
  ixpk= 1972, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1973    58 VAL  MGY         4.50    (#   1973:20  Single Ambig)
 &rst
  ixpk= 1973, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 212, 183,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  HN           58 VAL  MGY         4.50    (#   1974:20  Unique         1.95, 3.70 A)
 &rst
  ixpk= 1974, nxpk= 20, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   59 GLN  HN           58 VAL  MGY         4.50    (#   1975:20  Unique         2.00, 4.20 A)
 &rst
  ixpk= 1975, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   14 LYS  HA           58 VAL  MGY         5.50    (#   1976:20  Unique         2.54, 5.47 A)
 &rst
  ixpk= 1976, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   16 THR  HN           15 VAL  MGX         3.50    (#   1979:20  Unique         2.05, 3.99 A)
 &rst
  ixpk= 1979, nxpk= 20, iat= 228,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   15 VAL  HN           15 VAL  MGX         4.50    (#   1980:20  Unique         1.96, 3.69 A)
 &rst
  ixpk= 1980, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1981    15 VAL  MGX         4.50    (#   1981:20  Single Ambig)
 &rst
  ixpk= 1981, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 333, 844, 794, 249,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  20-3:1982     0 AMB  20-1:1982   4.50    (#   1982:20  Double Ambig)
 &rst
  ixpk= 1982, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 497, 114,
 igr2= 503, 504, 505, 507, 508, 509, 921, 922, 923, 925,
       926, 927,
 &end
#
#   63 LEU  HN           62 VAL  MGX         4.50    (#   1983:20  Unique         2.15, 4.11 A)
 &rst
  ixpk= 1983, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   23 ALA  HN           35 VAL  MGX         5.50    (#   1984:20  Unique         1.94, 4.21 A)
 &rst
  ixpk= 1984, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 503, 504, 505, 507, 508, 509,
 &end
#
#   62 VAL  HN           62 VAL  MGX         7.00    (#   1985:20  Unique         1.94, 3.83 A)
 &rst
  ixpk= 1985, nxpk= 20, iat= 915,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   64 ALA  HN           62 VAL  MGX         4.50    (#   1986:20  Unique         2.02, 4.34 A)
 &rst
  ixpk= 1986, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  20-3:1987     0 AMB  20-1:1987   5.50    (#   1987:20  Double Ambig)
 &rst
  ixpk= 1987, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1=  71,  79, 341, 349,
 igr2= 921, 922, 923, 925, 926, 927, 503, 504, 505, 507,
       508, 509,
 &end
#
#   74 LEU  HA            0 AMB  20-1:1988   5.50    (#   1988:20  Single Ambig)
 &rst
  ixpk= 1988, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr2= 921, 922, 923, 925, 926, 927, 503, 504, 505, 507,
       508, 509,
 &end
#
#    0 AMB  20-3:1989    27 LEU  MDY         4.50    (#   1989:20  Single Ambig)
 &rst
  ixpk= 1989, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 877, 893,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  HN           27 LEU  MDY         4.50    (#   1990:20  Unique         3.02, 4.52 A)
 &rst
  ixpk= 1990, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   11 TYR  HD           27 LEU  MDY         4.50    (#   1991:20  Unique         2.00, 4.80 A)
 &rst
  ixpk= 1991, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 156, 165,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    5 PHE  HD           27 LEU  MDY         5.50    (#   1992:20  Unique         4.31, 8.34 A)
 &rst
  ixpk= 1992, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  71,  79,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:1993    27 LEU  MDY         4.50    (#   1993:20  Single Ambig)
 &rst
  ixpk= 1993, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 171, 862,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   13 GLY  HN           12 THR  MG2         3.50    (#   1994:20  Unique         2.03, 3.65 A)
 &rst
  ixpk= 1994, nxpk= 20, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 175, 176, 177,
 &end
#
#   60 VAL  HN           12 THR  MG2         4.50    (#   1995:20  Unique         4.28, 6.48 A)
 &rst
  ixpk= 1995, nxpk= 20, iat= 877,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:1996    12 THR  MG2         4.50    (#   1996:20  Single Ambig)
 &rst
  ixpk= 1996, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 844, 169,
 igr2= 175, 176, 177,
 &end
#
#   14 LYS  HN           12 THR  MG2         5.50    (#   1997:20  Unique         4.52, 6.82 A)
 &rst
  ixpk= 1997, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:2000    12 THR  MG2         2.80    (#   2000:20  Single Ambig)
 &rst
  ixpk= 2000, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 862, 171,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:2010    31 THR  MG2         4.50    (#   2010:20  Single Ambig)
 &rst
  ixpk= 2010, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 454, 471,
 igr2= 446, 447, 448,
 &end
#
#   28 ASP  HN           31 THR  MG2         4.50    (#   2011:20  Unique         5.33, 6.39 A)
 &rst
  ixpk= 2011, nxpk= 20, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 446, 447, 448,
 &end
#
#   31 THR  HN           31 THR  MG2         4.50    (#   2012:20  Unique         4.40, 4.66 A)
 &rst
  ixpk= 2012, nxpk= 20, iat= 440,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 446, 447, 448,
 &end
#
#    0 AMB  20-3:2013    31 THR  MG2         3.50    (#   2013:20  Single Ambig)
 &rst
  ixpk= 2013, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1=  71,  79, 341, 349,
 igr2= 446, 447, 448,
 &end
#
#   32 GLN  HA           31 THR  MG2         4.50    (#   2015:20  Unique         4.22, 5.18 A)
 &rst
  ixpk= 2015, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 446, 447, 448,
 &end
#
#   62 VAL  HN            0 AMB  20-1:2017   4.50    (#   2017:20  Single Ambig)
 &rst
  ixpk= 2017, nxpk= 20, iat= 915,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   10 VAL  HN            0 AMB  20-1:2018   3.50    (#   2018:20  Single Ambig)
 &rst
  ixpk= 2018, nxpk= 20, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   26 ALA  HN           25 VAL  MGX         4.50    (#   2019:20  Unique         1.94, 3.99 A)
 &rst
  ixpk= 2019, nxpk= 20, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  HN           25 VAL  MGX         4.50    (#   2020:20  Unique         2.58, 4.18 A)
 &rst
  ixpk= 2020, nxpk= 20, iat= 353,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2021    25 VAL  MGX         4.50    (#   2021:20  Single Ambig)
 &rst
  ixpk= 2021, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 335, 831,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   34 LEU  HA           25 VAL  MGX         4.50    (#   2022:20  Unique         3.71, 6.74 A)
 &rst
  ixpk= 2022, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   35 VAL  HN           34 LEU  MDY         4.50    (#   2023:20  Unique         1.95, 3.99 A)
 &rst
  ixpk= 2023, nxpk= 20, iat= 497,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:2024    34 LEU  MDY         4.50    (#   2024:20  Single Ambig)
 &rst
  ixpk= 2024, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 333, 353,1069,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   23 ALA  HN           34 LEU  MDY         4.50    (#   2025:20  Unique         2.71, 5.94 A)
 &rst
  ixpk= 2025, nxpk= 20, iat= 323,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HN           34 LEU  MDY         5.50    (#   2026:20  Unique         4.71, 5.53 A)
 &rst
  ixpk= 2026, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:2027    34 LEU  MDY         4.50    (#   2027:20  Single Ambig)
 &rst
  ixpk= 2027, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 280, 281, 316,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   21 TYR  HD           34 LEU  MDY         4.50    (#   2028:20  Unique         3.47, 8.46 A)
 &rst
  ixpk= 2028, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 303, 312,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   19 GLN  HE2-         34 LEU  MDY         5.50    (#   2029:20  Unique         4.72, 9.95 A)
 &rst
  ixpk= 2029, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 280, 281,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   34 LEU  HA           34 LEU  MDY         2.80    (#   2030:20  Unique         2.10, 3.94 A)
 &rst
  ixpk= 2030, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   32 GLN  HE2+         34 LEU  MDY         4.50    (#   2031:20  Unique         8.30,11.65 A)
 &rst
  ixpk= 2031, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 466, 467,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   24 PHE  HA           34 LEU  MDY         4.50    (#   2032:20  Unique         2.34, 5.55 A)
 &rst
  ixpk= 2032, nxpk= 20, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#   73 SER  HN           64 ALA  MB          4.50    (#   2033:20  Unique         4.37, 5.66 A)
 &rst
  ixpk= 2033, nxpk= 20, iat=1088,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 954, 955, 956,
 &end
#
#   65 VAL  HN           64 ALA  MB          3.50    (#   2034:20  Unique         2.18, 3.60 A)
 &rst
  ixpk= 2034, nxpk= 20, iat= 960,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 954, 955, 956,
 &end
#
#   64 ALA  HN           64 ALA  MB          4.50    (#   2035:20  Unique         2.79, 3.46 A)
 &rst
  ixpk= 2035, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 954, 955, 956,
 &end
#
#   62 VAL  HN           62 VAL  MGY         3.50    (#   2039:20  Unique         1.94, 3.83 A)
 &rst
  ixpk= 2039, nxpk= 20, iat= 915,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    9 SER  HN           62 VAL  MGY         4.50    (#   2040:20  Unique         2.83, 5.89 A)
 &rst
  ixpk= 2040, nxpk= 20, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   11 TYR  HD           62 VAL  MGY         3.50    (#   2041:20  Unique         2.07, 6.99 A)
 &rst
  ixpk= 2041, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 156, 165,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#    5 PHE  HD           62 VAL  MGY         2.80    (#   2042:20  Unique         4.10, 8.48 A)
 &rst
  ixpk= 2042, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  71,  79,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   74 LEU  HA           62 VAL  MGY         4.50    (#   2044:20  Unique         3.29, 5.31 A)
 &rst
  ixpk= 2044, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 921, 922, 923, 925, 926, 927,
 &end
#
#   61 LYS  HA            0 AMB  20-1:2045   2.80    (#   2045:20  Single Ambig)
 &rst
  ixpk= 2045, nxpk= 20, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    8 GLY  HN            7 VAL  MGY         3.50    (#   2046:20  Unique         2.02, 4.39 A)
 &rst
  ixpk= 2046, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#    7 VAL  HN            7 VAL  MGY         3.50    (#   2047:20  Unique         1.94, 3.41 A)
 &rst
  ixpk= 2047, nxpk= 20, iat=  98,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 104, 105, 106, 108, 109, 110,
 &end
#
#   55 GLY  HN           54 VAL  MGX         3.50    (#   2048:20  Unique         1.95, 3.89 A)
 &rst
  ixpk= 2048, nxpk= 20, iat= 810,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   54 VAL  HN           54 VAL  MGX         4.50    (#   2049:20  Unique         1.96, 3.76 A)
 &rst
  ixpk= 2049, nxpk= 20, iat= 794,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   56 ASP  HN           54 VAL  MGX         5.50    (#   2050:20  Unique         4.36, 5.74 A)
 &rst
  ixpk= 2050, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:2051     0 AMB  20-1:2051   4.50    (#   2051:20  Double Ambig)
 &rst
  ixpk= 2051, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 242, 950,
 igr2= 800, 801, 802, 804, 805, 806, 104, 105, 106, 108,
       109, 110,
 &end
#
#   75 SER  HN           63 LEU  MDX         7.00    (#   2053:20  Unique         2.05, 4.62 A)
 &rst
  ixpk= 2053, nxpk= 20, iat=1118,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   74 LEU  HA           63 LEU  MDX         7.00    (#   2054:20  Unique         1.99, 4.71 A)
 &rst
  ixpk= 2054, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   63 LEU  HN           63 LEU  MDX         4.50    (#   2055:20  Unique         1.95, 3.87 A)
 &rst
  ixpk= 2055, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   75 SER  HA           63 LEU  MDX         5.50    (#   2056:20  Unique         3.41, 5.36 A)
 &rst
  ixpk= 2056, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#   41 THR  HN           40 VAL  MGY         4.50    (#   2057:20  Unique         3.80, 4.74 A)
 &rst
  ixpk= 2057, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   21 TYR  HD           40 VAL  MGY         7.00    (#   2058:20  Unique         7.28,11.73 A)
 &rst
  ixpk= 2058, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 303, 312,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   40 VAL  HN           40 VAL  MGY         4.50    (#   2059:20  Unique         2.26, 3.93 A)
 &rst
  ixpk= 2059, nxpk= 20, iat= 575,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   45 VAL  HN           45 VAL  MGY         4.50    (#   2061:20  Unique         1.95, 3.90 A)
 &rst
  ixpk= 2061, nxpk= 20, iat= 649,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   45 VAL  HN           45 VAL  MGX         4.50    (#   2063:20  Unique         1.95, 3.90 A)
 &rst
  ixpk= 2063, nxpk= 20, iat= 649,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   47 ASP  HN           45 VAL  MGY         5.50    (#   2066:20  Unique         1.99, 4.52 A)
 &rst
  ixpk= 2066, nxpk= 20, iat= 687,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:2067    25 VAL  MGY         4.50    (#   2067:20  Single Ambig)
 &rst
  ixpk= 2067, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 183, 212,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2068     0 AMB  20-1:2068   4.50    (#   2068:20  Double Ambig)
 &rst
  ixpk= 2068, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 665, 353,
 igr2= 655, 656, 657, 659, 660, 661, 359, 360, 361, 363,
       364, 365,
 &end
#
#   14 LYS  HA           25 VAL  MGY         4.50    (#   2069:20  Unique         3.32, 5.16 A)
 &rst
  ixpk= 2069, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2070    25 VAL  MGY         4.50    (#   2070:20  Single Ambig)
 &rst
  ixpk= 2070, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 335, 831,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   26 ALA  HN           25 VAL  MGY         4.50    (#   2071:20  Unique         1.94, 3.99 A)
 &rst
  ixpk= 2071, nxpk= 20, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   14 LYS  HN           25 VAL  MGY         3.50    (#   2072:20  Unique         2.09, 4.64 A)
 &rst
  ixpk= 2072, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   75 SER  HA           35 VAL  MGY         7.00    (#   2073:20  Unique         2.37, 5.48 A)
 &rst
  ixpk= 2073, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 503, 504, 505, 507, 508, 509,
 &end
#
#    0 AMB  20-3:2074     0 AMB  20-1:2074   3.50    (#   2074:20  Double Ambig)
 &rst
  ixpk= 2074, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 960, 976,
 igr2= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   61 LYS  HN           78 ALA  MB          4.50    (#   2075:20  Unique         4.33, 6.44 A)
 &rst
  ixpk= 2075, nxpk= 20, iat= 893,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1176,1177,1178,
 &end
#
#   75 SER  HN           78 ALA  MB          4.50    (#   2076:20  Unique         3.98, 5.52 A)
 &rst
  ixpk= 2076, nxpk= 20, iat=1118,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1176,1177,1178,
 &end
#
#   78 ALA  HN           78 ALA  MB          2.80    (#   2077:20  Unique         2.13, 2.91 A)
 &rst
  ixpk= 2077, nxpk= 20, iat=1172,  -1, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr2=1176,1177,1178,
 &end
#
#   79 THR  HN           78 ALA  MB          4.50    (#   2078:20  Unique         2.59, 3.58 A)
 &rst
  ixpk= 2078, nxpk= 20, iat=1182,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1176,1177,1178,
 &end
#
#   61 LYS  HA           78 ALA  MB          4.50    (#   2080:20  Unique         5.61, 7.84 A)
 &rst
  ixpk= 2080, nxpk= 20, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1176,1177,1178,
 &end
#
#    4 LYS  HN            3 ALA  MB          4.50    (#   2084:20  Unique         2.22, 3.75 A)
 &rst
  ixpk= 2084, nxpk= 20, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  35,  36,  37,
 &end
#
#    5 PHE  HN            3 ALA  MB          4.50    (#   2085:20  Unique         2.75, 4.29 A)
 &rst
  ixpk= 2085, nxpk= 20, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=  35,  36,  37,
 &end
#
#    5 PHE  HD            3 ALA  MB          4.50    (#   2086:20  Unique         2.17, 7.16 A)
 &rst
  ixpk= 2086, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  71,  79,
 igr2=  35,  36,  37,
 &end
#
#    0 AMB  20-3:2088    26 ALA  MB          5.50    (#   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= 212, 183,
 igr2= 373, 374, 375,
 &end
#
#    0 AMB  20-3:2089    26 ALA  MB          4.50    (#   2089:20  Single Ambig)
 &rst
  ixpk= 2089, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 353, 454, 471,
 igr2= 373, 374, 375,
 &end
#
#   26 ALA  HN           26 ALA  MB          3.50    (#   2090:20  Unique         2.42, 3.07 A)
 &rst
  ixpk= 2090, nxpk= 20, iat= 369,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 373, 374, 375,
 &end
#
#   27 LEU  HN           26 ALA  MB          4.50    (#   2091:20  Unique         2.84, 3.74 A)
 &rst
  ixpk= 2091, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 373, 374, 375,
 &end
#
#   14 LYS  HN           26 ALA  MB          4.50    (#   2093:20  Unique         3.50, 4.52 A)
 &rst
  ixpk= 2093, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 373, 374, 375,
 &end
#
#   14 LYS  HA           26 ALA  MB          5.50    (#   2094:20  Unique         5.41, 6.73 A)
 &rst
  ixpk= 2094, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 373, 374, 375,
 &end
#
#   32 GLN  HA           26 ALA  MB          4.50    (#   2095:20  Unique         3.99, 4.63 A)
 &rst
  ixpk= 2095, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 373, 374, 375,
 &end
#
#    0 AMB  20-3:2097    96 ALA  MB          4.50    (#   2097:20  Single Ambig)
 &rst
  ixpk= 2097, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1460,1470,
 igr2=1464,1465,1466,
 &end
#
#    0 AMB  20-3:2099    60 VAL  MGX         2.80    (#   2099:20  Single Ambig)
 &rst
  ixpk= 2099, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 877, 148,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   11 TYR  HD           60 VAL  MGX         4.50    (#   2100:20  Unique         1.95, 6.63 A)
 &rst
  ixpk= 2100, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 156, 165,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   13 GLY  HN           60 VAL  MGX         4.50    (#   2102:20  Unique         3.39, 5.91 A)
 &rst
  ixpk= 2102, nxpk= 20, iat= 183,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#   74 LEU  HA           60 VAL  MGX         5.50    (#   2103:20  Unique         4.16, 6.60 A)
 &rst
  ixpk= 2103, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  20-3:2105    58 VAL  MGX         4.50    (#   2105:20  Single Ambig)
 &rst
  ixpk= 2105, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 212, 183,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  HN           58 VAL  MGX         3.50    (#   2106:20  Unique         1.95, 3.70 A)
 &rst
  ixpk= 2106, nxpk= 20, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   14 LYS  HA           58 VAL  MGX         4.50    (#   2107:20  Unique         2.54, 5.47 A)
 &rst
  ixpk= 2107, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   57 GLU  HA           58 VAL  MGX         4.50    (#   2108:20  Unique         3.80, 5.41 A)
 &rst
  ixpk= 2108, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   20 ALA  HN           20 ALA  MB          4.50    (#   2110:20  Unique         2.08, 2.98 A)
 &rst
  ixpk= 2110, nxpk= 20, iat= 285,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 289, 290, 291,
 &end
#
#   21 TYR  HD           20 ALA  MB          4.50    (#   2111:20  Unique         2.56, 5.71 A)
 &rst
  ixpk= 2111, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 303, 312,
 igr2= 289, 290, 291,
 &end
#
#   21 TYR  HN           20 ALA  MB          4.50    (#   2112:20  Unique         2.52, 3.86 A)
 &rst
  ixpk= 2112, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 289, 290, 291,
 &end
#
#   41 THR  HN           41 THR  MG2         4.50    (#   2113:20  Unique         2.18, 3.32 A)
 &rst
  ixpk= 2113, nxpk= 20, iat= 591,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 597, 598, 599,
 &end
#
#   14 LYS  HN           58 VAL  MGX         4.50    (#   2114:20  Unique         4.35, 7.32 A)
 &rst
  ixpk= 2114, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2118    72 ILE  QG2         4.50    (#   2118:20  Single Ambig)
 &rst
  ixpk= 2118, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1099, 976, 960,
 igr2=1075,1076,1077,
 &end
#
#   74 LEU  HA           72 ILE  QG2         4.50    (#   2120:20  Unique         4.41, 5.38 A)
 &rst
  ixpk= 2120, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1075,1076,1077,
 &end
#
#   73 SER  HA           72 ILE  QG2         5.50    (#   2121:20  Unique         3.81, 4.97 A)
 &rst
  ixpk= 2121, nxpk= 20, iat=1090,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1075,1076,1077,
 &end
#
#   63 LEU  HN           72 ILE  QG2         7.00    (#   2125:20  Unique         4.76, 5.92 A)
 &rst
  ixpk= 2125, nxpk= 20, iat= 931,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1075,1076,1077,
 &end
#
#   79 THR  HN           76 ILE  QG2         7.00    (#   2131:20  Unique         3.83, 5.25 A)
 &rst
  ixpk= 2131, nxpk= 20, iat=1182,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1135,1136,1137,
 &end
#
#   77 ARG  HN           76 ILE  QG2         4.50    (#   2132:20  Unique         3.93, 4.68 A)
 &rst
  ixpk= 2132, nxpk= 20, iat=1148,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1135,1136,1137,
 &end
#
#   76 ILE  HN           76 ILE  QG2         4.50    (#   2133:20  Unique         4.38, 4.56 A)
 &rst
  ixpk= 2133, nxpk= 20, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1135,1136,1137,
 &end
#
#   80 GLN  HE2-         76 ILE  QG2         5.50    (#   2134:20  Unique         1.99, 4.07 A)
 &rst
  ixpk= 2134, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1208,1209,
 igr2=1135,1136,1137,
 &end
#
#    0 AMB  20-3:2135    76 ILE  QG2         4.50    (#   2135:20  Single Ambig)
 &rst
  ixpk= 2135, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 879,1120,
 igr2=1135,1136,1137,
 &end
#
#   59 GLN  HN           76 ILE  QG2         7.00    (#   2137:20  Unique         5.71, 7.22 A)
 &rst
  ixpk= 2137, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1135,1136,1137,
 &end
#
#   80 GLN  HE2+         76 ILE  QG2         5.50    (#   2138:20  Unique         1.99, 4.07 A)
 &rst
  ixpk= 2138, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1=1208,1209,
 igr2=1135,1136,1137,
 &end
#
#  119 ILE  HN          119 ILE  QG2         5.50    (#   2140:20  Unique         2.06, 3.86 A)
 &rst
  ixpk= 2140, nxpk= 20, iat=1813,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1819,1820,1821,
 &end
#
#   52 LEU  HN           52 LEU  HB+         7.00    (#   2141:20  Unique         2.27, 3.13 A)
 &rst
  ixpk= 2141, nxpk= 20, iat= 764,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 768, 769,
 &end
#
#   53 SER  HN           52 LEU  HB-         7.00    (#   2142:20  Unique         2.27, 3.31 A)
 &rst
  ixpk= 2142, nxpk= 20, iat= 783,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 768, 769,
 &end
#
#   49 ASN  HD2+         48 ILE  QG2         7.00    (#   2143:20  Unique         2.33, 3.98 A)
 &rst
  ixpk= 2143, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 727, 728,
 igr2= 705, 706, 707,
 &end
#
#   48 ILE  HN           48 ILE  QG2         4.50    (#   2144:20  Unique         1.90, 2.90 A)
 &rst
  ixpk= 2144, nxpk= 20, iat= 699,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 705, 706, 707,
 &end
#
#   19 GLN  HN           48 ILE  QG2         4.50    (#   2145:20  Unique         3.18, 4.71 A)
 &rst
  ixpk= 2145, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 705, 706, 707,
 &end
#
#   74 LEU  HN           74 LEU  HB+         7.00    (#   2147:20  Unique         2.68, 3.26 A)
 &rst
  ixpk= 2147, nxpk= 20, iat=1099,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1103,1104,
 &end
#
#   74 LEU  HA           74 LEU  HB-         7.00    (#   2148:20  Unique         2.29, 2.67 A)
 &rst
  ixpk= 2148, nxpk= 20, iat=1101,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=1103,1104,
 &end
#
#   38 SER  HN           37 ILE  QG2         4.50    (#   2149:20  Unique         1.95, 3.00 A)
 &rst
  ixpk= 2149, nxpk= 20, iat= 549,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:2150    37 ILE  QG2         5.50    (#   2150:20  Single Ambig)
 &rst
  ixpk= 2150, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 649, 591,
 igr2= 536, 537, 538,
 &end
#
#   37 ILE  HN           37 ILE  QG2         3.50    (#   2151:20  Unique         1.95, 2.96 A)
 &rst
  ixpk= 2151, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr2= 536, 537, 538,
 &end
#
#   21 TYR  HD           37 ILE  QG2         5.50    (#   2153:20  Unique         3.06, 6.48 A)
 &rst
  ixpk= 2153, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 303, 312,
 igr2= 536, 537, 538,
 &end
#
#   76 ILE  HN           76 ILE  QD1         5.50    (#   2154:20  Unique         2.16, 3.75 A)
 &rst
  ixpk= 2154, nxpk= 20, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1142,1143,1144,
 &end
#
#   60 VAL  HA           76 ILE  QD1         4.50    (#   2155:20  Unique         2.74, 4.91 A)
 &rst
  ixpk= 2155, nxpk= 20, iat= 879,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2=1142,1143,1144,
 &end
#
#   48 ILE  HN           37 ILE  QD1         4.50    (#   2157:20  Unique         3.21, 5.76 A)
 &rst
  ixpk= 2157, nxpk= 20, iat= 699,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 543, 544, 545,
 &end
#
#   37 ILE  HN           37 ILE  QD1         4.50    (#   2158:20  Unique         4.53, 5.35 A)
 &rst
  ixpk= 2158, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:2159    37 ILE  QD1         5.50    (#   2159:20  Single Ambig)
 &rst
  ixpk= 2159, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 316, 637, 645,
 igr2= 543, 544, 545,
 &end
#
#   23 ALA  HA           48 ILE  QD1         4.50    (#   2161:20  Unique         3.33, 4.74 A)
 &rst
  ixpk= 2161, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 712, 713, 714,
 &end
#
#    0 AMB  20-3:2162    48 ILE  QD1         4.50    (#   2162:20  Single Ambig)
 &rst
  ixpk= 2162, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 268, 323,
 igr2= 712, 713, 714,
 &end
#
#    0 AMB  20-3:2164    72 ILE  QD1         5.50    (#   2164:20  Single Ambig)
 &rst
  ixpk= 2164, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 471, 454,
 igr2=1082,1083,1084,
 &end
#
#    5 PHE  HD           72 ILE  QD1         7.00    (#   2165:20  Unique         4.47,10.58 A)
 &rst
  ixpk= 2165, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=  71,  79,
 igr2=1082,1083,1084,
 &end
#
#   34 LEU  HN           34 LEU  HB+         4.50    (#   2168:20  Unique         2.57, 3.09 A)
 &rst
  ixpk= 2168, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 482, 483,
 &end
#
#   34 LEU  HA           34 LEU  HB+         4.50    (#   2169:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 2169, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 482, 483,
 &end
#
#   34 LEU  HA           34 LEU  HB-         4.50    (#   2170:20  Unique         2.33, 2.67 A)
 &rst
  ixpk= 2170, nxpk= 20, iat= 480,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 482, 483,
 &end
#
#   34 LEU  HN           34 LEU  HB-         4.50    (#   2171:20  Unique         2.57, 3.09 A)
 &rst
  ixpk= 2171, nxpk= 20, iat= 478,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 482, 483,
 &end
#
#    0 AMB  20-3:2173     0 AMB  20-1:2173   4.50    (#   2173:20  Double Ambig)
 &rst
  ixpk= 2173, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 249, 285,
 igr2= 253, 254, 253, 254,
 &end
#
#   12 THR  HN           11 TYR  HB-         4.50    (#   2174:20  Unique         2.12, 3.33 A)
 &rst
  ixpk= 2174, nxpk= 20, iat= 169,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 152, 153,
 &end
#
#   11 TYR  HN           11 TYR  HB-         4.50    (#   2175:20  Unique         2.07, 2.98 A)
 &rst
  ixpk= 2175, nxpk= 20, iat= 148,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 152, 153,
 &end
#
#   11 TYR  HD           11 TYR  HB-         3.50    (#   2176:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 2176, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 156, 165,
 igr2= 152, 153,
 &end
#
#   64 ALA  HN            0 AMB  20-1:2178   5.50    (#   2178:20  Single Ambig)
 &rst
  ixpk= 2178, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 935, 936, 935, 936,
 &end
#
#    5 PHE  HD            0 AMB  20-1:2180   5.50    (#   2180:20  Single Ambig)
 &rst
  ixpk= 2180, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  71,  79,
 igr2=  54,  55,  54,  55,
 &end
#
#   71 LYS  HN           66 ASP  HB+         4.50    (#   2181:20  Unique         1.95, 2.78 A)
 &rst
  ixpk= 2181, nxpk= 20, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#   66 ASP  HN           66 ASP  HB+         4.50    (#   2182:20  Unique         2.14, 2.69 A)
 &rst
  ixpk= 2182, nxpk= 20, iat= 976,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#   61 LYS  HA            0 AMB  20-1:2183   4.50    (#   2183:20  Single Ambig)
 &rst
  ixpk= 2183, nxpk= 20, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 906, 907, 906, 907,
 &end
#
#   66 ASP  HN           66 ASP  HB-         4.50    (#   2184:20  Unique         2.14, 2.69 A)
 &rst
  ixpk= 2184, nxpk= 20, iat= 976,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#   71 LYS  HN           66 ASP  HB-         7.00    (#   2185:20  Unique         1.95, 2.78 A)
 &rst
  ixpk= 2185, nxpk= 20, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 980, 981,
 &end
#
#   56 ASP  HN           56 ASP  HB+         4.50    (#   2186:20  Unique         2.42, 2.89 A)
 &rst
  ixpk= 2186, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 821, 822,
 &end
#
#   56 ASP  HN           56 ASP  HB-         4.50    (#   2188:20  Unique         2.42, 2.89 A)
 &rst
  ixpk= 2188, nxpk= 20, iat= 817,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 821, 822,
 &end
#
#   57 GLU  HN           56 ASP  HB-         4.50    (#   2189:20  Unique         2.81, 3.84 A)
 &rst
  ixpk= 2189, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 821, 822,
 &end
#
#   24 PHE  HN           24 PHE  HB+         4.50    (#   2190:20  Unique         2.14, 2.88 A)
 &rst
  ixpk= 2190, nxpk= 20, iat= 333,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 337, 338,
 &end
#
#   24 PHE  HA           24 PHE  HB+         4.50    (#   2191:20  Unique         2.69, 2.84 A)
 &rst
  ixpk= 2191, nxpk= 20, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 337, 338,
 &end
#
#   24 PHE  HD           24 PHE  HB+         4.50    (#   2192:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 2192, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 341, 349,
 igr2= 337, 338,
 &end
#
#   24 PHE  HD           24 PHE  HB-         4.50    (#   2193:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 2193, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 341, 349,
 igr2= 337, 338,
 &end
#
#   24 PHE  HN           24 PHE  HB-         4.50    (#   2194:20  Unique         2.14, 2.88 A)
 &rst
  ixpk= 2194, nxpk= 20, iat= 333,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 337, 338,
 &end
#
#   17 GLY  HN           24 PHE  HB-         4.50    (#   2195:20  Unique         2.70, 3.64 A)
 &rst
  ixpk= 2195, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 337, 338,
 &end
#
#   24 PHE  HA           24 PHE  HB-         4.50    (#   2196:20  Unique         2.69, 2.84 A)
 &rst
  ixpk= 2196, nxpk= 20, iat= 335,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 337, 338,
 &end
#
#   72 ILE  HN           72 ILE  HB          4.50    (#   2198:20  Unique         2.57, 2.73 A)
 &rst
  ixpk= 2198, nxpk= 20, iat=1069,1073, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 PHE  HN           44 PHE  HB+         7.00    (#   2199:20  Unique         2.32, 3.05 A)
 &rst
  ixpk= 2199, nxpk= 20, iat= 629,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 633, 634,
 &end
#
#   44 PHE  HD           44 PHE  HB+         4.50    (#   2200:20  Unique         2.28, 3.04 A)
 &rst
  ixpk= 2200, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 637, 645,
 igr2= 633, 634,
 &end
#
#    5 PHE  HN            5 PHE  HB-         5.50    (#   2203:20  Unique         2.18, 3.00 A)
 &rst
  ixpk= 2203, nxpk= 20, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  67,  68,
 &end
#
#   77 ARG  HN           76 ILE  HB          7.00    (#   2204:20  Unique         2.51, 2.93 A)
 &rst
  ixpk= 2204, nxpk= 20, iat=1148,1133, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   76 ILE  HN           76 ILE  HB          5.50    (#   2205:20  Unique         2.49, 2.58 A)
 &rst
  ixpk= 2205, nxpk= 20, iat=1129,1133, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   48 ILE  HN           48 ILE  HB          4.50    (#   2206:20  Unique         2.48, 2.72 A)
 &rst
  ixpk= 2206, nxpk= 20, iat= 699, 703, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  HN           37 ILE  HB          4.50    (#   2207:20  Unique         2.44, 2.56 A)
 &rst
  ixpk= 2207, nxpk= 20, iat= 530, 534, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   49 ASN  HD2+         49 ASN  HB+         7.00    (#   2208:20  Unique         2.19, 3.40 A)
 &rst
  ixpk= 2208, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 727, 728,
 igr2= 722, 723,
 &end
#
#  119 ILE  HN          119 ILE  HB          4.50    (#   2209:20  Unique         2.45, 3.10 A)
 &rst
  ixpk= 2209, nxpk= 20, iat=1813,1817, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 GLN  HN           49 ASN  HB+         7.00    (#   2210:20  Unique         5.34, 7.94 A)
 &rst
  ixpk= 2210, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 722, 723,
 &end
#
#   49 ASN  HD2-         49 ASN  HB+         4.50    (#   2211:20  Unique         2.19, 3.40 A)
 &rst
  ixpk= 2211, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 727, 728,
 igr2= 722, 723,
 &end
#
#   49 ASN  HD2-         49 ASN  HB-         4.50    (#   2212:20  Unique         2.19, 3.40 A)
 &rst
  ixpk= 2212, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 727, 728,
 igr2= 722, 723,
 &end
#
#   19 GLN  HN           49 ASN  HB-         7.00    (#   2213:20  Unique         5.34, 7.94 A)
 &rst
  ixpk= 2213, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 722, 723,
 &end
#
#   49 ASN  HD2+         49 ASN  HB-         7.00    (#   2214:20  Unique         2.19, 3.40 A)
 &rst
  ixpk= 2214, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 727, 728,
 igr2= 722, 723,
 &end
#
#  128 ILE  HN          128 ILE  HB          7.00    (#   2215:20  Unique         2.54, 3.20 A)
 &rst
  ixpk= 2215, nxpk= 20, iat=1966,1970, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   21 TYR  HD           21 TYR  HB-         3.50    (#   2216:20  Unique         2.30, 3.05 A)
 &rst
  ixpk= 2216, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 303, 312,
 igr2= 299, 300,
 &end
#
#   57 GLU  HN           57 GLU  HG+         5.50    (#   2217:20  Unique         4.22, 4.46 A)
 &rst
  ixpk= 2217, nxpk= 20, iat= 829,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 836, 837,
 &end
#
#   57 GLU  HA           57 GLU  HG+         4.50    (#   2218:20  Unique         2.25, 2.85 A)
 &rst
  ixpk= 2218, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 836, 837,
 &end
#
#   57 GLU  HA           57 GLU  HG-         4.50    (#   2219:20  Unique         2.25, 2.85 A)
 &rst
  ixpk= 2219, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 836, 837,
 &end
#
#   50 GLU  HN           50 GLU  HG+         4.50    (#   2220:20  Unique         2.07, 2.92 A)
 &rst
  ixpk= 2220, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 739, 740,
 &end
#
#   50 GLU  HN           50 GLU  HG-         4.50    (#   2221:20  Unique         2.07, 2.92 A)
 &rst
  ixpk= 2221, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 739, 740,
 &end
#
#   29 GLU  HN            0 AMB  20-1:2222   4.50    (#   2222:20  Single Ambig)
 &rst
  ixpk= 2222, nxpk= 20, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 417, 418, 417, 418,
 &end
#
#   68 GLU  HN           68 GLU  HG-         4.50    (#   2223:20  Unique         1.98, 3.15 A)
 &rst
  ixpk= 2223, nxpk= 20, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1010,1011,
 &end
#
#   15 VAL  HN            0 AMB  20-1:2229   4.50    (#   2229:20  Single Ambig)
 &rst
  ixpk= 2229, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 194, 195, 194, 195,
 &end
#
#   61 LYS  HA           61 LYS  HB+         4.50    (#   2230:20  Unique         2.32, 2.52 A)
 &rst
  ixpk= 2230, nxpk= 20, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 897, 898,
 &end
#
#   61 LYS  HA           61 LYS  HB-         4.50    (#   2231:20  Unique         2.32, 2.52 A)
 &rst
  ixpk= 2231, nxpk= 20, iat= 895,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 897, 898,
 &end
#
#   61 LYS  HN           60 VAL  HB          4.50    (#   2232:20  Unique         1.99, 2.59 A)
 &rst
  ixpk= 2232, nxpk= 20, iat= 893, 881, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 LYS  HN            0 AMB  20-1:2233   4.50    (#   2233:20  Single Ambig)
 &rst
  ixpk= 2233, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 194, 195, 194, 195,
 &end
#
#   14 LYS  HA            0 AMB  20-1:2234   2.80    (#   2234:20  Single Ambig)
 &rst
  ixpk= 2234, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 194, 195, 194, 195,
 &end
#
#   15 VAL  HN            0 AMB  20-1:2235   4.50    (#   2235:20  Single Ambig)
 &rst
  ixpk= 2235, nxpk= 20, iat= 212,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 194, 195, 194, 195,
 &end
#
#   59 GLN  HN           58 VAL  HB          4.50    (#   2236:20  Unique         2.09, 3.40 A)
 &rst
  ixpk= 2236, nxpk= 20, iat= 860, 848, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   60 VAL  HA           60 VAL  HB          4.50    (#   2237:20  Unique         2.39, 2.43 A)
 &rst
  ixpk= 2237, nxpk= 20, iat= 879, 881, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2238    25 VAL  HB          4.50    (#   2238:20  Single Ambig)
 &rst
  ixpk= 2238, nxpk= 20, iat=  -1, 357, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353, 471,
 &end
#
#    0 AMB  20-3:2239    65 VAL  HB          4.50    (#   2239:20  Single Ambig)
 &rst
  ixpk= 2239, nxpk= 20, iat=  -1, 964, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 960,  98,
 &end
#
#   71 LYS  HN           71 LYS  HB+         4.50    (#   2240:20  Unique         2.28, 2.89 A)
 &rst
  ixpk= 2240, nxpk= 20, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1051,1052,
 &end
#
#   71 LYS  HN           71 LYS  HB-         4.50    (#   2241:20  Unique         2.28, 2.89 A)
 &rst
  ixpk= 2241, nxpk= 20, iat=1047,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1051,1052,
 &end
#
#   59 GLN  HN           59 GLN  HG+         5.50    (#   2242:20  Unique         1.94, 3.03 A)
 &rst
  ixpk= 2242, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 867, 868,
 &end
#
#    0 AMB  20-3:2243     0 AMB  20-1:2243   4.50    (#   2243:20  Double Ambig)
 &rst
  ixpk= 2243, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 171, 862,
 igr2= 867, 868, 867, 868,
 &end
#
#   59 GLN  HN           59 GLN  HG-         5.50    (#   2244:20  Unique         1.94, 3.03 A)
 &rst
  ixpk= 2244, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 867, 868,
 &end
#
#    0 AMB  20-3:2245    59 GLN  HG-         4.50    (#   2245:20  Single Ambig)
 &rst
  ixpk= 2245, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 171, 862,
 igr2= 867, 868,
 &end
#
#   32 GLN  HN            0 AMB  20-1:2246   4.50    (#   2246:20  Single Ambig)
 &rst
  ixpk= 2246, nxpk= 20, iat= 454,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 461, 462, 461, 462,
 &end
#
#    0 AMB  20-3:2247     0 AMB  20-1:2247   4.50    (#   2247:20  Double Ambig)
 &rst
  ixpk= 2247, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 466, 467, 466, 467,
 igr2= 461, 462, 461, 462,
 &end
#
#   32 GLN  HA            0 AMB  20-1:2248   4.50    (#   2248:20  Single Ambig)
 &rst
  ixpk= 2248, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 461, 462, 461, 462,
 &end
#
#   80 GLN  HN            0 AMB  20-1:2249   5.50    (#   2249:20  Single Ambig)
 &rst
  ixpk= 2249, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2=1203,1204,1203,1204,
 &end
#
#    0 AMB  20-3:2250     0 AMB  20-1:2250   4.50    (#   2250:20  Double Ambig)
 &rst
  ixpk= 2250, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1208,1209,1208,1209,
 igr2=1203,1204,1203,1204,
 &end
#
#   80 GLN  HN            0 AMB  20-1:2251   7.00    (#   2251:20  Single Ambig)
 &rst
  ixpk= 2251, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2=1203,1204,1203,1204,
 &end
#
#   69 LYS  HN           69 LYS  HB+         4.50    (#   2252:20  Unique         2.18, 2.72 A)
 &rst
  ixpk= 2252, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1022,1023,
 &end
#
#   10 VAL  HA           10 VAL  HB          4.50    (#   2254:20  Unique         2.36, 2.93 A)
 &rst
  ixpk= 2254, nxpk= 20, iat= 134, 136, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 VAL  HN           10 VAL  HB          3.50    (#   2255:20  Unique         2.55, 2.77 A)
 &rst
  ixpk= 2255, nxpk= 20, iat= 132, 136, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   69 LYS  HN           69 LYS  HB-         4.50    (#   2256:20  Unique         2.18, 2.72 A)
 &rst
  ixpk= 2256, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1022,1023,
 &end
#
#    4 LYS  HN            4 LYS  HB+         4.50    (#   2257:20  Unique         2.25, 3.06 A)
 &rst
  ixpk= 2257, nxpk= 20, iat=  41,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  45,  46,
 &end
#
#   52 LEU  HN           51 HIS  HB+         5.50    (#   2259:20  Unique         2.14, 2.95 A)
 &rst
  ixpk= 2259, nxpk= 20, iat= 764,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 751, 752,
 &end
#
#   45 VAL  HN           45 VAL  HB          4.50    (#   2261:20  Unique         2.69, 2.90 A)
 &rst
  ixpk= 2261, nxpk= 20, iat= 649, 653, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 GLN  HE2+         19 GLN  HG-         4.50    (#   2263:20  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2263, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 280, 281,
 igr2= 275, 276,
 &end
#
#   19 GLN  HE2+         19 GLN  HG+         4.50    (#   2264:20  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2264, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 280, 281,
 igr2= 275, 276,
 &end
#
#    0 AMB  20-3:2266     0 AMB  20-1:2266   4.50    (#   2266:20  Double Ambig)
 &rst
  ixpk= 2266, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 323, 268,
 igr2= 501, 275, 276,
 &end
#
#   35 VAL  HN           35 VAL  HB          4.50    (#   2267:20  Unique         2.62, 3.37 A)
 &rst
  ixpk= 2267, nxpk= 20, iat= 497, 501, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2268    32 GLN  HB-         4.50    (#   2268:20  Single Ambig)
 &rst
  ixpk= 2268, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 454, 353, 471,
 igr2= 458, 459,
 &end
#
#   32 GLN  HA           32 GLN  HB-         4.50    (#   2269:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 2269, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 458, 459,
 &end
#
#   40 VAL  HN           40 VAL  HB          3.50    (#   2270:20  Unique         2.51, 2.56 A)
 &rst
  ixpk= 2270, nxpk= 20, iat= 575, 579, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:2271     0 AMB  20-1:2271   4.50    (#   2271:20  Double Ambig)
 &rst
  ixpk= 2271, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 454, 353, 471,
 igr2= 458, 459, 458, 459, 458, 459,
 &end
#
#   32 GLN  HA           32 GLN  HB+         4.50    (#   2272:20  Unique         2.31, 2.69 A)
 &rst
  ixpk= 2272, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 458, 459,
 &end
#
#   30 GLU  HN           30 GLU  HB+         4.50    (#   2273:20  Unique         2.82, 3.55 A)
 &rst
  ixpk= 2273, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 429, 430,
 &end
#
#   30 GLU  HN           30 GLU  HB-         4.50    (#   2274:20  Unique         2.82, 3.55 A)
 &rst
  ixpk= 2274, nxpk= 20, iat= 425,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 429, 430,
 &end
#
#   41 THR  HN           40 VAL  HB          4.50    (#   2275:20  Unique         2.66, 2.97 A)
 &rst
  ixpk= 2275, nxpk= 20, iat= 591, 579, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ASP  HN           15 VAL  HB          4.50    (#   2277:20  Unique         2.25, 2.49 A)
 &rst
  ixpk= 2277, nxpk= 20, iat= 817, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   15 VAL  HN           15 VAL  HB          4.50    (#   2278:20  Unique         2.59, 2.65 A)
 &rst
  ixpk= 2278, nxpk= 20, iat= 212, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    6 GLU  HN            0 AMB  20-1:2280   4.50    (#   2280:20  Single Ambig)
 &rst
  ixpk= 2280, nxpk= 20, iat=  83,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=  87,  88,  87,  88,
 &end
#
#   36 HIS  HN           36 HIS  HB-         4.50    (#   2281:20  Unique         2.10, 2.75 A)
 &rst
  ixpk= 2281, nxpk= 20, iat= 513,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 517, 518,
 &end
#
#   55 GLY  HN           15 VAL  HB          4.50    (#   2282:20  Unique         2.03, 2.34 A)
 &rst
  ixpk= 2282, nxpk= 20, iat= 810, 216, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2283    19 GLN  HB-         4.50    (#   2283:20  Single Ambig)
 &rst
  ixpk= 2283, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 280, 281, 316,
 igr2= 272, 273,
 &end
#
#   19 GLN  HN           19 GLN  HB-         4.50    (#   2284:20  Unique         2.26, 3.17 A)
 &rst
  ixpk= 2284, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 272, 273,
 &end
#
#    0 AMB  20-3:2285     0 AMB  20-1:2285   2.80    (#   2285:20  Double Ambig)
 &rst
  ixpk= 2285, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 829,  98,
 igr2= 833, 834, 102,
 &end
#
#   62 VAL  HN           62 VAL  HB          4.50    (#   2286:20  Unique         2.48, 2.72 A)
 &rst
  ixpk= 2286, nxpk= 20, iat= 915, 919, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HA           57 GLU  HB+         3.50    (#   2287:20  Unique         2.38, 2.76 A)
 &rst
  ixpk= 2287, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 833, 834,
 &end
#
#   58 VAL  HN           57 GLU  HB+         4.50    (#   2288:20  Unique         4.16, 4.38 A)
 &rst
  ixpk= 2288, nxpk= 20, iat= 844,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 833, 834,
 &end
#
#   14 LYS  HA           57 GLU  HB+         7.00    (#   2289:20  Unique         3.78, 4.73 A)
 &rst
  ixpk= 2289, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 833, 834,
 &end
#
#    0 AMB  20-3:2290    54 VAL  HB          3.50    (#   2290:20  Single Ambig)
 &rst
  ixpk= 2290, nxpk= 20, iat=  -1, 798, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 794, 249,
 &end
#
#   80 GLN  HN            0 AMB  20-1:2291   4.50    (#   2291:20  Single Ambig)
 &rst
  ixpk= 2291, nxpk= 20, iat=1196,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1200,1201,1200,1201,
 &end
#
#   59 GLN  HN           59 GLN  HB+         4.50    (#   2295:20  Unique         2.30, 3.22 A)
 &rst
  ixpk= 2295, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 864, 865,
 &end
#
#   68 GLU  HN           67 GLU  HB-         5.50    (#   2296:20  Unique         2.85, 3.46 A)
 &rst
  ixpk= 2296, nxpk= 20, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 992, 993,
 &end
#
#   59 GLN  HN           59 GLN  HB-         7.00    (#   2298:20  Unique         2.30, 3.22 A)
 &rst
  ixpk= 2298, nxpk= 20, iat= 860,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 864, 865,
 &end
#
#    0 AMB  20-3:2299    59 GLN  HB-         3.50    (#   2299:20  Single Ambig)
 &rst
  ixpk= 2299, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 862, 171,
 igr2= 864, 865,
 &end
#
#   60 VAL  HN           59 GLN  HB-         5.50    (#   2300:20  Unique         2.39, 3.66 A)
 &rst
  ixpk= 2300, nxpk= 20, iat= 877,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 864, 865,
 &end
#
#   68 GLU  HN            0 AMB  20-1:2301   3.50    (#   2301:20  Single Ambig)
 &rst
  ixpk= 2301, nxpk= 20, iat=1003,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=1007,1008,1007,1008,
 &end
#
#   67 GLU  HN           67 GLU  HB+         5.50    (#   2302:20  Unique         2.21, 3.00 A)
 &rst
  ixpk= 2302, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 992, 993,
 &end
#
#   67 GLU  HN           67 GLU  HB-         4.50    (#   2305:20  Unique         2.21, 3.00 A)
 &rst
  ixpk= 2305, nxpk= 20, iat= 988,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 992, 993,
 &end
#
#   75 SER  HA            0 AMB  20-1:2309   4.50    (#   2309:20  Single Ambig)
 &rst
  ixpk= 2309, nxpk= 20, iat=1120,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 564, 565, 564, 565,
 &end
#
#   69 LYS  HN            0 AMB  20-1:2310   4.50    (#   2310:20  Single Ambig)
 &rst
  ixpk= 2310, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1007,1008,1007,1008,
 &end
#
#   66 ASP  HN            0 AMB  20-1:2311   5.50    (#   2311:20  Single Ambig)
 &rst
  ixpk= 2311, nxpk= 20, iat= 976,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 992, 993,1007,1008,1007,1008,
 &end
#
#   50 GLU  HN           50 GLU  HB-         4.50    (#   2313:20  Unique         2.13, 3.02 A)
 &rst
  ixpk= 2313, nxpk= 20, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 736, 737,
 &end
#
#   29 GLU  HN           29 GLU  HB+         4.50    (#   2315:20  Unique         2.93, 3.76 A)
 &rst
  ixpk= 2315, nxpk= 20, iat= 410,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 414, 415,
 &end
#
#   77 ARG  HN           77 ARG  HB+         4.50    (#   2318:20  Unique         2.33, 3.04 A)
 &rst
  ixpk= 2318, nxpk= 20, iat=1148,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1152,1153,
 &end
#
#   77 ARG  HN           77 ARG  HB-         5.50    (#   2319:20  Unique         2.33, 3.04 A)
 &rst
  ixpk= 2319, nxpk= 20, iat=1148,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1152,1153,
 &end
#
#    5 PHE  HD            0 AMB  20-1:2322   5.50    (#   2322:20  Single Ambig)
 &rst
  ixpk= 2322, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1=  71,  79,
 igr2=  51,  52,  51,  52,
 &end
#
#   37 ILE  HN            0 AMB  20-1:2327   4.50    (#   2327:20  Single Ambig)
 &rst
  ixpk= 2327, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2= 540, 541, 540, 541,
 &end
#
#   25 VAL  MGX          25 VAL  HA          4.50    (#   2335:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 2335, nxpk= 20, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2337    38 SER  HA          3.50    (#   2337:20  Single Ambig)
 &rst
  ixpk= 2337, nxpk= 20, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 553, 554, 553, 554,
 &end
#
#    0 AMB  20-3:2338    38 SER  HA          4.50    (#   2338:20  Single Ambig)
 &rst
  ixpk= 2338, nxpk= 20, iat=  -1, 551, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 536, 537, 538, 581, 582, 583, 585, 586, 587,
 &end
#
#   72 ILE  QD1          72 ILE  HG1+        3.50    (#   2340:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 2340, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1082,1083,1084,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:2342     0 AMB  20-1:2342   4.50    (#   2342:20  Double Ambig)
 &rst
  ixpk= 2342, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 igr2=1079,1080,1079,1080,
 &end
#
#   72 ILE  HA           72 ILE  HG1+        5.50    (#   2343:20  Unique         2.57, 3.02 A)
 &rst
  ixpk= 2343, nxpk= 20, iat=1071,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:2352     3 ALA  MB          4.50    (#   2352:20  Single Ambig)
 &rst
  ixpk= 2352, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.07, r4= 7.57,
 igr1=1079,1080, 446, 447, 448,
 igr2=  35,  36,  37,
 &end
#
#    4 LYS  HG+           3 ALA  MB          4.50    (#   2353:20  Unique         4.03, 6.68 A)
 &rst
  ixpk= 2353, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=  48,  49,
 igr2=  35,  36,  37,
 &end
#
#    0 AMB  20-3:2356     4 LYS  HG-         4.50    (#   2356:20  Single Ambig)
 &rst
  ixpk= 2356, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1=  51,  52,  51,  52,
 igr2=  48,  49,
 &end
#
#    5 PHE  HN            5 PHE  HB+         7.00    (#   2358:20  Unique         2.18, 3.00 A)
 &rst
  ixpk= 2358, nxpk= 20, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2=  67,  68,
 &end
#
#   10 VAL  HN            9 SER  HA          3.50    (#   2359:20  Unique         2.23, 2.48 A)
 &rst
  ixpk= 2359, nxpk= 20, iat= 132, 123, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:2363     0 AMB  20-1:2363   3.50    (#   2363:20  Double Ambig)
 &rst
  ixpk= 2363, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=2014,2015,2014,2015, 897, 898,
 igr2=2011,2012,2011,2012, 136,
 &end
#
#   11 TYR  HD           11 TYR  HA          4.50    (#   2372:20  Unique         2.22, 3.73 A)
 &rst
  ixpk= 2372, nxpk= 20, iat=  -1, 150, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 156, 165,
 &end
#
#   12 THR  HN           11 TYR  HA          4.50    (#   2373:20  Unique         2.22, 2.37 A)
 &rst
  ixpk= 2373, nxpk= 20, iat= 169, 150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HN           11 TYR  HA          4.50    (#   2374:20  Unique         2.77, 2.90 A)
 &rst
  ixpk= 2374, nxpk= 20, iat= 148, 150, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HA           11 TYR  HB+         3.50    (#   2375:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 2375, nxpk= 20, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 152, 153,
 &end
#
#   11 TYR  HA           11 TYR  HB-         4.50    (#   2376:20  Unique         2.24, 2.66 A)
 &rst
  ixpk= 2376, nxpk= 20, iat= 150,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 152, 153,
 &end
#
#    0 AMB  20-3:2379    12 THR  MG2         3.50    (#   2379:20  Single Ambig)
 &rst
  ixpk= 2379, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 846, 185, 186,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:2384    18 LEU  HA          4.50    (#   2384:20  Single Ambig)
 &rst
  ixpk= 2384, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 &end
#
#   18 LEU  HB-          18 LEU  HA          3.50    (#   2385:20  Unique         2.29, 2.70 A)
 &rst
  ixpk= 2385, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 253, 254,
 &end
#
#   18 LEU  HB+          18 LEU  HA          5.50    (#   2386:20  Unique         2.29, 2.70 A)
 &rst
  ixpk= 2386, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#   19 GLN  HN           18 LEU  HA          4.50    (#   2387:20  Unique         2.14, 2.23 A)
 &rst
  ixpk= 2387, nxpk= 20, iat= 268, 251, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2388    18 LEU  HA          5.50    (#   2388:20  Single Ambig)
 &rst
  ixpk= 2388, nxpk= 20, iat=  -1, 251, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 249, 333,
 &end
#
#    0 AMB  20-3:2389     0 AMB  20-1:2389   4.50    (#   2389:20  Double Ambig)
 &rst
  ixpk= 2389, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.53, r4=10.03,
 igr1= 705, 706, 707, 800, 801, 802, 804, 805, 806, 800,
       801, 802, 804, 805, 806,
 igr2= 253, 254, 253, 254, 253, 254,
 &end
#
#   18 LEU  HA           18 LEU  HB+         4.50    (#   2390:20  Unique         2.29, 2.70 A)
 &rst
  ixpk= 2390, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 253, 254,
 &end
#
#   18 LEU  HA           18 LEU  HB-         4.50    (#   2391:20  Unique         2.29, 2.70 A)
 &rst
  ixpk= 2391, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-3:2392    18 LEU  HB-         3.50    (#   2392:20  Single Ambig)
 &rst
  ixpk= 2392, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 709, 710, 709, 710, 256,
 igr2= 253, 254,
 &end
#
#   18 LEU  HA           19 GLN  HA          4.50    (#   2393:20  Unique         4.39, 4.43 A)
 &rst
  ixpk= 2393, nxpk= 20, iat= 251, 270, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2396    26 ALA  HA          5.50    (#   2396:20  Single Ambig)
 &rst
  ixpk= 2396, nxpk= 20, iat=  -1, 371, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 461, 462, 461, 462,
 &end
#
#   32 GLN  HA           26 ALA  HA          4.50    (#   2397:20  Unique         2.00, 2.25 A)
 &rst
  ixpk= 2397, nxpk= 20, iat= 456, 371, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           26 ALA  HA          4.50    (#   2398:20  Unique         2.14, 2.20 A)
 &rst
  ixpk= 2398, nxpk= 20, iat= 379, 371, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 GLY  HA+          27 LEU  HA          4.50    (#   2399:20  Unique         2.03, 3.21 A)
 &rst
  ixpk= 2399, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 185, 186,
 &end
#
#   26 ALA  HA           32 GLN  HA          3.50    (#   2402:20  Unique         2.00, 2.25 A)
 &rst
  ixpk= 2402, nxpk= 20, iat= 371, 456, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   38 SER  HA            0 AMB  20-1:2409   2.80    (#   2409:20  Single Ambig)
 &rst
  ixpk= 2409, nxpk= 20, iat= 551,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr2= 553, 554, 553, 554,
 &end
#
#   71 LYS  HB+          67 GLU  HB+         7.00    (#   2411:20  Unique         8.72, 9.79 A)
 &rst
  ixpk= 2411, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1051,1052,
 igr2= 992, 993,
 &end
#
#   52 LEU  HA           40 VAL  MGY         4.50    (#   2412:20  Unique         5.33, 7.94 A)
 &rst
  ixpk= 2412, nxpk= 20, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 581, 582, 583, 585, 586, 587,
 &end
#
#   42 HIS  HA           42 HIS  HB-         4.50    (#   2419:20  Unique         2.37, 2.62 A)
 &rst
  ixpk= 2419, nxpk= 20, iat= 607,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 609, 610,
 &end
#
#   42 HIS  HB-          42 HIS  HA          2.80    (#   2424:20  Unique         2.37, 2.62 A)
 &rst
  ixpk= 2424, nxpk= 20, iat=  -1, 607, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 609, 610,
 &end
#
#    0 AMB  20-3:2428     0 AMB  20-1:2428   2.80    (#   2428:20  Double Ambig)
 &rst
  ixpk= 2428, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 672, 673, 672, 673, 672, 673,
 igr2= 669, 670, 669, 670, 669, 670,
 &end
#
#   18 LEU  MDY          49 ASN  HA          4.50    (#   2436:20  Unique         2.00, 3.64 A)
 &rst
  ixpk= 2436, nxpk= 20, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 258, 259, 260, 262, 263, 264,
 &end
#
#   52 LEU  HB-          49 ASN  HA          5.50    (#   2437:20  Unique         3.45, 4.69 A)
 &rst
  ixpk= 2437, nxpk= 20, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 768, 769,
 &end
#
#    0 AMB  20-3:2438     0 AMB  20-1:2438   7.00    (#   2438:20  Double Ambig)
 &rst
  ixpk= 2438, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1=1054,1055, 256,
 igr2=1049, 720,
 &end
#
#    0 AMB  20-3:2439     0 AMB  20-1:2439   4.50    (#   2439:20  Double Ambig)
 &rst
  ixpk= 2439, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1057,1058,1057,1058,1051,1052, 253, 254,
 igr2=1049, 720,
 &end
#
#   71 LYS  HB+          71 LYS  HA          4.50    (#   2440:20  Unique         2.41, 2.78 A)
 &rst
  ixpk= 2440, nxpk= 20, iat=  -1,1049, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1051,1052,
 &end
#
#   49 ASN  HB-          49 ASN  HA          4.50    (#   2441:20  Unique         2.30, 2.57 A)
 &rst
  ixpk= 2441, nxpk= 20, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 722, 723,
 &end
#
#   49 ASN  HB+          49 ASN  HA          4.50    (#   2442:20  Unique         2.30, 2.57 A)
 &rst
  ixpk= 2442, nxpk= 20, iat=  -1, 720, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 722, 723,
 &end
#
#    0 AMB  20-3:2444     0 AMB  20-1:2444   5.50    (#   2444:20  Double Ambig)
 &rst
  ixpk= 2444, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1047, 747,
 igr2=1049, 720,
 &end
#
#   49 ASN  HN           49 ASN  HA          5.50    (#   2445:20  Unique         2.79, 2.84 A)
 &rst
  ixpk= 2445, nxpk= 20, iat= 718, 720, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   72 ILE  HN           71 LYS  HA          4.50    (#   2459:20  Unique         2.14, 2.27 A)
 &rst
  ixpk= 2459, nxpk= 20, iat=1069,1049, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  106 GLN  HA          106 GLN  HB+         5.50    (#   2460:20  Unique         2.37, 2.70 A)
 &rst
  ixpk= 2460, nxpk= 20, iat=1595,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1597,1598,
 &end
#
#   50 GLU  HG-          50 GLU  HB-         3.50    (#   2463:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2463, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 739, 740,
 igr2= 736, 737,
 &end
#
#   50 GLU  HG+          50 GLU  HB-         4.50    (#   2464:20  Unique         2.21, 2.66 A)
 &rst
  ixpk= 2464, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 739, 740,
 igr2= 736, 737,
 &end
#
#   50 GLU  HA           50 GLU  HG+         4.50    (#   2465:20  Unique         2.12, 3.31 A)
 &rst
  ixpk= 2465, nxpk= 20, iat= 734,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 739, 740,
 &end
#
#    0 AMB  20-3:2466     0 AMB  20-1:2466   4.50    (#   2466:20  Double Ambig)
 &rst
  ixpk= 2466, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 691, 692, 751, 752,
 igr2= 739, 740, 739, 740,
 &end
#
#    0 AMB  20-3:2474    52 LEU  HA          5.50    (#   2474:20  Single Ambig)
 &rst
  ixpk= 2474, nxpk= 20, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 709, 710, 709, 710,
 &end
#
#    0 AMB  20-3:2475    52 LEU  HA          7.00    (#   2475:20  Single Ambig)
 &rst
  ixpk= 2475, nxpk= 20, iat=  -1, 766, r1= 1.30, r2= 1.80, r3= 9.15, r4= 9.65,
 igr1= 256, 709, 710, 709, 710,
 &end
#
#    0 AMB  20-3:2484    52 LEU  MDX         2.80    (#   2484:20  Single Ambig)
 &rst
  ixpk= 2484, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 850, 851, 852, 854, 855, 856, 258, 259, 260, 262,
       263, 264,
 igr2= 773, 774, 775, 777, 778, 779,
 &end
#
#   53 SER  HN           53 SER  HA          4.50    (#   2487:20  Unique         2.93, 2.94 A)
 &rst
  ixpk= 2487, nxpk= 20, iat= 783, 785, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   54 VAL  HN           53 SER  HA          3.50    (#   2488:20  Unique         2.14, 2.18 A)
 &rst
  ixpk= 2488, nxpk= 20, iat= 794, 785, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   18 LEU  HB+          54 VAL  MGY         4.50    (#   2490:20  Unique         2.22, 5.57 A)
 &rst
  ixpk= 2490, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 253, 254,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   53 SER  HB-          54 VAL  MGY         5.50    (#   2491:20  Unique         4.13, 6.98 A)
 &rst
  ixpk= 2491, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 787, 788,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#   18 LEU  HA           54 VAL  MGY         7.00    (#   2492:20  Unique         3.74, 6.18 A)
 &rst
  ixpk= 2492, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 800, 801, 802, 804, 805, 806,
 &end
#
#    0 AMB  20-3:2495     0 AMB  20-1:2495   4.50    (#   2495:20  Double Ambig)
 &rst
  ixpk= 2495, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.84, r4= 8.34,
 igr1= 218, 219, 220, 222, 223, 224, 386,
 igr2= 833, 834, 833, 834,
 &end
#
#    0 AMB  20-3:2496     0 AMB  20-1:2496   2.80    (#   2496:20  Double Ambig)
 &rst
  ixpk= 2496, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.09, r4= 5.59,
 igr1= 836, 837,1313,1314,1313,1314,
 igr2= 833, 834,1310,1311,1310,1311,
 &end
#
#   58 VAL  HA           58 VAL  HB          4.50    (#   2504:20  Unique         2.42, 2.67 A)
 &rst
  ixpk= 2504, nxpk= 20, iat= 846, 848, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HA           58 VAL  MGY         4.50    (#   2505:20  Unique         3.80, 5.41 A)
 &rst
  ixpk= 2505, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2507    58 VAL  MGY         3.50    (#   2507:20  Single Ambig)
 &rst
  ixpk= 2507, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1=1139,1140,1139,1140,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2508    58 VAL  MGY         3.50    (#   2508:20  Single Ambig)
 &rst
  ixpk= 2508, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 218, 219, 220, 222, 223, 224, 773, 774, 775, 777,
       778, 779,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2509    58 VAL  MGY         2.80    (#   2509:20  Single Ambig)
 &rst
  ixpk= 2509, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.71, r4= 6.21,
 igr1= 359, 360, 361, 363, 364, 365, 883, 884, 885, 887,
       888, 889,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2514     0 AMB  20-1:2514   4.50    (#   2514:20  Double Ambig)
 &rst
  ixpk= 2514, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 864, 865, 836, 837,
 igr2= 867, 868, 867, 868,
 &end
#
#   76 ILE  HA           60 VAL  HA          3.50    (#   2515:20  Unique         3.59, 4.29 A)
 &rst
  ixpk= 2515, nxpk= 20, iat=1131, 879, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 VAL  HA           62 VAL  HB          4.50    (#   2518:20  Unique         2.27, 4.03 A)
 &rst
  ixpk= 2518, nxpk= 20, iat= 100, 919, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HB+          12 THR  MG2         4.50    (#   2522:20  Unique         4.18, 6.00 A)
 &rst
  ixpk= 2522, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 833, 834,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:2523     0 AMB  20-1:2523   4.50    (#   2523:20  Double Ambig)
 &rst
  ixpk= 2523, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 499, 952, 962,
 igr2= 503, 504, 505, 507, 508, 509, 921, 922, 923, 925,
       926, 927,
 &end
#
#   63 LEU  MDY           0 AMB  20-1:2524   3.50    (#   2524:20  Single Ambig)
 &rst
  ixpk= 2524, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 940, 941, 942, 944, 945, 946,
 igr2= 935, 936, 935, 936,
 &end
#
#   64 ALA  HN           63 LEU  MDX         7.00    (#   2525:20  Unique         2.40, 4.59 A)
 &rst
  ixpk= 2525, nxpk= 20, iat= 950,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 940, 941, 942, 944, 945, 946,
 &end
#
#    0 AMB  20-3:2527     0 AMB  20-1:2527   2.80    (#   2527:20  Double Ambig)
 &rst
  ixpk= 2527, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.11, r4= 6.61,
 igr1= 258, 259, 260, 262, 263, 264,1075,1076,1077,
 igr2= 800, 801, 802, 804, 805, 806, 966, 967, 968, 970,
       971, 972,
 &end
#
#   66 ASP  HA           66 ASP  HB+         4.50    (#   2528:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 2528, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 980, 981,
 &end
#
#   66 ASP  HA           66 ASP  HB-         3.50    (#   2529:20  Unique         2.58, 2.82 A)
 &rst
  ixpk= 2529, nxpk= 20, iat= 978,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 980, 981,
 &end
#
#   68 GLU  HG+          69 LYS  HB+         5.50    (#   2530:20  Unique         3.72, 6.68 A)
 &rst
  ixpk= 2530, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1010,1011,
 igr2=1022,1023,
 &end
#
#    0 AMB  20-3:2531     0 AMB  20-1:2531   4.50    (#   2531:20  Double Ambig)
 &rst
  ixpk= 2531, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1=1054,1055,1106, 954, 955, 956,
 igr2=1079,1080,1079,1080,1079,1080,
 &end
#
#   72 ILE  QD1          72 ILE  HG1-        3.50    (#   2533:20  Unique         2.20, 2.62 A)
 &rst
  ixpk= 2533, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1082,1083,1084,
 igr2=1079,1080,
 &end
#
#    0 AMB  20-3:2542     0 AMB  20-1:2542   3.50    (#   2542:20  Double Ambig)
 &rst
  ixpk= 2542, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.56, r4= 6.06,
 igr1=1176,1177,1178, 938,
 igr2=1122,1123,1122,1123,
 &end
#
#   75 SER  HN           75 SER  HB+         5.50    (#   2544:20  Unique         2.42, 3.24 A)
 &rst
  ixpk= 2544, nxpk= 20, iat=1118,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=1122,1123,
 &end
#
#   60 VAL  MGY          76 ILE  HA          5.50    (#   2545:20  Unique         2.91, 6.00 A)
 &rst
  ixpk= 2545, nxpk= 20, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#   76 ILE  QD1          76 ILE  HA          4.50    (#   2546:20  Unique         2.03, 3.53 A)
 &rst
  ixpk= 2546, nxpk= 20, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1142,1143,1144,
 &end
#
#   76 ILE  QG2          76 ILE  HA          4.50    (#   2547:20  Unique         2.23, 3.07 A)
 &rst
  ixpk= 2547, nxpk= 20, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1135,1136,1137,
 &end
#
#   79 THR  MG2          76 ILE  HA          4.50    (#   2548:20  Unique         1.99, 2.89 A)
 &rst
  ixpk= 2548, nxpk= 20, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1188,1189,1190,
 &end
#
#    0 AMB  20-3:2549    76 ILE  HA          4.50    (#   2549:20  Single Ambig)
 &rst
  ixpk= 2549, nxpk= 20, iat=  -1,1131, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 879,1120,
 &end
#
#    8 GLY  HN           78 ALA  MB          7.00    (#   2560:20  Unique         6.74, 8.69 A)
 &rst
  ixpk= 2560, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr2=1176,1177,1178,
 &end
#
#   76 ILE  HN           78 ALA  MB          5.50    (#   2562:20  Unique         4.99, 6.17 A)
 &rst
  ixpk= 2562, nxpk= 20, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2=1176,1177,1178,
 &end
#
#   80 GLN  HA            0 AMB  20-1:2563   4.50    (#   2563:20  Single Ambig)
 &rst
  ixpk= 2563, nxpk= 20, iat=1198,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr2=1203,1204,1203,1204,
 &end
#
#  128 ILE  QG2         128 ILE  HG1-        4.50    (#   2582:20  Unique         2.02, 3.35 A)
 &rst
  ixpk= 2582, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1972,1973,1974,
 igr2=1976,1977,
 &end
#
#    4 LYS  HG-           4 LYS  HB+         4.50    (#   2583:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 2583, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  48,  49,
 igr2=  45,  46,
 &end
#
#    5 PHE  HN            4 LYS  HB-         5.50    (#   2585:20  Unique         2.15, 3.60 A)
 &rst
  ixpk= 2585, nxpk= 20, iat=  63,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2=  45,  46,
 &end
#
#    4 LYS  HA            4 LYS  HG-         4.50    (#   2586:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 2586, nxpk= 20, iat=  43,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=  48,  49,
 &end
#
#    4 LYS  HB-           4 LYS  HG-         4.50    (#   2587:20  Unique         2.23, 2.67 A)
 &rst
  ixpk= 2587, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  45,  46,
 igr2=  48,  49,
 &end
#
#    0 AMB  20-3:2588     0 AMB  20-1:2588   2.80    (#   2588:20  Double Ambig)
 &rst
  ixpk= 2588, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 897, 898,1176,1177,1178,
 igr2= 906, 907, 906, 907, 906, 907,
 &end
#
#   62 VAL  HN            0 AMB  20-1:2589   7.00    (#   2589:20  Single Ambig)
 &rst
  ixpk= 2589, nxpk= 20, iat= 915,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr2= 906, 907, 906, 907,
 &end
#
#    8 GLY  HN            0 AMB  20-1:2590   5.50    (#   2590:20  Single Ambig)
 &rst
  ixpk= 2590, nxpk= 20, iat= 114,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 906, 907, 906, 907,
 &end
#
#    0 AMB  20-3:2591     5 PHE  HA          7.00    (#   2591:20  Single Ambig)
 &rst
  ixpk= 2591, nxpk= 20, iat=  -1,  65, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1082,1083,1084,1108,1109,1110,1112,1113,1114,
 &end
#
#   27 LEU  MDX           5 PHE  HB-         7.00    (#   2592:20  Unique         4.78, 7.95 A)
 &rst
  ixpk= 2592, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=  67,  68,
 &end
#
#   27 LEU  MDX           5 PHE  HB+         7.00    (#   2593:20  Unique         4.78, 7.95 A)
 &rst
  ixpk= 2593, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 388, 389, 390, 392, 393, 394,
 igr2=  67,  68,
 &end
#
#    5 PHE  HD            5 PHE  HB-         5.50    (#   2594:20  Unique         2.28, 3.05 A)
 &rst
  ixpk= 2594, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  71,  79,
 igr2=  67,  68,
 &end
#
#    5 PHE  HD            5 PHE  HB+         5.50    (#   2595:20  Unique         2.28, 3.05 A)
 &rst
  ixpk= 2595, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=  71,  79,
 igr2=  67,  68,
 &end
#
#    0 AMB  20-3:2596     0 AMB  20-1:2596   4.50    (#   2596:20  Double Ambig)
 &rst
  ixpk= 2596, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 125, 126, 125, 126,
 igr2=  87,  88,  87,  88,
 &end
#
#    7 VAL  HN            0 AMB  20-1:2597   3.50    (#   2597:20  Single Ambig)
 &rst
  ixpk= 2597, nxpk= 20, iat=  98,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr2=  87,  88,  87,  88,
 &end
#
#    7 VAL  MGY           0 AMB  20-1:2600   3.50    (#   2600:20  Single Ambig)
 &rst
  ixpk= 2600, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 104, 105, 106, 108, 109, 110,
 igr2=  87,  88,  87,  88,
 &end
#
#    7 VAL  MGX           0 AMB  20-1:2601   3.50    (#   2601:20  Single Ambig)
 &rst
  ixpk= 2601, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.94, r4= 6.44,
 igr1= 104, 105, 106, 108, 109, 110,
 igr2=  87,  88,  87,  88,
 &end
#
#    9 SER  HN            8 GLY  HA+         5.50    (#   2602:20  Unique         2.85, 3.24 A)
 &rst
  ixpk= 2602, nxpk= 20, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 116, 117,
 &end
#
#   62 VAL  MGY           9 SER  HB+         5.50    (#   2604:20  Unique         3.11, 7.42 A)
 &rst
  ixpk= 2604, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 921, 922, 923, 925, 926, 927,
 igr2= 125, 126,
 &end
#
#    9 SER  HN            9 SER  HB+         4.50    (#   2605:20  Unique         2.41, 3.15 A)
 &rst
  ixpk= 2605, nxpk= 20, iat= 121,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 125, 126,
 &end
#
#    0 AMB  20-3:2607     0 AMB  20-1:2607   4.50    (#   2607:20  Double Ambig)
 &rst
  ixpk= 2607, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.18, r4= 9.68,
 igr1= 921, 922, 923, 925, 926, 927, 800, 801, 802, 804,
       805, 806, 800, 801, 802, 804, 805, 806,
 igr2= 125, 126, 787, 788,
 &end
#
#   10 VAL  HN            9 SER  HB-         3.50    (#   2608:20  Unique         1.95, 2.90 A)
 &rst
  ixpk= 2608, nxpk= 20, iat= 132,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 125, 126,
 &end
#
#   11 TYR  HD           10 VAL  HA          7.00    (#   2609:20  Unique         3.08, 5.61 A)
 &rst
  ixpk= 2609, nxpk= 20, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 156, 165,
 &end
#
#   61 LYS  HB-          10 VAL  HA          4.50    (#   2610:20  Unique         2.07, 3.48 A)
 &rst
  ixpk= 2610, nxpk= 20, iat=  -1, 134, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#    0 AMB  20-3:2611    10 VAL  HB          5.50    (#   2611:20  Single Ambig)
 &rst
  ixpk= 2611, nxpk= 20, iat=  -1, 136, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 148, 877,
 &end
#
#    5 PHE  HD           11 TYR  HB+         4.50    (#   2613:20  Unique         2.00, 6.01 A)
 &rst
  ixpk= 2613, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=  71,  79,
 igr2= 152, 153,
 &end
#
#    0 AMB  20-3:2614    12 THR  HA          5.50    (#   2614:20  Single Ambig)
 &rst
  ixpk= 2614, nxpk= 20, iat=  -1, 171, r1= 1.30, r2= 1.80, r3= 8.54, r4= 9.04,
 igr1= 850, 851, 852, 854, 855, 856, 383, 384,1108,1109,
      1110,1112,1113,1114,
 &end
#
#   13 GLY  HN           12 THR  HB          4.50    (#   2618:20  Unique         3.32, 4.06 A)
 &rst
  ixpk= 2618, nxpk= 20, iat= 183, 173, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HB+          12 THR  MG2         5.50    (#   2620:20  Unique         6.24, 7.51 A)
 &rst
  ixpk= 2620, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 152, 153,
 igr2= 175, 176, 177,
 &end
#
#   14 LYS  HA           12 THR  MG2         5.50    (#   2621:20  Unique         5.04, 6.80 A)
 &rst
  ixpk= 2621, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 175, 176, 177,
 &end
#
#    0 AMB  20-3:2622     0 AMB  20-1:2622   5.50    (#   2622:20  Double Ambig)
 &rst
  ixpk= 2622, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.58, r4=10.08,
 igr1= 197, 198, 175, 176, 177,1054,1055,
 igr2= 185, 186, 473, 474,
 &end
#
#    0 AMB  20-3:2623    13 GLY  HA-         5.50    (#   2623:20  Single Ambig)
 &rst
  ixpk= 2623, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 197, 198, 175, 176, 177,
 igr2= 185, 186,
 &end
#
#   27 LEU  HA           13 GLY  HA-         4.50    (#   2624:20  Unique         2.03, 3.21 A)
 &rst
  ixpk= 2624, nxpk= 20, iat= 381,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   14 LYS  HN           13 GLY  HA-         4.50    (#   2625:20  Unique         2.14, 2.59 A)
 &rst
  ixpk= 2625, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 185, 186,
 &end
#
#   75 SER  HN           74 LEU  HA          3.50    (#   2626:20  Unique         2.19, 2.29 A)
 &rst
  ixpk= 2626, nxpk= 20, iat=1118,1101, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   76 ILE  HN           61 LYS  HB+         7.00    (#   2628:20  Unique         5.23, 8.28 A)
 &rst
  ixpk= 2628, nxpk= 20, iat=1129,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 897, 898,
 &end
#
#    0 AMB  20-3:2629     0 AMB  20-1:2629   5.50    (#   2629:20  Double Ambig)
 &rst
  ixpk= 2629, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.99, r4=10.49,
 igr1= 203, 204, 203, 204, 203, 204,
 igr2= 194, 195, 194, 195, 194, 195,
 &end
#
#   57 GLU  HA           14 LYS  HG+         5.50    (#   2632:20  Unique         2.00, 3.09 A)
 &rst
  ixpk= 2632, nxpk= 20, iat= 831,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 197, 198,
 &end
#
#    0 AMB  20-3:2633     0 AMB  20-1:2633   5.50    (#   2633:20  Double Ambig)
 &rst
  ixpk= 2633, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 212, 183,
 igr2= 197, 198, 197, 198,
 &end
#
#    0 AMB  20-3:2634    14 LYS  HG-         5.50    (#   2634:20  Single Ambig)
 &rst
  ixpk= 2634, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 212, 183,
 igr2= 197, 198,
 &end
#
#   14 LYS  HA           15 VAL  HB          5.50    (#   2636:20  Unique         4.74, 4.83 A)
 &rst
  ixpk= 2636, nxpk= 20, iat= 192, 216, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   14 LYS  HA           15 VAL  MGX         5.50    (#   2637:20  Unique         3.62, 5.59 A)
 &rst
  ixpk= 2637, nxpk= 20, iat= 192,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 218, 219, 220, 222, 223, 224,
 &end
#
#   19 GLN  HN           18 LEU  HB-         4.50    (#   2639:20  Unique         2.42, 3.65 A)
 &rst
  ixpk= 2639, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 253, 254,
 &end
#
#    0 AMB  20-3:2640    18 LEU  HB-         7.00    (#   2640:20  Single Ambig)
 &rst
  ixpk= 2640, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 249, 285,
 igr2= 253, 254,
 &end
#
#   54 VAL  HB           18 LEU  MDX         5.50    (#   2641:20  Unique         2.09, 5.35 A)
 &rst
  ixpk= 2641, nxpk= 20, iat= 798,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   15 VAL  HB           18 LEU  MDX         5.50    (#   2643:20  Unique         4.10, 6.46 A)
 &rst
  ixpk= 2643, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   49 ASN  HB-          18 LEU  MDX         5.50    (#   2644:20  Unique         2.01, 5.21 A)
 &rst
  ixpk= 2644, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 722, 723,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#   18 LEU  HA           18 LEU  MDX         2.80    (#   2645:20  Unique         2.01, 4.07 A)
 &rst
  ixpk= 2645, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr2= 258, 259, 260, 262, 263, 264,
 &end
#
#    0 AMB  20-3:2646    19 GLN  HA          5.50    (#   2646:20  Single Ambig)
 &rst
  ixpk= 2646, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 &end
#
#    0 AMB  20-3:2647    19 GLN  HA          5.50    (#   2647:20  Single Ambig)
 &rst
  ixpk= 2647, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 253, 254, 703,
 &end
#
#   20 ALA  HA           19 GLN  HA          5.50    (#   2648:20  Unique         4.29, 4.39 A)
 &rst
  ixpk= 2648, nxpk= 20, iat= 287, 270, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   19 GLN  HE2+         19 GLN  HA          5.50    (#   2649:20  Unique         2.78, 4.64 A)
 &rst
  ixpk= 2649, nxpk= 20, iat=  -1, 270, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 280, 281,
 &end
#
#   19 GLN  HG-          19 GLN  HB+         3.50    (#   2650:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 2650, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 275, 276,
 igr2= 272, 273,
 &end
#
#   21 TYR  HN           19 GLN  HB+         4.50    (#   2652:20  Unique         2.14, 2.90 A)
 &rst
  ixpk= 2652, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 272, 273,
 &end
#
#   19 GLN  HE2-         19 GLN  HB+         7.00    (#   2653:20  Unique         1.95, 4.23 A)
 &rst
  ixpk= 2653, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 280, 281,
 igr2= 272, 273,
 &end
#
#   19 GLN  HN           19 GLN  HB+         5.50    (#   2654:20  Unique         2.26, 3.17 A)
 &rst
  ixpk= 2654, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 272, 273,
 &end
#
#   19 GLN  HB+          19 GLN  HG-         4.50    (#   2655:20  Unique         2.21, 2.64 A)
 &rst
  ixpk= 2655, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 272, 273,
 igr2= 275, 276,
 &end
#
#   19 GLN  HN           19 GLN  HG-         7.00    (#   2657:20  Unique         2.56, 4.00 A)
 &rst
  ixpk= 2657, nxpk= 20, iat= 268,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 275, 276,
 &end
#
#   19 GLN  HE2-         19 GLN  HG-         7.00    (#   2658:20  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2658, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 280, 281,
 igr2= 275, 276,
 &end
#
#   19 GLN  HE2-         19 GLN  HG+         7.00    (#   2659:20  Unique         2.12, 3.21 A)
 &rst
  ixpk= 2659, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 280, 281,
 igr2= 275, 276,
 &end
#
#   21 TYR  HN           20 ALA  HA          4.50    (#   2660:20  Unique         3.13, 3.37 A)
 &rst
  ixpk= 2660, nxpk= 20, iat= 295, 287, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 TYR  HB+          20 ALA  MB          5.50    (#   2661:20  Unique         4.09, 6.07 A)
 &rst
  ixpk= 2661, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 299, 300,
 igr2= 289, 290, 291,
 &end
#
#    0 AMB  20-3:2663    20 ALA  MB          5.50    (#   2663:20  Single Ambig)
 &rst
  ixpk= 2663, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 316, 280, 281,
 igr2= 289, 290, 291,
 &end
#
#   22 GLY  HN           21 TYR  HA          5.50    (#   2665:20  Unique         3.01, 3.41 A)
 &rst
  ixpk= 2665, nxpk= 20, iat= 316, 297, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  113 ASP  HN          113 ASP  HA          4.50    (#   2667:20  Unique         2.27, 2.79 A)
 &rst
  ixpk= 2667, nxpk= 20, iat=1706,1708, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   37 ILE  QG2          21 TYR  HB+         5.50    (#   2668:20  Unique         3.84, 5.85 A)
 &rst
  ixpk= 2668, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 536, 537, 538,
 igr2= 299, 300,
 &end
#
#   37 ILE  QG2          21 TYR  HB-         5.50    (#   2669:20  Unique         3.84, 5.85 A)
 &rst
  ixpk= 2669, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 536, 537, 538,
 igr2= 299, 300,
 &end
#
#   21 TYR  HN           21 TYR  HB+         7.00    (#   2670:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 2670, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr2= 299, 300,
 &end
#
#   21 TYR  HN           21 TYR  HB-         4.50    (#   2671:20  Unique         2.23, 3.10 A)
 &rst
  ixpk= 2671, nxpk= 20, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 299, 300,
 &end
#
#   37 ILE  HA           22 GLY  HA+         5.50    (#   2672:20  Unique         2.85, 4.11 A)
 &rst
  ixpk= 2672, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 318, 319,
 &end
#
#   37 ILE  HA           22 GLY  HA-         4.50    (#   2673:20  Unique         2.85, 4.11 A)
 &rst
  ixpk= 2673, nxpk= 20, iat= 532,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   22 GLY  HN           22 GLY  HA+         4.50    (#   2674:20  Unique         2.48, 2.79 A)
 &rst
  ixpk= 2674, nxpk= 20, iat= 316,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   37 ILE  HN           22 GLY  HA+         4.50    (#   2675:20  Unique         2.77, 3.55 A)
 &rst
  ixpk= 2675, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 318, 319,
 &end
#
#   37 ILE  HN           22 GLY  HA-         5.50    (#   2676:20  Unique         2.77, 3.55 A)
 &rst
  ixpk= 2676, nxpk= 20, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 318, 319,
 &end
#
#    0 AMB  20-3:2677     0 AMB  20-1:2677   4.50    (#   2677:20  Double Ambig)
 &rst
  ixpk= 2677, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 485, 327, 328, 329,
 igr2= 318, 319, 318, 319,
 &end
#
#   23 ALA  MB           22 GLY  HA-         4.50    (#   2678:20  Unique         4.10, 5.28 A)
 &rst
  ixpk= 2678, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 327, 328, 329,
 igr2= 318, 319,
 &end
#
#   37 ILE  HB           22 GLY  HA+         5.50    (#   2679:20  Unique         2.89, 3.96 A)
 &rst
  ixpk= 2679, nxpk= 20, iat= 534,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 318, 319,
 &end
#
#   18 LEU  HB-          23 ALA  HA          5.50    (#   2680:20  Unique         3.54, 4.70 A)
 &rst
  ixpk= 2680, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 253, 254,
 &end
#
#   24 PHE  HB-          23 ALA  HA          5.50    (#   2681:20  Unique         4.04, 4.80 A)
 &rst
  ixpk= 2681, nxpk= 20, iat=  -1, 325, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 337, 338,
 &end
#
#   18 LEU  HA           23 ALA  MB          4.50    (#   2683:20  Unique         2.00, 3.44 A)
 &rst
  ixpk= 2683, nxpk= 20, iat= 251,  -1, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr2= 327, 328, 329,
 &end
#
#    0 AMB  20-3:2684    73 SER  HA          4.50    (#   2684:20  Single Ambig)
 &rst
  ixpk= 2684, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 485,1103,1104,
 &end
#
#   74 LEU  HB+          73 SER  HA          4.50    (#   2685:20  Unique         4.73, 5.25 A)
 &rst
  ixpk= 2685, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1103,1104,
 &end
#
#    0 AMB  20-3:2686    73 SER  HA          4.50    (#   2686:20  Single Ambig)
 &rst
  ixpk= 2686, nxpk= 20, iat=  -1,1090, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 482, 483,1051,1052,
 &end
#
#   17 GLY  HN           24 PHE  HB+         5.50    (#   2687:20  Unique         2.70, 3.64 A)
 &rst
  ixpk= 2687, nxpk= 20, iat= 242,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 337, 338,
 &end
#
#   23 ALA  HA           24 PHE  HB+         5.50    (#   2688:20  Unique         4.04, 4.80 A)
 &rst
  ixpk= 2688, nxpk= 20, iat= 325,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 337, 338,
 &end
#
#    0 AMB  20-3:2689    24 PHE  HB-         5.50    (#   2689:20  Single Ambig)
 &rst
  ixpk= 2689, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 325, 480,
 igr2= 337, 338,
 &end
#
#   25 VAL  MGY          25 VAL  HA          4.50    (#   2690:20  Unique         2.28, 3.11 A)
 &rst
  ixpk= 2690, nxpk= 20, iat=  -1, 355, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2691    45 VAL  MGX         4.50    (#   2691:20  Single Ambig)
 &rst
  ixpk= 2691, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 751, 752, 691, 692,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:2692    45 VAL  MGX         5.50    (#   2692:20  Single Ambig)
 &rst
  ixpk= 2692, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.49, r4=10.99,
 igr1= 678, 679, 678, 679, 564, 565, 564, 565,
 igr2= 655, 656, 657, 659, 660, 661,
 &end
#
#   13 GLY  HA+          25 VAL  MGY         3.50    (#   2693:20  Unique         2.03, 5.28 A)
 &rst
  ixpk= 2693, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 185, 186,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   15 VAL  HB           25 VAL  MGX         5.50    (#   2694:20  Unique         4.20, 6.19 A)
 &rst
  ixpk= 2694, nxpk= 20, iat= 216,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   13 GLY  HA-          25 VAL  MGX         5.50    (#   2695:20  Unique         2.03, 5.28 A)
 &rst
  ixpk= 2695, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 185, 186,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#    0 AMB  20-3:2696    25 VAL  MGX         5.50    (#   2696:20  Single Ambig)
 &rst
  ixpk= 2696, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 183, 212,
 igr2= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          27 LEU  HA          4.50    (#   2697:20  Unique         3.99, 6.62 A)
 &rst
  ixpk= 2697, nxpk= 20, iat=  -1, 381, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   31 THR  HB           27 LEU  HB+         5.50    (#   2698:20  Unique         2.58, 4.08 A)
 &rst
  ixpk= 2698, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#   31 THR  HB           27 LEU  HB-         4.50    (#   2699:20  Unique         2.58, 4.08 A)
 &rst
  ixpk= 2699, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   27 LEU  HN           27 LEU  HB+         5.50    (#   2700:20  Unique         2.16, 3.10 A)
 &rst
  ixpk= 2700, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 383, 384,
 &end
#
#   27 LEU  HN           27 LEU  HB-         4.50    (#   2701:20  Unique         2.16, 3.10 A)
 &rst
  ixpk= 2701, nxpk= 20, iat= 379,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 383, 384,
 &end
#
#   25 VAL  MGY          27 LEU  HG          4.50    (#   2702:20  Unique         3.64, 6.34 A)
 &rst
  ixpk= 2702, nxpk= 20, iat=  -1, 386, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   27 LEU  HA           27 LEU  HG          5.50    (#   2703:20  Unique         2.54, 3.08 A)
 &rst
  ixpk= 2703, nxpk= 20, iat= 381, 386, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:2704    27 LEU  MDX         7.00    (#   2704:20  Single Ambig)
 &rst
  ixpk= 2704, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=11.33, r4=11.83,
 igr1= 400, 214, 962,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   13 GLY  HA+          27 LEU  MDX         5.50    (#   2705:20  Unique         2.11, 5.56 A)
 &rst
  ixpk= 2705, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 185, 186,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:2706    27 LEU  MDX         7.00    (#   2706:20  Single Ambig)
 &rst
  ixpk= 2706, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3=10.59, r4=11.09,
 igr1= 192,1101,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   28 ASP  HN           27 LEU  MDX         7.00    (#   2707:20  Unique         3.67, 5.22 A)
 &rst
  ixpk= 2707, nxpk= 20, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   11 TYR  HB-          27 LEU  MDY         4.50    (#   2708:20  Unique         2.04, 4.76 A)
 &rst
  ixpk= 2708, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 152, 153,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   31 THR  HB           27 LEU  MDY         5.50    (#   2709:20  Unique         2.05, 5.02 A)
 &rst
  ixpk= 2709, nxpk= 20, iat= 444,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   13 GLY  HA+          27 LEU  MDY         4.50    (#   2710:20  Unique         2.11, 5.56 A)
 &rst
  ixpk= 2710, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 185, 186,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  20-3:2711    27 LEU  MDY         5.50    (#   2711:20  Single Ambig)
 &rst
  ixpk= 2711, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.34, r4= 9.84,
 igr1=  85,  65, 125, 126,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   32 GLN  HA           27 LEU  MDY         5.50    (#   2712:20  Unique         3.64, 5.50 A)
 &rst
  ixpk= 2712, nxpk= 20, iat= 456,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   14 LYS  HN           27 LEU  MDY         5.50    (#   2713:20  Unique         3.51, 6.87 A)
 &rst
  ixpk= 2713, nxpk= 20, iat= 190,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   28 ASP  HN           27 LEU  MDY         5.50    (#   2714:20  Unique         3.67, 5.22 A)
 &rst
  ixpk= 2714, nxpk= 20, iat= 398,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr2= 388, 389, 390, 392, 393, 394,
 &end
#
#   29 GLU  HB-          28 ASP  HA          4.50    (#   2715:20  Unique         3.96, 4.92 A)
 &rst
  ixpk= 2715, nxpk= 20, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 414, 415,
 &end
#
#    0 AMB  20-3:2716    28 ASP  HA          5.50    (#   2716:20  Single Ambig)
 &rst
  ixpk= 2716, nxpk= 20, iat=  -1, 400, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 417, 418, 417, 418,
 &end
#
#    0 AMB  20-3:2722     0 AMB  20-1:2722   2.80    (#   2722:20  Double Ambig)
 &rst
  ixpk= 2722, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 417, 418, 417, 418, 995, 996,
 igr2= 412, 990,
 &end
#
#   69 LYS  HN           67 GLU  HA          5.50    (#   2723:20  Unique         4.13, 4.72 A)
 &rst
  ixpk= 2723, nxpk= 20, iat=1018, 990, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  20-3:2724     0 AMB  20-1:2724   2.80    (#   2724:20  Double Ambig)
 &rst
  ixpk= 2724, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 417, 418, 417, 418,
 igr2= 414, 415, 414, 415,
 &end
#
#    0 AMB  20-3:2725   106 GLN  HB-         2.80    (#   2725:20  Single Ambig)
 &rst
  ixpk= 2725, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1600,1601,1600,1601,
 igr2=1597,1598,
 &end
#
#   30 GLU  HA            0 AMB  20-1:2726   5.50    (#   2726:20  Single Ambig)
 &rst
  ixpk= 2726, nxpk= 20, iat= 427,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr2= 417, 418, 417, 418,
 &end
#
#   70 GLY  HA-          67 GLU  HG-         5.50    (#   2727:20  Unique         4.86, 6.90 A)
 &rst
  ixpk= 2727, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1042,1043,
 igr2= 995, 996,
 &end
#
#   69 LYS  HN           68 GLU  HG-         4.50    (#   2728:20  Unique         3.01, 4.44 A)
 &rst
  ixpk= 2728, nxpk= 20, iat=1018,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1010,1011,
 &end
#
#   72 ILE  QD1          31 THR  HA          5.50    (#   2730:20  Unique         3.86, 6.21 A)
 &rst
  ixpk= 2730, nxpk= 20, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1082,1083,1084,
 &end
#
#    0 AMB  20-3:2731    31 THR  HA          5.50    (#   2731:20  Single Ambig)
 &rst
  ixpk= 2731, nxpk= 20, iat=  -1, 442, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 461, 462, 461, 462, 432, 433, 432, 433,
 &end
#
#    0 AMB  20-3:2733    31 THR  MG2         5.50    (#   2733:20  Single Ambig)
 &rst
  ixpk= 2733, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 379, 976,
 igr2= 446, 447, 448,
 &end
#
#    0 AMB  20-3:2734    31 THR  MG2         5.50    (#   2734:20  Single Ambig)
 &rst
  ixpk= 2734, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 990, 381,
 igr2= 446, 447, 448,
 &end
#
#   33 GLY  HA-          31 THR  MG2         5.50    (#   2735:20  Unique         3.93, 5.61 A)
 &rst
  ixpk= 2735, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 473, 474,
 igr2= 446, 447, 448,
 &end
#
#    0 AMB  20-3:2736    31 THR  MG2         5.50    (#   2736:20  Single Ambig)
 &rst
  ixpk= 2736, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1=  67,  68, 995, 996,
 igr2= 446, 447, 448,
 &end
#
#    0 AMB  20-3:2737    31 THR  MG2         5.50    (#   2737:20  Single Ambig)
 &rst
  ixpk= 2737, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.90, r4= 9.40,
 igr1= 458, 459, 429, 430, 992, 993,
 igr2= 446, 447, 448,
 &end
#
#   34 LEU  HN           34 LEU  HA          4.50    (#   2740:20  Unique         2.91, 2.92 A)
 &rst
  ixpk= 2740, nxpk= 20, iat= 478, 480, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  20-3:2743    34 LEU  MDY         4.50    (#   2743:20  Single Ambig)
 &rst
  ixpk= 2743, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.18, r4= 8.68,
 igr1= 275, 276, 461, 462, 461, 462,
 igr2= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  20-3:2744    36 HIS  HA          7.00    (#   2744:20  Single Ambig)
 &rst
  ixpk= 2744, nxpk= 20, iat=  -1, 515, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 316, 280, 281,
 &end
#
#    0 AMB  20-3:2747    37 ILE  HA          5.50    (#   2747:20  Single Ambig)
 &rst
  ixpk= 2747, nxpk= 20, iat=  -1, 532, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 560, 323,
 &end
#
#    0 AMB  20-3:2748     0 AMB  20-1:2748   5.50    (#   2748:20  Double Ambig)
 &rst
  ixpk= 2748, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 9.70, r4=10.20,
 igr1= 551, 318, 319, 318, 319,
 igr2= 540, 541, 540, 541, 540, 541,
 &end
#
#   45 VAL  HN           37 ILE  QD1         5.50    (#   2749:20  Unique         3.37, 5.28 A)
 &rst
  ixpk= 2749, nxpk= 20, iat= 649,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:2750    37 ILE  QD1         5.50    (#   2750:20  Single Ambig)
 &rst
  ixpk= 2750, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 318, 319, 551,
 igr2= 543, 544, 545,
 &end
#
#   20 ALA  HA           37 ILE  QD1         5.50    (#   2751:20  Unique         2.62, 4.29 A)
 &rst
  ixpk= 2751, nxpk= 20, iat= 287,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:2753    37 ILE  QD1         5.50    (#   2753:20  Single Ambig)
 &rst
  ixpk= 2753, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.32, r4= 8.82,
 igr1= 633, 634, 299, 300,
 igr2= 543, 544, 545,
 &end
#
#   40 VAL  HB           37 ILE  QD1         5.50    (#   2754:20  Unique         3.55, 6.12 A)
 &rst
  ixpk= 2754, nxpk= 20, iat= 579,  -1, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr2= 543, 544, 545,
 &end
#
#    0 AMB  20-3:2756    37 ILE  QG2         5.50    (#   2756:20  Single Ambig)
 &rst
  ixpk= 2756, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 560, 323,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:2757    37 ILE  QG2         5.50    (#   2757:20  Single Ambig)
 &rst
  ixpk= 2757, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 637, 645, 316,
 igr2= 536, 537, 538,
 &end
#
#   22 GLY  HA-          37 ILE  QG2         5.50    (#   2758:20  Unique         4.42, 5.81 A)
 &rst
  ixpk= 2758, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 318, 319,
 igr2= 536, 537, 538,
 &end
#
#    0 AMB  20-3:2760    40 VAL  HB          4.50    (#   2760:20  Single Ambig)
 &rst
  ixpk= 2760, nxpk= 20, iat=  -1, 579, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 655, 656, 657, 659, 660, 661, 597, 598, 599,
 &end
#
#    0 AMB  20-3:2761   127 LEU  MDX         4.50    (#   2761:20  Single Ambig)
 &rst
  ixpk= 2761, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1947,1966,
 igr2=1956,1957,1958,1960,1961,1962,
 &end
#
#    0 AMB  20-3:2763    41 THR  HA          5.50    (#   2763:20  Single Ambig)
 &rst
  ixpk= 2763, nxpk= 20, iat=  -1, 593, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 609, 610, 564, 565,
 &end
#
#   41 THR  HN           41 THR  HB          4.50    (#   2764:20  Unique         3.17, 3.47 A)
 &rst
  ixpk= 2764, nxpk= 20, iat= 591, 595, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   45 VAL  MGX          41 THR  HB          7.00    (#   2765:20  Unique         2.55, 5.04 A)
 &rst
  ixpk= 2765, nxpk= 20, iat=  -1, 595, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  20-3:2766    41 THR  HB          4.50    (#   2766:20  Single Ambig)
 &rst
  ixpk= 2766, nxpk= 20, iat=  -1, 595, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 581, 582, 583, 585, 586, 587,1152,1153,
 &end
#
#   15 VAL  HA           58 VAL  MGX         4.50    (#   2767:20  Unique         3.53, 6.02 A)
 &rst
  ixpk= 2767, nxpk= 20, iat= 214,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#    0 AMB  20-3:2768    58 VAL  MGX         4.50    (#   2768:20  Single Ambig)
 &rst
  ixpk= 2768, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 355, 785,1131,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   56 ASP  HB+          58 VAL  MGX         4.50    (#   2771:20  Unique         2.67, 5.84 A)
 &rst
  ixpk= 2771, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 821, 822,
 igr2= 850, 851, 852, 854, 855, 856,
 &end
#
#   42 HIS  HB+          42 HIS  HA          3.50    (#   2773:20  Unique         2.37, 2.62 A)
 &rst
  ixpk= 2773, nxpk= 20, iat=  -1, 607, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 609, 610,
 &end
#
#    0 AMB  20-3:2774     0 AMB  20-1:2774   2.80    (#   2774:20  Double Ambig)
 &rst
  ixpk= 2774, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.76, r4= 5.26,
 igr1= 134, 862,
 igr2= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   71 LYS  HB+          71 LYS  HG-         4.50    (#   2777:20  Unique         2.25, 2.69 A)
 &rst
  ixpk= 2777, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1051,1052,
 igr2=1054,1055,
 &end
#
#    0 AMB  20-3:2778    14 LYS  HG-         2.80    (#   2778:20  Single Ambig)
 &rst
  ixpk= 2778, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 194, 195, 194, 195,
 igr2= 197, 198,
 &end
#
#   25 VAL  HA           15 VAL  HA          3.50    (#   2779:20  Unique         2.00, 2.29 A)
 &rst
  ixpk= 2779, nxpk= 20, iat= 355, 214, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  20-3:2782    23 ALA  MB          3.50    (#   2782:20  Single Ambig)
 &rst
  ixpk= 2782, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 318, 319, 214,
 igr2= 327, 328, 329,
 &end
#
#    0 AMB  20-3:2783    23 ALA  MB          5.50    (#   2783:20  Single Ambig)
 &rst
  ixpk= 2783, nxpk= 20, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 513, 212, 699,
 igr2= 327, 328, 329,
 &end
#
#   25 VAL  HA           26 ALA  HN          2.80    (#     14:10  Unique         2.14, 2.21 A)
 &rst
  ixpk= 14, nxpk= 10, iat= 355, 369, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  HA           26 ALA  HN          3.50    (#     15:10  Unique         3.27, 3.69 A)
 &rst
  ixpk= 15, nxpk= 10, iat= 214, 369, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 GLY  HA-          26 ALA  HN          4.50    (#     16:10  Unique         3.87, 4.75 A)
 &rst
  ixpk= 16, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 185, 186,
 &end
#
#    0 AMB  10-2:17      26 ALA  HN          4.50    (#     17:10  Single Ambig)
 &rst
  ixpk= 17, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 194, 195, 194, 195, 200, 201,
 &end
#
#   26 ALA  MB           26 ALA  HN          2.80    (#     18:10  Unique         2.42, 3.07 A)
 &rst
  ixpk= 18, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 373, 374, 375,
 &end
#
#    0 AMB  10-2:19      26 ALA  HN          2.80    (#     19:10  Single Ambig)
 &rst
  ixpk= 19, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 238, 234, 235, 236,
 &end
#
#   25 VAL  MGX          26 ALA  HN          2.80    (#     20:10  Unique         1.94, 3.99 A)
 &rst
  ixpk= 20, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          26 ALA  HN          2.80    (#     21:10  Unique         1.94, 3.99 A)
 &rst
  ixpk= 21, nxpk= 10, iat=  -1, 369, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   63 LEU  HA           63 LEU  HN          3.50    (#     22:10  Unique         2.82, 2.92 A)
 &rst
  ixpk= 22, nxpk= 10, iat= 933, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  HA           63 LEU  HN          2.80    (#     23:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 23, nxpk= 10, iat= 917, 931, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:24      63 LEU  HN          4.50    (#     24:10  Single Ambig)
 &rst
  ixpk= 24, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1092,1093,1122,1123,
 &end
#
#   63 LEU  HG           63 LEU  HN          4.50    (#     25:10  Unique         2.01, 2.59 A)
 &rst
  ixpk= 25, nxpk= 10, iat= 938, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 VAL  MGY          63 LEU  HN          3.50    (#     26:10  Unique         2.15, 4.11 A)
 &rst
  ixpk= 26, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:27      63 LEU  HN          2.80    (#     27:10  Single Ambig)
 &rst
  ixpk= 27, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 940, 941, 942, 944, 945, 946, 921, 922, 923, 925,
       926, 927,
 &end
#
#  129 LYS  HA          130 LYS  HN          4.50    (#     28:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 28, nxpk= 10, iat=1987,2007, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:29      76 ILE  HN          5.50    (#     29:10  Single Ambig)
 &rst
  ixpk= 29, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 562, 499,
 &end
#
#   37 ILE  HA           48 ILE  HN          7.00    (#     30:10  Unique         6.51, 7.71 A)
 &rst
  ixpk= 30, nxpk= 10, iat= 532, 699, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:31      48 ILE  HN          4.50    (#     31:10  Single Ambig)
 &rst
  ixpk= 31, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 540, 541, 540, 541, 534,
 &end
#
#   47 ASP  HA           48 ILE  HN          2.80    (#     32:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 32, nxpk= 10, iat= 689, 699, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   48 ILE  HB           48 ILE  HN          2.80    (#     33:10  Unique         2.48, 2.72 A)
 &rst
  ixpk= 33, nxpk= 10, iat= 703, 699, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   48 ILE  QG2          48 ILE  HN          2.80    (#     34:10  Unique         1.90, 2.90 A)
 &rst
  ixpk= 34, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 705, 706, 707,
 &end
#
#   45 VAL  MGY          48 ILE  HN          4.50    (#     35:10  Unique         3.99, 5.65 A)
 &rst
  ixpk= 35, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  10-2:36      48 ILE  HN          3.50    (#     36:10  Single Ambig)
 &rst
  ixpk= 36, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 691, 692, 691, 692,
 &end
#
#   76 ILE  HA           76 ILE  HN          4.50    (#     37:10  Unique         2.80, 2.89 A)
 &rst
  ixpk= 37, nxpk= 10, iat=1131,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 VAL  HA           76 ILE  HN          4.50    (#     38:10  Unique         2.34, 2.89 A)
 &rst
  ixpk= 38, nxpk= 10, iat= 577,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:39      76 ILE  HN          4.50    (#     39:10  Single Ambig)
 &rst
  ixpk= 39, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 564, 565, 564, 565,
 &end
#
#   76 ILE  HB           76 ILE  HN          3.50    (#     40:10  Unique         2.49, 2.58 A)
 &rst
  ixpk= 40, nxpk= 10, iat=1133,1129, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:41      76 ILE  HN          3.50    (#     41:10  Single Ambig)
 &rst
  ixpk= 41, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1139,1140,1139,1140,
 &end
#
#    0 AMB  10-2:42      76 ILE  HN          5.50    (#     42:10  Single Ambig)
 &rst
  ixpk= 42, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1188,1189,1190, 900, 901,
 &end
#
#   35 VAL  MGX          76 ILE  HN          3.50    (#     44:10  Unique         2.12, 5.14 A)
 &rst
  ixpk= 44, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 503, 504, 505, 507, 508, 509,
 &end
#
#    0 AMB  10-2:45      76 ILE  HN          4.50    (#     45:10  Single Ambig)
 &rst
  ixpk= 45, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 581, 582, 583, 585, 586, 587, 883, 884, 885, 887,
       888, 889,
 &end
#
#    0 AMB  10-2:46      76 ILE  HN          2.80    (#     46:10  Single Ambig)
 &rst
  ixpk= 46, nxpk= 10, iat=  -1,1129, r1= 1.30, r2= 1.80, r3= 4.04, r4= 4.54,
 igr1= 503, 504, 505, 507, 508, 509,1142,1143,1144,
 &end
#
#   35 VAL  HA           35 VAL  HN          3.50    (#     47:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 47, nxpk= 10, iat= 499, 497, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 VAL  HB           35 VAL  HN          3.50    (#     48:10  Unique         2.62, 3.37 A)
 &rst
  ixpk= 48, nxpk= 10, iat= 501, 497, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 LEU  HB+          35 VAL  HN          4.50    (#     49:10  Unique         3.82, 4.05 A)
 &rst
  ixpk= 49, nxpk= 10, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 482, 483,
 &end
#
#   34 LEU  HG           35 VAL  HN          5.50    (#     50:10  Unique         2.66, 3.05 A)
 &rst
  ixpk= 50, nxpk= 10, iat= 485, 497, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:51      35 VAL  HN          2.80    (#     51:10  Single Ambig)
 &rst
  ixpk= 51, nxpk= 10, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 503, 504, 505, 507, 508, 509, 487, 488, 489, 491,
       492, 493,
 &end
#
#   34 LEU  MDY          35 VAL  HN          2.80    (#     52:10  Unique         1.95, 3.99 A)
 &rst
  ixpk= 52, nxpk= 10, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   35 VAL  MGY          35 VAL  HN          3.50    (#     53:10  Unique         1.95, 3.64 A)
 &rst
  ixpk= 53, nxpk= 10, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 503, 504, 505, 507, 508, 509,
 &end
#
#   48 ILE  QD1          48 ILE  HN          4.50    (#     54:10  Unique         4.28, 5.43 A)
 &rst
  ixpk= 54, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 712, 713, 714,
 &end
#
#   44 PHE  HA           45 VAL  HN          2.80    (#     61:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 61, nxpk= 10, iat= 631, 649, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   45 VAL  HA           45 VAL  HN          3.50    (#     62:10  Unique         2.88, 2.94 A)
 &rst
  ixpk= 62, nxpk= 10, iat= 651, 649, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   44 PHE  HB-          45 VAL  HN          4.50    (#     63:10  Unique         3.02, 3.91 A)
 &rst
  ixpk= 63, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 633, 634,
 &end
#
#   45 VAL  HB           45 VAL  HN          4.50    (#     64:10  Unique         2.69, 2.90 A)
 &rst
  ixpk= 64, nxpk= 10, iat= 653, 649, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:65      45 VAL  HN          3.50    (#     65:10  Single Ambig)
 &rst
  ixpk= 65, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 655, 656, 657, 659, 660, 661, 597, 598, 599,
 &end
#
#   44 PHE  HB+          45 VAL  HN          4.50    (#     67:10  Unique         3.02, 3.91 A)
 &rst
  ixpk= 67, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 633, 634,
 &end
#
#    0 AMB  10-2:68      45 VAL  HN          5.50    (#     68:10  Single Ambig)
 &rst
  ixpk= 68, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 540, 541, 540, 541,
 &end
#
#    0 AMB  10-2:69      36 HIS  HN          2.80    (#     69:10  Single Ambig)
 &rst
  ixpk= 69, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 499, 515,
 &end
#
#   36 HIS  HB+          36 HIS  HN          2.80    (#     70:10  Unique         2.10, 2.75 A)
 &rst
  ixpk= 70, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 517, 518,
 &end
#
#   36 HIS  HB-          36 HIS  HN          2.80    (#     71:10  Unique         2.10, 2.75 A)
 &rst
  ixpk= 71, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 517, 518,
 &end
#
#    0 AMB  10-2:73      36 HIS  HN          7.00    (#     73:10  Single Ambig)
 &rst
  ixpk= 73, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1=1133, 275, 276,
 &end
#
#   34 LEU  HG           36 HIS  HN          4.50    (#     74:10  Unique         2.90, 3.55 A)
 &rst
  ixpk= 74, nxpk= 10, iat= 485, 513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 VAL  MGY          36 HIS  HN          2.80    (#     75:10  Unique         2.56, 4.83 A)
 &rst
  ixpk= 75, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 503, 504, 505, 507, 508, 509,
 &end
#
#   35 VAL  MGX          36 HIS  HN          3.50    (#     76:10  Unique         2.56, 4.83 A)
 &rst
  ixpk= 76, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 503, 504, 505, 507, 508, 509,
 &end
#
#   27 LEU  HA           32 GLN  HN          7.00    (#     78:10  Unique         7.09, 7.64 A)
 &rst
  ixpk= 78, nxpk= 10, iat= 381, 454, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   27 LEU  HB+          32 GLN  HN          4.50    (#     80:10  Unique         4.83, 6.67 A)
 &rst
  ixpk= 80, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 383, 384,
 &end
#
#   25 VAL  MGY          32 GLN  HN          7.00    (#     81:10  Unique         7.58, 9.35 A)
 &rst
  ixpk= 81, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   31 THR  HA           32 GLN  HN          3.50    (#     82:10  Unique         2.15, 2.26 A)
 &rst
  ixpk= 82, nxpk= 10, iat= 442, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HB           32 GLN  HN          4.50    (#     83:10  Unique         4.34, 4.46 A)
 &rst
  ixpk= 83, nxpk= 10, iat= 444, 454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:84      32 GLN  HN          4.50    (#     84:10  Single Ambig)
 &rst
  ixpk= 84, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 461, 462, 461, 462,
 &end
#
#    0 AMB  10-2:85      32 GLN  HN          2.80    (#     85:10  Single Ambig)
 &rst
  ixpk= 85, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 458, 459, 458, 459,
 &end
#
#    0 AMB  10-2:86      32 GLN  HN          4.50    (#     86:10  Single Ambig)
 &rst
  ixpk= 86, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 446, 447, 448, 450,
 &end
#
#   27 LEU  MDX          32 GLN  HN          4.50    (#     87:10  Unique         5.08, 7.28 A)
 &rst
  ixpk= 87, nxpk= 10, iat=  -1, 454, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   32 GLN  HB+          27 LEU  HN          5.50    (#     88:10  Unique         3.03, 5.13 A)
 &rst
  ixpk= 88, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 458, 459,
 &end
#
#   26 ALA  HA           27 LEU  HN          2.80    (#     89:10  Unique         2.14, 2.20 A)
 &rst
  ixpk= 89, nxpk= 10, iat= 371, 379, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:90      27 LEU  HN          4.50    (#     90:10  Single Ambig)
 &rst
  ixpk= 90, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 400, 442,
 &end
#
#   27 LEU  HA           27 LEU  HN          3.50    (#     91:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 91, nxpk= 10, iat= 381, 379, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HB           27 LEU  HN          4.50    (#     92:10  Unique         4.32, 4.64 A)
 &rst
  ixpk= 92, nxpk= 10, iat= 444, 379, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:93      27 LEU  HN          4.50    (#     93:10  Single Ambig)
 &rst
  ixpk= 93, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 461, 462, 461, 462,
 &end
#
#   26 ALA  MB           27 LEU  HN          3.50    (#     94:10  Unique         2.84, 3.74 A)
 &rst
  ixpk= 94, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 373, 374, 375,
 &end
#
#   27 LEU  HG           27 LEU  HN          3.50    (#     95:10  Unique         2.19, 2.64 A)
 &rst
  ixpk= 95, nxpk= 10, iat= 386, 379, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HB-          27 LEU  HN          2.80    (#     96:10  Unique         2.16, 3.10 A)
 &rst
  ixpk= 96, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 383, 384,
 &end
#
#   27 LEU  MDY          27 LEU  HN          4.50    (#     97:10  Unique         3.02, 4.52 A)
 &rst
  ixpk= 97, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  MDX          27 LEU  HN          4.50    (#     98:10  Unique         3.02, 4.52 A)
 &rst
  ixpk= 98, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#  128 ILE  HA          129 LYS  HN          4.50    (#     99:10  Unique         2.16, 2.22 A)
 &rst
  ixpk= 99, nxpk= 10, iat=1968,1985, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 LYS  HG-          72 ILE  HN          4.50    (#    102:10  Unique         1.96, 3.41 A)
 &rst
  ixpk= 102, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#    0 AMB  10-2:103     72 ILE  HN          4.50    (#    103:10  Single Ambig)
 &rst
  ixpk= 103, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   71 LYS  HA           72 ILE  HN          2.80    (#    104:10  Unique         2.14, 2.27 A)
 &rst
  ixpk= 104, nxpk= 10, iat=1049,1069, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   33 GLY  HA-          72 ILE  HN          4.50    (#    105:10  Unique         2.74, 4.83 A)
 &rst
  ixpk= 105, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 473, 474,
 &end
#
#   72 ILE  HB           72 ILE  HN          2.80    (#    106:10  Unique         2.57, 2.73 A)
 &rst
  ixpk= 106, nxpk= 10, iat=1073,1069, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   71 LYS  HG+          72 ILE  HN          4.50    (#    107:10  Unique         1.96, 3.41 A)
 &rst
  ixpk= 107, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#   72 ILE  QD1          72 ILE  HN          4.50    (#    108:10  Unique         3.35, 4.74 A)
 &rst
  ixpk= 108, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1082,1083,1084,
 &end
#
#   80 GLN  HA           81 ALA  HN          3.50    (#    113:10  Unique         2.17, 2.49 A)
 &rst
  ixpk= 113, nxpk= 10, iat=1198,1213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   81 ALA  HA           81 ALA  HN          3.50    (#    114:10  Unique         2.28, 2.89 A)
 &rst
  ixpk= 114, nxpk= 10, iat=1215,1213, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:115     81 ALA  HN          4.50    (#    115:10  Single Ambig)
 &rst
  ixpk= 115, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1203,1204,1203,1204,
 &end
#
#    0 AMB  10-2:116     81 ALA  HN          3.50    (#    116:10  Single Ambig)
 &rst
  ixpk= 116, nxpk= 10, iat=  -1,1213, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1200,1201,1200,1201,
 &end
#
#   72 ILE  HA           66 ASP  HN          3.50    (#    121:10  Unique         2.73, 3.46 A)
 &rst
  ixpk= 121, nxpk= 10, iat=1071, 976, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   65 VAL  HA           66 ASP  HN          2.80    (#    122:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 122, nxpk= 10, iat= 962, 976, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   66 ASP  HB+          66 ASP  HN          2.80    (#    123:10  Unique         2.14, 2.69 A)
 &rst
  ixpk= 123, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:124     66 ASP  HN          4.50    (#    124:10  Single Ambig)
 &rst
  ixpk= 124, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 964,1022,1023,
 &end
#
#    0 AMB  10-2:125     66 ASP  HN          3.50    (#    125:10  Single Ambig)
 &rst
  ixpk= 125, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1079,1080,1051,1052,1057,1058,
 &end
#
#   72 ILE  HG1-         66 ASP  HN          4.50    (#    126:10  Unique         3.52, 4.96 A)
 &rst
  ixpk= 126, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1080,
 &end
#
#    0 AMB  10-2:127     66 ASP  HN          5.50    (#    127:10  Single Ambig)
 &rst
  ixpk= 127, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1=1075,1076,1077, 921, 922, 923, 925, 926, 927,
 &end
#
#   66 ASP  HB-          66 ASP  HN          2.80    (#    128:10  Unique         2.14, 2.69 A)
 &rst
  ixpk= 128, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 980, 981,
 &end
#
#   71 LYS  HB+          66 ASP  HN          5.50    (#    129:10  Unique         3.55, 4.69 A)
 &rst
  ixpk= 129, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1051,1052,
 &end
#
#   62 VAL  HA           62 VAL  HN          3.50    (#    130:10  Unique         2.87, 2.92 A)
 &rst
  ixpk= 130, nxpk= 10, iat= 917, 915, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    7 VAL  HA           62 VAL  HN          5.50    (#    131:10  Unique         3.21, 4.35 A)
 &rst
  ixpk= 131, nxpk= 10, iat= 100, 915, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   62 VAL  HB           62 VAL  HN          2.80    (#    132:10  Unique         2.48, 2.72 A)
 &rst
  ixpk= 132, nxpk= 10, iat= 919, 915, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   61 LYS  HB+          62 VAL  HN          4.50    (#    133:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 133, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#   61 LYS  HB-          62 VAL  HN          4.50    (#    134:10  Unique         2.26, 3.41 A)
 &rst
  ixpk= 134, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#   61 LYS  HG+          62 VAL  HN          2.80    (#    135:10  Unique         3.76, 4.78 A)
 &rst
  ixpk= 135, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 900, 901,
 &end
#
#    0 AMB  10-2:136     62 VAL  HN          2.80    (#    136:10  Single Ambig)
 &rst
  ixpk= 136, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 900, 901, 104, 105, 106, 108, 109, 110,
 &end
#
#   62 VAL  MGY          62 VAL  HN          2.80    (#    137:10  Unique         1.94, 3.83 A)
 &rst
  ixpk= 137, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   62 VAL  MGX          62 VAL  HN          2.80    (#    138:10  Unique         1.94, 3.83 A)
 &rst
  ixpk= 138, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   36 HIS  HA           37 ILE  HN          2.80    (#    140:10  Unique         2.17, 2.25 A)
 &rst
  ixpk= 140, nxpk= 10, iat= 515, 530, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   22 GLY  HA+          37 ILE  HN          3.50    (#    141:10  Unique         2.77, 3.55 A)
 &rst
  ixpk= 141, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 318, 319,
 &end
#
#   37 ILE  HA           37 ILE  HN          2.80    (#    142:10  Unique         2.76, 2.79 A)
 &rst
  ixpk= 142, nxpk= 10, iat= 532, 530, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   22 GLY  HA-          37 ILE  HN          3.50    (#    143:10  Unique         2.77, 3.55 A)
 &rst
  ixpk= 143, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 318, 319,
 &end
#
#   36 HIS  HB+          37 ILE  HN          4.50    (#    144:10  Unique         2.64, 3.70 A)
 &rst
  ixpk= 144, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
#   36 HIS  HB-          37 ILE  HN          4.50    (#    145:10  Unique         2.64, 3.70 A)
 &rst
  ixpk= 145, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
#   37 ILE  HB           37 ILE  HN          2.80    (#    146:10  Unique         2.44, 2.56 A)
 &rst
  ixpk= 146, nxpk= 10, iat= 534, 530, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:147     37 ILE  HN          4.50    (#    147:10  Single Ambig)
 &rst
  ixpk= 147, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 543, 544, 545, 487, 488, 489, 491, 492, 493,
 &end
#
#   37 ILE  QG2          37 ILE  HN          2.80    (#    148:10  Unique         1.95, 2.96 A)
 &rst
  ixpk= 148, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 536, 537, 538,
 &end
#
#    0 AMB  10-2:149      0 AMB  10-1:149    2.80    (#    149:10  Double Ambig)
 &rst
  ixpk= 149, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1452,1430,
 igr2=1460,1450,
 &end
#
#   96 ALA  MB           96 ALA  HN          2.80    (#    151:10  Unique         2.09, 3.01 A)
 &rst
  ixpk= 151, nxpk= 10, iat=  -1,1460, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1464,1465,1466,
 &end
#
#   25 VAL  HA           15 VAL  HN          4.50    (#    153:10  Unique         4.24, 4.52 A)
 &rst
  ixpk= 153, nxpk= 10, iat= 355, 212, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   25 VAL  MGX          15 VAL  HN          4.50    (#    154:10  Unique         3.21, 4.98 A)
 &rst
  ixpk= 154, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   67 GLU  HG-          67 GLU  HN          4.50    (#    155:10  Unique         2.09, 3.11 A)
 &rst
  ixpk= 155, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 995, 996,
 &end
#
#   67 GLU  HA           67 GLU  HN          3.50    (#    156:10  Unique         2.84, 2.88 A)
 &rst
  ixpk= 156, nxpk= 10, iat= 990, 988, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 ASP  HB+          67 GLU  HN          4.50    (#    157:10  Unique         3.96, 4.36 A)
 &rst
  ixpk= 157, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   66 ASP  HB-          67 GLU  HN          4.50    (#    158:10  Unique         3.96, 4.36 A)
 &rst
  ixpk= 158, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   67 GLU  HB-          67 GLU  HN          2.80    (#    159:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 159, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 992, 993,
 &end
#
#   39 GLU  HA           40 VAL  HN          4.50    (#    162:10  Unique         2.85, 3.21 A)
 &rst
  ixpk= 162, nxpk= 10, iat= 562, 575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:163     40 VAL  HN          4.50    (#    163:10  Single Ambig)
 &rst
  ixpk= 163, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 551, 593,
 &end
#
#   37 ILE  HA           40 VAL  HN          4.50    (#    164:10  Unique         3.20, 3.71 A)
 &rst
  ixpk= 164, nxpk= 10, iat= 532, 575, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 VAL  HA           40 VAL  HN          3.50    (#    165:10  Unique         2.79, 2.89 A)
 &rst
  ixpk= 165, nxpk= 10, iat= 577, 575, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:166     40 VAL  HN          5.50    (#    166:10  Single Ambig)
 &rst
  ixpk= 166, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1158,1159, 517, 518,
 &end
#
#    0 AMB  10-2:167     40 VAL  HN          5.50    (#    167:10  Single Ambig)
 &rst
  ixpk= 167, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 501,1133,
 &end
#
#   77 ARG  HB+          40 VAL  HN          4.50    (#    168:10  Unique         3.69, 5.24 A)
 &rst
  ixpk= 168, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1152,1153,
 &end
#
#   40 VAL  MGY          40 VAL  HN          2.80    (#    169:10  Unique         2.26, 3.93 A)
 &rst
  ixpk= 169, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 581, 582, 583, 585, 586, 587,
 &end
#
#   45 VAL  MGX          40 VAL  HN          7.00    (#    170:10  Unique         4.12, 7.20 A)
 &rst
  ixpk= 170, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 9.44, r4= 9.94,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#    0 AMB  10-2:171     40 VAL  HN          2.80    (#    171:10  Single Ambig)
 &rst
  ixpk= 171, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 581, 582, 583, 585, 586, 587,1152,1153,
 &end
#
#    0 AMB  10-2:172     40 VAL  HN          3.50    (#    172:10  Single Ambig)
 &rst
  ixpk= 172, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1= 597, 598, 599, 601, 655, 656, 657, 659, 660, 661,
      
 &end
#
#   15 VAL  HA           15 VAL  HN          3.50    (#    173:10  Unique         2.81, 2.82 A)
 &rst
  ixpk= 173, nxpk= 10, iat= 214, 212, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:174     15 VAL  HN          4.50    (#    174:10  Single Ambig)
 &rst
  ixpk= 174, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 796, 185, 186,
 &end
#
#   56 ASP  HB+          15 VAL  HN          4.50    (#    175:10  Unique         4.27, 4.95 A)
 &rst
  ixpk= 175, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 821, 822,
 &end
#
#   15 VAL  HB           15 VAL  HN          2.80    (#    176:10  Unique         2.59, 2.65 A)
 &rst
  ixpk= 176, nxpk= 10, iat= 216, 212, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:177     15 VAL  HN          2.80    (#    177:10  Single Ambig)
 &rst
  ixpk= 177, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 194, 195, 194, 195, 200, 201,
 &end
#
#    0 AMB  10-2:178     15 VAL  HN          3.50    (#    178:10  Single Ambig)
 &rst
  ixpk= 178, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 197, 198, 768, 769,
 &end
#
#   15 VAL  MGY          15 VAL  HN          2.80    (#    179:10  Unique         1.96, 3.69 A)
 &rst
  ixpk= 179, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  10-2:180     15 VAL  HN          2.80    (#    180:10  Single Ambig)
 &rst
  ixpk= 180, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 218, 219, 220, 222, 223, 224, 850, 851, 852, 854,
       855, 856,
 &end
#
#   58 VAL  MGX          15 VAL  HN          3.50    (#    181:10  Unique         2.56, 5.02 A)
 &rst
  ixpk= 181, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   25 VAL  MGY          15 VAL  HN          4.50    (#    182:10  Unique         3.21, 4.98 A)
 &rst
  ixpk= 182, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   35 VAL  HA           74 LEU  HN          3.50    (#    183:10  Unique         2.70, 3.13 A)
 &rst
  ixpk= 183, nxpk= 10, iat= 499,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:184     74 LEU  HN          5.50    (#    184:10  Single Ambig)
 &rst
  ixpk= 184, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 8.64, r4= 9.14,
 igr1= 921, 922, 923, 925, 926, 927,1142,1143,1144, 581,
       582, 583, 585, 586, 587,
 &end
#
#   73 SER  HB+          74 LEU  HN          3.50    (#    185:10  Unique         3.03, 3.96 A)
 &rst
  ixpk= 185, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1092,1093,
 &end
#
#   74 LEU  HB+          74 LEU  HN          2.80    (#    186:10  Unique         2.68, 3.26 A)
 &rst
  ixpk= 186, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1103,1104,
 &end
#
#   74 LEU  HG           74 LEU  HN          4.50    (#    187:10  Unique         2.15, 2.43 A)
 &rst
  ixpk= 187, nxpk= 10, iat=1106,1099, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HB-          74 LEU  HN          3.50    (#    188:10  Unique         2.68, 3.26 A)
 &rst
  ixpk= 188, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1103,1104,
 &end
#
#    0 AMB  10-2:189     74 LEU  HN          3.50    (#    189:10  Single Ambig)
 &rst
  ixpk= 189, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.81, r4= 6.31,
 igr1=1108,1109,1110,1112,1113,1114, 503, 504, 505, 507,
       508, 509, 940, 941, 942, 944, 945, 946,1075,1076,
      1077,
 &end
#
#   74 LEU  MDY          74 LEU  HN          3.50    (#    190:10  Unique         2.93, 4.46 A)
 &rst
  ixpk= 190, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1108,1109,1110,1112,1113,1114,
 &end
#
#   11 TYR  HB+          11 TYR  HN          3.50    (#    192:10  Unique         2.07, 2.98 A)
 &rst
  ixpk= 192, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 152, 153,
 &end
#
#   11 TYR  HB-          11 TYR  HN          3.50    (#    193:10  Unique         2.07, 2.98 A)
 &rst
  ixpk= 193, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 152, 153,
 &end
#
#    0 AMB  10-2:194     11 TYR  HN          4.50    (#    194:10  Single Ambig)
 &rst
  ixpk= 194, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 136, 881,
 &end
#
#   61 LYS  HG+          11 TYR  HN          5.50    (#    195:10  Unique         3.67, 5.85 A)
 &rst
  ixpk= 195, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 900, 901,
 &end
#
#    0 AMB  10-2:196     11 TYR  HN          2.80    (#    196:10  Single Ambig)
 &rst
  ixpk= 196, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#   27 LEU  MDY          11 TYR  HN          4.50    (#    197:10  Unique         4.81, 7.03 A)
 &rst
  ixpk= 197, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   89 LYS  HA           89 LYS  HN          4.50    (#    201:10  Unique         2.27, 2.76 A)
 &rst
  ixpk= 201, nxpk= 10, iat=1334,1332, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 SER  HA           54 VAL  HN          2.80    (#    202:10  Unique         2.14, 2.18 A)
 &rst
  ixpk= 202, nxpk= 10, iat= 785, 794, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   53 SER  HB+          54 VAL  HN          3.50    (#    203:10  Unique         2.88, 3.81 A)
 &rst
  ixpk= 203, nxpk= 10, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   53 SER  HB-          54 VAL  HN          4.50    (#    204:10  Unique         2.88, 3.81 A)
 &rst
  ixpk= 204, nxpk= 10, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 787, 788,
 &end
#
#   54 VAL  HA           54 VAL  HN          3.50    (#    205:10  Unique         2.80, 2.84 A)
 &rst
  ixpk= 205, nxpk= 10, iat= 796, 794, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   54 VAL  HB           54 VAL  HN          2.80    (#    206:10  Unique         2.46, 2.57 A)
 &rst
  ixpk= 206, nxpk= 10, iat= 798, 794, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:207     54 VAL  HN          4.50    (#    207:10  Single Ambig)
 &rst
  ixpk= 207, nxpk= 10, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 256, 768, 769,
 &end
#
#   54 VAL  MGY          54 VAL  HN          2.80    (#    208:10  Unique         1.96, 3.76 A)
 &rst
  ixpk= 208, nxpk= 10, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 800, 801, 802, 804, 805, 806,
 &end
#
#   88 SER  HA           89 LYS  HN          4.50    (#    209:10  Unique         2.14, 2.64 A)
 &rst
  ixpk= 209, nxpk= 10, iat=1323,1332, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 ILE  HA           73 SER  HN          2.80    (#    211:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 211, nxpk= 10, iat=1071,1088, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   65 VAL  HA           73 SER  HN          3.50    (#    212:10  Unique         2.90, 3.35 A)
 &rst
  ixpk= 212, nxpk= 10, iat= 962,1088, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:213     73 SER  HN          2.80    (#    213:10  Single Ambig)
 &rst
  ixpk= 213, nxpk= 10, iat=  -1,1088, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1092,1093,1092,1093,
 &end
#
#    0 AMB  10-2:214      0 AMB  10-1:214    2.80    (#    214:10  Double Ambig)
 &rst
  ixpk= 214, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.94, r4= 5.44,
 igr1= 258, 259, 260, 262, 263, 264,1075,1076,1077, 921,
       922, 923, 925, 926, 927,
 igr2= 249,1088,
 &end
#
#    0 AMB  10-2:215     86 LYS  HN          2.80    (#    215:10  Single Ambig)
 &rst
  ixpk= 215, nxpk= 10, iat=  -1,1284, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1264,1286,
 &end
#
#   54 VAL  HB           18 LEU  HN          5.50    (#    221:10  Unique         2.64, 4.15 A)
 &rst
  ixpk= 221, nxpk= 10, iat= 798, 249, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:222      0 AMB  10-1:222    2.80    (#    222:10  Double Ambig)
 &rst
  ixpk= 222, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 253, 254,1057,1058,
 igr2= 249,1088,
 &end
#
#   18 LEU  HG           18 LEU  HN          3.50    (#    223:10  Unique         1.95, 3.34 A)
 &rst
  ixpk= 223, nxpk= 10, iat= 256, 249, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:224      0 AMB  10-1:224    3.50    (#    224:10  Double Ambig)
 &rst
  ixpk= 224, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806, 921, 922, 923, 925, 926, 927,
 igr2= 249,1088,
 &end
#
#   84 GLU  HA           85 LYS  HN          3.50    (#    227:10  Unique         2.16, 2.49 A)
 &rst
  ixpk= 227, nxpk= 10, iat=1249,1262, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:228     85 LYS  HN          4.50    (#    228:10  Single Ambig)
 &rst
  ixpk= 228, nxpk= 10, iat=  -1,1262, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1251,1252,1251,1252,
 &end
#
#   17 GLY  HA+          18 LEU  HN          2.80    (#    229:10  Unique         2.14, 2.64 A)
 &rst
  ixpk= 229, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 244, 245,
 &end
#
#   17 GLY  HA-          18 LEU  HN          2.80    (#    230:10  Unique         2.14, 2.64 A)
 &rst
  ixpk= 230, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 244, 245,
 &end
#
#   18 LEU  HB-          18 LEU  HN          2.80    (#    231:10  Unique         2.24, 3.01 A)
 &rst
  ixpk= 231, nxpk= 10, iat=  -1, 249, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 253, 254,
 &end
#
#   99 SER  HA          100 GLU  HN          4.50    (#    232:10  Unique         2.14, 2.32 A)
 &rst
  ixpk= 232, nxpk= 10, iat=1505,1514, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:233    115 LEU  HN          2.80    (#    233:10  Single Ambig)
 &rst
  ixpk= 233, nxpk= 10, iat=  -1,1740, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1720,1742,
 &end
#
#    0 AMB  10-2:234    115 LEU  HN          2.80    (#    234:10  Single Ambig)
 &rst
  ixpk= 234, nxpk= 10, iat=  -1,1740, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=1747,1744,1745,1744,1745,
 &end
#
#  119 ILE  HA          120 GLU  HN          3.50    (#    235:10  Unique         2.16, 2.46 A)
 &rst
  ixpk= 235, nxpk= 10, iat=1815,1832, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#  120 GLU  HB-         120 GLU  HN          3.50    (#    236:10  Unique         2.11, 3.17 A)
 &rst
  ixpk= 236, nxpk= 10, iat=  -1,1832, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1836,1837,
 &end
#
#  119 ILE  HB          120 GLU  HN          4.50    (#    237:10  Unique         2.22, 3.80 A)
 &rst
  ixpk= 237, nxpk= 10, iat=1817,1832, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 ILE  HA           77 ARG  HN          4.50    (#    238:10  Unique         3.40, 3.47 A)
 &rst
  ixpk= 238, nxpk= 10, iat=1131,1148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:239     77 ARG  HN          4.50    (#    239:10  Single Ambig)
 &rst
  ixpk= 239, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 562, 607,
 &end
#
#    0 AMB  10-2:241     77 ARG  HN          4.50    (#    241:10  Single Ambig)
 &rst
  ixpk= 241, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1139,1140,1139,1140,
 &end
#
#    0 AMB  10-2:242     77 ARG  HN          5.50    (#    242:10  Single Ambig)
 &rst
  ixpk= 242, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1176,1177,1178, 897, 898,
 &end
#
#   77 ARG  HA           77 ARG  HN          2.80    (#    243:10  Unique         2.77, 2.82 A)
 &rst
  ixpk= 243, nxpk= 10, iat=1150,1148, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   40 VAL  HA           77 ARG  HN          5.50    (#    244:10  Unique         2.70, 2.97 A)
 &rst
  ixpk= 244, nxpk= 10, iat= 577,1148, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   76 ILE  HB           77 ARG  HN          3.50    (#    245:10  Unique         2.51, 2.93 A)
 &rst
  ixpk= 245, nxpk= 10, iat=1133,1148, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   77 ARG  HG+          77 ARG  HN          3.50    (#    246:10  Unique         1.97, 2.84 A)
 &rst
  ixpk= 246, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1155,1156,
 &end
#
#   77 ARG  HB+          77 ARG  HN          2.80    (#    247:10  Unique         2.33, 3.04 A)
 &rst
  ixpk= 247, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1152,1153,
 &end
#
#    0 AMB  10-2:248     77 ARG  HN          2.80    (#    248:10  Single Ambig)
 &rst
  ixpk= 248, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1155,1156,1152,1153,
 &end
#
#    0 AMB  10-2:249     77 ARG  HN          5.50    (#    249:10  Single Ambig)
 &rst
  ixpk= 249, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 8.43, r4= 8.93,
 igr1= 581, 582, 583, 585, 586, 587, 771, 883, 884, 885,
       887, 888, 889,
 &end
#
#   34 LEU  MDY          25 VAL  HN          5.50    (#    253:10  Unique         4.34, 7.11 A)
 &rst
  ixpk= 253, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   25 VAL  HA           25 VAL  HN          3.50    (#    254:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 254, nxpk= 10, iat= 355, 353, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 GLN  HB-          25 VAL  HN          5.50    (#    255:10  Unique         3.03, 4.38 A)
 &rst
  ixpk= 255, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 458, 459,
 &end
#
#   25 VAL  HB           25 VAL  HN          2.80    (#    256:10  Unique         2.62, 2.76 A)
 &rst
  ixpk= 256, nxpk= 10, iat= 357, 353, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:257     25 VAL  HN          4.50    (#    257:10  Single Ambig)
 &rst
  ixpk= 257, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1=1108,1109,1110,1112,1113,1114, 503, 504, 505, 507,
       508, 509,
 &end
#
#   25 VAL  MGX          25 VAL  HN          2.80    (#    258:10  Unique         2.58, 4.18 A)
 &rst
  ixpk= 258, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          25 VAL  HN          4.50    (#    259:10  Unique         2.58, 4.18 A)
 &rst
  ixpk= 259, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   24 PHE  HB+          25 VAL  HN          3.50    (#    260:10  Unique         2.83, 3.80 A)
 &rst
  ixpk= 260, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 337, 338,
 &end
#
#   24 PHE  HB-          25 VAL  HN          3.50    (#    261:10  Unique         2.83, 3.80 A)
 &rst
  ixpk= 261, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 337, 338,
 &end
#
#    0 AMB  10-2:262     25 VAL  HN          4.50    (#    262:10  Single Ambig)
 &rst
  ixpk= 262, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 461, 462, 461, 462,
 &end
#
#    0 AMB  10-2:263     24 PHE  HN          3.50    (#    263:10  Single Ambig)
 &rst
  ixpk= 263, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 258, 259, 260, 262, 263, 264, 503, 504, 505, 507,
       508, 509,
 &end
#
#   24 PHE  HB+          24 PHE  HN          2.80    (#    264:10  Unique         2.14, 2.88 A)
 &rst
  ixpk= 264, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 337, 338,
 &end
#
#   24 PHE  HB-          24 PHE  HN          2.80    (#    265:10  Unique         2.14, 2.88 A)
 &rst
  ixpk= 265, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 337, 338,
 &end
#
#   23 ALA  MB           24 PHE  HN          3.50    (#    266:10  Unique         2.43, 3.49 A)
 &rst
  ixpk= 266, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 327, 328, 329,
 &end
#
#   34 LEU  MDY          24 PHE  HN          4.50    (#    267:10  Unique         3.78, 7.10 A)
 &rst
  ixpk= 267, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   62 VAL  MGX           7 VAL  HN          3.50    (#    268:10  Unique         3.06, 5.75 A)
 &rst
  ixpk= 268, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#    7 VAL  HA            7 VAL  HN          2.80    (#    269:10  Unique         2.75, 2.82 A)
 &rst
  ixpk= 269, nxpk= 10, iat= 100,  98, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:271      0 AMB  10-1:271    2.80    (#    271:10  Double Ambig)
 &rst
  ixpk= 271, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=  87,  88,  87,  88, 833, 834,
 igr2=  98, 829,
 &end
#
#    7 VAL  MGX           7 VAL  HN          2.80    (#    272:10  Unique         1.94, 3.41 A)
 &rst
  ixpk= 272, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  10-2:273      7 VAL  HN          2.80    (#    273:10  Single Ambig)
 &rst
  ixpk= 273, nxpk= 10, iat=  -1,  98, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 104, 105, 106, 108, 109, 110, 966, 967, 968, 970,
       971, 972, 966, 967, 968, 970, 971, 972,
 &end
#
#    0 AMB  10-2:279     87 GLU  HN          2.80    (#    279:10  Single Ambig)
 &rst
  ixpk= 279, nxpk= 10, iat=  -1,1306, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1286,1308,
 &end
#
#   56 ASP  HA           57 GLU  HN          2.80    (#    283:10  Unique         2.18, 2.24 A)
 &rst
  ixpk= 283, nxpk= 10, iat= 819, 829, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   56 ASP  HB+          57 GLU  HN          3.50    (#    284:10  Unique         2.81, 3.84 A)
 &rst
  ixpk= 284, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 821, 822,
 &end
#
#   56 ASP  HB-          57 GLU  HN          3.50    (#    285:10  Unique         2.81, 3.84 A)
 &rst
  ixpk= 285, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 821, 822,
 &end
#
#   57 GLU  HG+          57 GLU  HN          4.50    (#    286:10  Unique         4.22, 4.46 A)
 &rst
  ixpk= 286, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 836, 837,
 &end
#
#   14 LYS  HG-          57 GLU  HN          4.50    (#    287:10  Unique         3.56, 4.92 A)
 &rst
  ixpk= 287, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 197, 198,
 &end
#
#    0 AMB  10-2:288      0 AMB  10-1:288    4.50    (#    288:10  Double Ambig)
 &rst
  ixpk= 288, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1372,1373,1372,1373,1288,1289,1288,1289,
 igr2=1368,1306,
 &end
#
#    0 AMB  10-2:291      0 AMB  10-1:291    2.80    (#    291:10  Double Ambig)
 &rst
  ixpk= 291, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=  65,1364,  85,
 igr2=  83,1368,
 &end
#
#   90 PRO  HB-          91 ARG  HN          2.80    (#    292:10  Unique         2.08, 3.46 A)
 &rst
  ixpk= 292, nxpk= 10, iat=  -1,1368, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1361,1362,
 &end
#
#   11 TYR  HB-           6 GLU  HN          7.00    (#    294:10  Unique         6.60, 8.75 A)
 &rst
  ixpk= 294, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 152, 153,
 &end
#
#    0 AMB  10-2:295      0 AMB  10-1:295    2.80    (#    295:10  Double Ambig)
 &rst
  ixpk= 295, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1358,1359,1358,1359,  87,  88,  87,  88,
 igr2=1368,  83,
 &end
#
#    0 AMB  10-2:296      6 GLU  HN          4.50    (#    296:10  Single Ambig)
 &rst
  ixpk= 296, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 921, 922, 923, 925, 926, 927, 104, 105, 106, 108,
       109, 110, 966, 967, 968, 970, 971, 972, 966, 967,
       968, 970, 971, 972,
 &end
#
#    5 PHE  HB-           6 GLU  HN          4.50    (#    297:10  Unique         2.17, 3.99 A)
 &rst
  ixpk= 297, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  67,  68,
 &end
#
#   62 VAL  MGX           6 GLU  HN          4.50    (#    298:10  Unique         4.22, 7.31 A)
 &rst
  ixpk= 298, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:299      0 AMB  10-1:299    2.80    (#    299:10  Double Ambig)
 &rst
  ixpk= 299, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1516,1430,
 igr2=1529,1428,
 &end
#
#   26 ALA  MB           16 THR  HN          4.50    (#    304:10  Unique         4.85, 6.07 A)
 &rst
  ixpk= 304, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 373, 374, 375,
 &end
#
#   76 ILE  HA           61 LYS  HN          4.50    (#    305:10  Unique         3.30, 4.34 A)
 &rst
  ixpk= 305, nxpk= 10, iat=1131, 893, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:306     61 LYS  HN          4.50    (#    306:10  Single Ambig)
 &rst
  ixpk= 306, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1122,1123, 152, 153,
 &end
#
#   60 VAL  HB           61 LYS  HN          3.50    (#    307:10  Unique         1.99, 2.59 A)
 &rst
  ixpk= 307, nxpk= 10, iat= 881, 893, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   61 LYS  HB-          61 LYS  HN          2.80    (#    308:10  Unique         2.49, 3.39 A)
 &rst
  ixpk= 308, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 897, 898,
 &end
#
#    0 AMB  10-2:309     61 LYS  HN          3.50    (#    309:10  Single Ambig)
 &rst
  ixpk= 309, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 900, 901,1188,1189,1190,
 &end
#
#    0 AMB  10-2:310     61 LYS  HN          2.80    (#    310:10  Single Ambig)
 &rst
  ixpk= 310, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 897, 898,1103,1104,
 &end
#
#    0 AMB  10-2:311     61 LYS  HN          4.50    (#    311:10  Single Ambig)
 &rst
  ixpk= 311, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1=1142,1143,1144, 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:312     61 LYS  HN          3.50    (#    312:10  Single Ambig)
 &rst
  ixpk= 312, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  10-2:314    101 GLU  HN          3.50    (#    314:10  Single Ambig)
 &rst
  ixpk= 314, nxpk= 10, iat=  -1,1529, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1518,1519,1533,1534,
 &end
#
#  118 TRP  HA          118 TRP  HN          4.50    (#    315:10  Unique         2.27, 2.76 A)
 &rst
  ixpk= 315, nxpk= 10, iat=1791,1789, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:316    118 TRP  HN          4.50    (#    316:10  Single Ambig)
 &rst
  ixpk= 316, nxpk= 10, iat=  -1,1789, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1778,1779,1778,1779,
 &end
#
#   41 THR  HA           42 HIS  HN          4.50    (#    317:10  Unique         2.17, 2.36 A)
 &rst
  ixpk= 317, nxpk= 10, iat= 593, 605, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 HIS  HB+          42 HIS  HN          4.50    (#    318:10  Unique         2.20, 2.89 A)
 &rst
  ixpk= 318, nxpk= 10, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 609, 610,
 &end
#
#   41 THR  HG1          42 HIS  HN          5.50    (#    319:10  Unique         1.97, 3.14 A)
 &rst
  ixpk= 319, nxpk= 10, iat= 601, 605, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#  127 LEU  HA          128 ILE  HN          3.50    (#    320:10  Unique         2.14, 2.24 A)
 &rst
  ixpk= 320, nxpk= 10, iat=1949,1966, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 ASP  HA           56 ASP  HN          3.50    (#    321:10  Unique         2.94, 2.95 A)
 &rst
  ixpk= 321, nxpk= 10, iat= 819, 817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 GLY  HA-          56 ASP  HN          3.50    (#    322:10  Unique         2.95, 3.25 A)
 &rst
  ixpk= 322, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 812, 813,
 &end
#
#   54 VAL  HA           56 ASP  HN          3.50    (#    323:10  Unique         3.24, 3.35 A)
 &rst
  ixpk= 323, nxpk= 10, iat= 796, 817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   56 ASP  HB+          56 ASP  HN          2.80    (#    324:10  Unique         2.42, 2.89 A)
 &rst
  ixpk= 324, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 821, 822,
 &end
#
#   56 ASP  HB-          56 ASP  HN          2.80    (#    325:10  Unique         2.42, 2.89 A)
 &rst
  ixpk= 325, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 821, 822,
 &end
#
#   15 VAL  HB           56 ASP  HN          2.80    (#    326:10  Unique         2.25, 2.49 A)
 &rst
  ixpk= 326, nxpk= 10, iat= 216, 817, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  MGY          56 ASP  HN          2.80    (#    327:10  Unique         2.73, 4.52 A)
 &rst
  ixpk= 327, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  10-2:328     56 ASP  HN          2.80    (#    328:10  Single Ambig)
 &rst
  ixpk= 328, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806,
 &end
#
#   24 PHE  HB+          16 THR  HN          4.50    (#    329:10  Unique         3.04, 4.02 A)
 &rst
  ixpk= 329, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 337, 338,
 &end
#
#   24 PHE  HB-          16 THR  HN          4.50    (#    330:10  Unique         3.04, 4.02 A)
 &rst
  ixpk= 330, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 337, 338,
 &end
#
#   25 VAL  HA           16 THR  HN          2.80    (#    331:10  Unique         2.59, 2.96 A)
 &rst
  ixpk= 331, nxpk= 10, iat= 355, 228, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  HA           16 THR  HN          2.80    (#    332:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 332, nxpk= 10, iat= 214, 228, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  HB           16 THR  HN          4.50    (#    333:10  Unique         3.74, 3.89 A)
 &rst
  ixpk= 333, nxpk= 10, iat= 216, 228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:334     16 THR  HN          2.80    (#    334:10  Single Ambig)
 &rst
  ixpk= 334, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 234, 235, 236, 238,
 &end
#
#   15 VAL  MGY          16 THR  HN          2.80    (#    335:10  Unique         2.05, 3.99 A)
 &rst
  ixpk= 335, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   15 VAL  MGX          16 THR  HN          2.80    (#    336:10  Unique         2.05, 3.99 A)
 &rst
  ixpk= 336, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   25 VAL  MGX          16 THR  HN          3.50    (#    337:10  Unique         3.18, 5.31 A)
 &rst
  ixpk= 337, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   25 VAL  MGY          16 THR  HN          4.50    (#    338:10  Unique         3.18, 5.31 A)
 &rst
  ixpk= 338, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   84 GLU  HA           84 GLU  HN          3.50    (#    339:10  Unique         2.27, 2.84 A)
 &rst
  ixpk= 339, nxpk= 10, iat=1249,1247, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 THR  HB           42 HIS  HN          4.50    (#    341:10  Unique         2.61, 3.63 A)
 &rst
  ixpk= 341, nxpk= 10, iat= 595, 605, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 HIS  HA           42 HIS  HN          4.50    (#    342:10  Unique         2.76, 2.83 A)
 &rst
  ixpk= 342, nxpk= 10, iat= 607, 605, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   42 HIS  HB-          42 HIS  HN          3.50    (#    343:10  Unique         2.20, 2.89 A)
 &rst
  ixpk= 343, nxpk= 10, iat=  -1, 605, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 609, 610,
 &end
#
#  128 ILE  HB          128 ILE  HN          4.50    (#    344:10  Unique         2.54, 3.20 A)
 &rst
  ixpk= 344, nxpk= 10, iat=1970,1966, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:345     80 GLN  HN          3.50    (#    345:10  Single Ambig)
 &rst
  ixpk= 345, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1184,1174,
 &end
#
#   77 ARG  HA           80 GLN  HN          4.50    (#    346:10  Unique         3.13, 3.80 A)
 &rst
  ixpk= 346, nxpk= 10, iat=1150,1196, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:347     80 GLN  HN          2.80    (#    347:10  Single Ambig)
 &rst
  ixpk= 347, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1203,1204,1203,1204,
 &end
#
#    0 AMB  10-2:348     80 GLN  HN          2.80    (#    348:10  Single Ambig)
 &rst
  ixpk= 348, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1200,1201,1200,1201,
 &end
#
#    0 AMB  10-2:349     80 GLN  HN          4.50    (#    349:10  Single Ambig)
 &rst
  ixpk= 349, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1188,1189,1190,1227,1228,1229,
 &end
#
#   80 GLN  HA           80 GLN  HN          3.50    (#    350:10  Unique         2.83, 2.92 A)
 &rst
  ixpk= 350, nxpk= 10, iat=1198,1196, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:351     80 GLN  HN          5.50    (#    351:10  Single Ambig)
 &rst
  ixpk= 351, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1=1176,1177,1178, 897, 898,
 &end
#
#    0 AMB  10-2:361      0 AMB  10-1:361    3.50    (#    361:10  Double Ambig)
 &rst
  ixpk= 361, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1667,1720,
 igr2=1684,1718,
 &end
#
#    9 SER  HB+          10 VAL  HN          2.80    (#    362:10  Unique         1.95, 2.90 A)
 &rst
  ixpk= 362, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 125, 126,
 &end
#
#  118 TRP  HA          117 GLU  HN          7.00    (#    367:10  Unique         4.16, 5.10 A)
 &rst
  ixpk= 367, nxpk= 10, iat=1791,1774, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    4 LYS  HG+           4 LYS  HN          4.50    (#    368:10  Unique         1.98, 3.63 A)
 &rst
  ixpk= 368, nxpk= 10, iat=  -1,  41, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  48,  49,
 &end
#
#    3 ALA  HA            4 LYS  HN          4.50    (#    369:10  Unique         2.14, 2.26 A)
 &rst
  ixpk= 369, nxpk= 10, iat=  33,  41, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 LYS  HA            4 LYS  HN          3.50    (#    370:10  Unique         2.86, 2.93 A)
 &rst
  ixpk= 370, nxpk= 10, iat=  43,  41, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 LYS  HB+           4 LYS  HN          3.50    (#    371:10  Unique         2.25, 3.06 A)
 &rst
  ixpk= 371, nxpk= 10, iat=  -1,  41, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  45,  46,
 &end
#
#    0 AMB  10-2:372      4 LYS  HN          2.80    (#    372:10  Single Ambig)
 &rst
  ixpk= 372, nxpk= 10, iat=  -1,  41, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=  35,  36,  37,  45,  46,
 &end
#
#    0 AMB  10-2:373      0 AMB  10-1:373    3.50    (#    373:10  Double Ambig)
 &rst
  ixpk= 373, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1708, 473, 474,
 igr2=1718, 478,
 &end
#
#    9 SER  HA           10 VAL  HN          2.80    (#    374:10  Unique         2.23, 2.48 A)
 &rst
  ixpk= 374, nxpk= 10, iat= 123, 132, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    9 SER  HB-          10 VAL  HN          2.80    (#    375:10  Unique         1.95, 2.90 A)
 &rst
  ixpk= 375, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 125, 126,
 &end
#
#   10 VAL  HB           10 VAL  HN          3.50    (#    376:10  Unique         2.55, 2.77 A)
 &rst
  ixpk= 376, nxpk= 10, iat= 136, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:377     10 VAL  HN          2.80    (#    377:10  Single Ambig)
 &rst
  ixpk= 377, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 138, 139, 140, 142, 143, 144, 138, 139, 140, 142,
       143, 144,
 &end
#
#    0 AMB  10-2:381      0 AMB  10-1:381    3.50    (#    381:10  Double Ambig)
 &rst
  ixpk= 381, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 867, 868,1781,1782,1781,1782,
 igr2= 860,1774,
 &end
#
#   58 VAL  HB           59 GLN  HN          2.80    (#    382:10  Unique         2.09, 3.40 A)
 &rst
  ixpk= 382, nxpk= 10, iat= 848, 860, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:383      0 AMB  10-1:383    2.80    (#    383:10  Double Ambig)
 &rst
  ixpk= 383, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1=1688,1689,1688,1689, 864, 865,
 igr2=1706, 860,
 &end
#
#   60 VAL  MGY          59 GLN  HN          4.50    (#    386:10  Unique         3.26, 5.83 A)
 &rst
  ixpk= 386, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#    0 AMB  10-2:387    113 ASP  HN          4.50    (#    387:10  Single Ambig)
 &rst
  ixpk= 387, nxpk= 10, iat=  -1,1706, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1710,1711,1710,1711,
 &end
#
#   33 GLY  HA-          34 LEU  HN          2.80    (#    389:10  Unique         2.33, 2.57 A)
 &rst
  ixpk= 389, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 473, 474,
 &end
#
#    0 AMB  10-2:391      0 AMB  10-1:391    2.80    (#    391:10  Double Ambig)
 &rst
  ixpk= 391, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.11, r4= 4.61,
 igr1=1725,1726,1725,1726,1106,
 igr2=1718, 478,
 &end
#
#   34 LEU  HB-          34 LEU  HN          2.80    (#    392:10  Unique         2.57, 3.09 A)
 &rst
  ixpk= 392, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 482, 483,
 &end
#
#    0 AMB  10-2:393     34 LEU  HN          4.50    (#    393:10  Single Ambig)
 &rst
  ixpk= 393, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1103,1104, 485,
 &end
#
#   74 LEU  MDY          34 LEU  HN          3.50    (#    395:10  Unique         2.31, 4.45 A)
 &rst
  ixpk= 395, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1108,1109,1110,1112,1113,1114,
 &end
#
#    0 AMB  10-2:396     34 LEU  HN          3.50    (#    396:10  Single Ambig)
 &rst
  ixpk= 396, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077,
 &end
#
#   34 LEU  MDY          34 LEU  HN          4.50    (#    397:10  Unique         4.71, 5.53 A)
 &rst
  ixpk= 397, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   19 GLN  HA           20 ALA  HN          3.50    (#    398:10  Unique         2.28, 2.58 A)
 &rst
  ixpk= 398, nxpk= 10, iat= 270, 285, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   20 ALA  HA           20 ALA  HN          4.50    (#    399:10  Unique         2.28, 2.80 A)
 &rst
  ixpk= 399, nxpk= 10, iat= 287, 285, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 GLN  HB+          20 ALA  HN          3.50    (#    400:10  Unique         1.95, 3.02 A)
 &rst
  ixpk= 400, nxpk= 10, iat=  -1, 285, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 272, 273,
 &end
#
#   19 GLN  HB-          20 ALA  HN          4.50    (#    401:10  Unique         1.95, 3.02 A)
 &rst
  ixpk= 401, nxpk= 10, iat=  -1, 285, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 272, 273,
 &end
#
#   20 ALA  MB           20 ALA  HN          2.80    (#    402:10  Unique         2.08, 2.98 A)
 &rst
  ixpk= 402, nxpk= 10, iat=  -1, 285, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 289, 290, 291,
 &end
#
#  115 LEU  HA          116 GLU  HN          3.50    (#    403:10  Unique         2.14, 2.35 A)
 &rst
  ixpk= 403, nxpk= 10, iat=1742,1759, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   19 GLN  HG-          19 GLN  HN          3.50    (#    408:10  Unique         2.56, 4.00 A)
 &rst
  ixpk= 408, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 275, 276,
 &end
#
#   19 GLN  HG+          19 GLN  HN          3.50    (#    409:10  Unique         2.56, 4.00 A)
 &rst
  ixpk= 409, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 275, 276,
 &end
#
#    0 AMB  10-2:410     19 GLN  HN          2.80    (#    410:10  Single Ambig)
 &rst
  ixpk= 410, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1= 272, 273, 327, 328, 329,
 &end
#
#   18 LEU  MDX          19 GLN  HN          3.50    (#    411:10  Unique         1.96, 5.14 A)
 &rst
  ixpk= 411, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 258, 259, 260, 262, 263, 264,
 &end
#
#   19 GLN  HB+          19 GLN  HN          3.50    (#    412:10  Unique         2.26, 3.17 A)
 &rst
  ixpk= 412, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 272, 273,
 &end
#
#   18 LEU  HB+          19 GLN  HN          3.50    (#    413:10  Unique         2.42, 3.65 A)
 &rst
  ixpk= 413, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 253, 254,
 &end
#
#   18 LEU  HB-          19 GLN  HN          2.80    (#    414:10  Unique         2.42, 3.65 A)
 &rst
  ixpk= 414, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 253, 254,
 &end
#
#    0 AMB  10-2:415      0 AMB  10-1:415    3.50    (#    415:10  Double Ambig)
 &rst
  ixpk= 415, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1915,1462,
 igr2=1935,1470,
 &end
#
#   44 PHE  HB-          44 PHE  HN          2.80    (#    416:10  Unique         2.32, 3.05 A)
 &rst
  ixpk= 416, nxpk= 10, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 633, 634,
 &end
#
#   44 PHE  HB+          44 PHE  HN          3.50    (#    417:10  Unique         2.32, 3.05 A)
 &rst
  ixpk= 417, nxpk= 10, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 633, 634,
 &end
#
#    0 AMB  10-2:418     65 VAL  HN          2.80    (#    418:10  Single Ambig)
 &rst
  ixpk= 418, nxpk= 10, iat=  -1, 960, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972, 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  10-2:419     65 VAL  HN          2.80    (#    419:10  Single Ambig)
 &rst
  ixpk= 419, nxpk= 10, iat=  -1, 960, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 952, 962,
 &end
#
#    0 AMB  10-2:420     65 VAL  HN          4.50    (#    420:10  Single Ambig)
 &rst
  ixpk= 420, nxpk= 10, iat=  -1, 960, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 964, 102,
 &end
#
#   64 ALA  MB           65 VAL  HN          2.80    (#    421:10  Unique         2.18, 3.60 A)
 &rst
  ixpk= 421, nxpk= 10, iat=  -1, 960, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 954, 955, 956,
 &end
#
#    7 VAL  MGX          65 VAL  HN          2.80    (#    422:10  Unique         2.47, 5.24 A)
 &rst
  ixpk= 422, nxpk= 10, iat=  -1, 960, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#  126 ASP  HA          126 ASP  HN          4.50    (#    423:10  Unique         2.28, 2.81 A)
 &rst
  ixpk= 423, nxpk= 10, iat=1937,1935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 PHE  HA           44 PHE  HN          3.50    (#    424:10  Unique         2.83, 2.93 A)
 &rst
  ixpk= 424, nxpk= 10, iat= 631, 629, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:425     44 PHE  HN          2.80    (#    425:10  Single Ambig)
 &rst
  ixpk= 425, nxpk= 10, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 624, 625, 624, 625,
 &end
#
#   69 LYS  HA           68 GLU  HN          5.50    (#    426:10  Unique         5.00, 5.25 A)
 &rst
  ixpk= 426, nxpk= 10, iat=1020,1003, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:427      0 AMB  10-1:427    2.80    (#    427:10  Double Ambig)
 &rst
  ixpk= 427, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1489,1005,
 igr2=1503,1003,
 &end
#
#   68 GLU  HG-          68 GLU  HN          2.80    (#    428:10  Unique         1.98, 3.15 A)
 &rst
  ixpk= 428, nxpk= 10, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1010,1011,
 &end
#
#    0 AMB  10-2:429     68 GLU  HN          2.80    (#    429:10  Single Ambig)
 &rst
  ixpk= 429, nxpk= 10, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1007,1008,1007,1008,
 &end
#
#   69 LYS  HB-          68 GLU  HN          5.50    (#    430:10  Unique         4.26, 5.20 A)
 &rst
  ixpk= 430, nxpk= 10, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1022,1023,
 &end
#
#   66 ASP  HB-          68 GLU  HN          4.50    (#    431:10  Unique         3.37, 4.63 A)
 &rst
  ixpk= 431, nxpk= 10, iat=  -1,1003, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#  125 LYS  HA          126 ASP  HN          4.50    (#    432:10  Unique         2.14, 2.41 A)
 &rst
  ixpk= 432, nxpk= 10, iat=1915,1935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 LYS  HG-           5 PHE  HN          5.50    (#    434:10  Unique         2.24, 4.56 A)
 &rst
  ixpk= 434, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  48,  49,
 &end
#
#   72 ILE  QD1           5 PHE  HN          5.50    (#    435:10  Unique         5.50,10.22 A)
 &rst
  ixpk= 435, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1=1082,1083,1084,
 &end
#
#    0 AMB  10-2:436      5 PHE  HN          2.80    (#    436:10  Single Ambig)
 &rst
  ixpk= 436, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 3.66, r4= 4.16,
 igr1=  45,  46,  35,  36,  37,
 &end
#
#    5 PHE  HA            5 PHE  HN          3.50    (#    437:10  Unique         2.28, 2.81 A)
 &rst
  ixpk= 437, nxpk= 10, iat=  65,  63, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    4 LYS  HA            5 PHE  HN          3.50    (#    438:10  Unique         3.09, 3.40 A)
 &rst
  ixpk= 438, nxpk= 10, iat=  43,  63, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    5 PHE  HB-           5 PHE  HN          3.50    (#    439:10  Unique         2.18, 3.00 A)
 &rst
  ixpk= 439, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  67,  68,
 &end
#
#    5 PHE  HB+           5 PHE  HN          3.50    (#    440:10  Unique         2.18, 3.00 A)
 &rst
  ixpk= 440, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=  67,  68,
 &end
#
#    4 LYS  HB+           5 PHE  HN          4.50    (#    441:10  Unique         2.15, 3.60 A)
 &rst
  ixpk= 441, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  45,  46,
 &end
#
#    4 LYS  HG+           5 PHE  HN          5.50    (#    442:10  Unique         2.24, 4.56 A)
 &rst
  ixpk= 442, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  48,  49,
 &end
#
#    0 AMB  10-2:443      5 PHE  HN          4.50    (#    443:10  Single Ambig)
 &rst
  ixpk= 443, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 7.28, r4= 7.78,
 igr1= 921, 922, 923, 925, 926, 927, 966, 967, 968, 970,
       971, 972, 966, 967, 968, 970, 971, 972,
 &end
#
#    0 AMB  10-2:447     23 ALA  HN          4.50    (#    447:10  Single Ambig)
 &rst
  ixpk= 447, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 709, 710, 709, 710,
 &end
#
#    0 AMB  10-2:448      0 AMB  10-1:448    2.80    (#    448:10  Double Ambig)
 &rst
  ixpk= 448, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1=1308, 318, 319,
 igr2=1321, 323,
 &end
#
#   22 GLY  HA-          23 ALA  HN          2.80    (#    449:10  Unique         2.16, 2.58 A)
 &rst
  ixpk= 449, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 318, 319,
 &end
#
#    0 AMB  10-2:450     23 ALA  HN          5.50    (#    450:10  Single Ambig)
 &rst
  ixpk= 450, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 7.19, r4= 7.69,
 igr1= 534, 253, 254, 768, 769,
 &end
#
#   23 ALA  MB           23 ALA  HN          2.80    (#    451:10  Unique         2.29, 3.03 A)
 &rst
  ixpk= 451, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 327, 328, 329,
 &end
#
#    0 AMB  10-2:452      0 AMB  10-1:452    2.80    (#    452:10  Double Ambig)
 &rst
  ixpk= 452, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 712, 713, 714, 581, 582, 583, 585, 586, 587,
 igr2= 323, 560,
 &end
#
#   34 LEU  MDY          23 ALA  HN          2.80    (#    453:10  Unique         2.71, 5.94 A)
 &rst
  ixpk= 453, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   18 LEU  HG           49 ASN  HN          7.00    (#    454:10  Unique         3.78, 6.15 A)
 &rst
  ixpk= 454, nxpk= 10, iat= 256, 718, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:455     49 ASN  HN          2.80    (#    455:10  Single Ambig)
 &rst
  ixpk= 455, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 720, 689,
 &end
#
#    0 AMB  10-2:456     49 ASN  HN          5.50    (#    456:10  Single Ambig)
 &rst
  ixpk= 456, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 287, 734,
 &end
#
#   49 ASN  HB+          49 ASN  HN          2.80    (#    458:10  Unique         2.32, 3.17 A)
 &rst
  ixpk= 458, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 722, 723,
 &end
#
#    0 AMB  10-2:459     49 ASN  HN          2.80    (#    459:10  Single Ambig)
 &rst
  ixpk= 459, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 722, 723, 691, 692,
 &end
#
#   50 GLU  HG+          49 ASN  HN          4.50    (#    460:10  Unique         3.91, 4.86 A)
 &rst
  ixpk= 460, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 739, 740,
 &end
#
#   48 ILE  HB           49 ASN  HN          4.50    (#    461:10  Unique         3.91, 4.06 A)
 &rst
  ixpk= 461, nxpk= 10, iat= 703, 718, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:462     23 ALA  HN          4.50    (#    462:10  Single Ambig)
 &rst
  ixpk= 462, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 581, 582, 583, 585, 586, 587,1142,1143,1144, 705,
       706, 707,
 &end
#
#   75 SER  HB+          78 ALA  HN          4.50    (#    463:10  Unique         2.24, 3.60 A)
 &rst
  ixpk= 463, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1122,1123,
 &end
#
#   75 SER  HB-          78 ALA  HN          5.50    (#    464:10  Unique         2.24, 3.60 A)
 &rst
  ixpk= 464, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1122,1123,
 &end
#
#   61 LYS  HB+          78 ALA  HN          4.50    (#    465:10  Unique         4.43, 7.28 A)
 &rst
  ixpk= 465, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 897, 898,
 &end
#
#   77 ARG  HG+          78 ALA  HN          3.50    (#    466:10  Unique         2.18, 2.77 A)
 &rst
  ixpk= 466, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1155,1156,
 &end
#
#   77 ARG  HA           78 ALA  HN          4.50    (#    468:10  Unique         3.43, 3.46 A)
 &rst
  ixpk= 468, nxpk= 10, iat=1150,1172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   78 ALA  MB           78 ALA  HN          2.80    (#    469:10  Unique         2.13, 2.91 A)
 &rst
  ixpk= 469, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1176,1177,1178,
 &end
#
#    0 AMB  10-2:470     78 ALA  HN          3.50    (#    470:10  Single Ambig)
 &rst
  ixpk= 470, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1152,1153,1135,1136,1137,
 &end
#
#   77 ARG  HG-          78 ALA  HN          2.80    (#    471:10  Unique         2.18, 2.77 A)
 &rst
  ixpk= 471, nxpk= 10, iat=  -1,1172, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1155,1156,
 &end
#
#   30 GLU  HA           31 THR  HN          3.50    (#    472:10  Unique         3.53, 3.54 A)
 &rst
  ixpk= 472, nxpk= 10, iat= 427, 440, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HA           31 THR  HN          3.50    (#    473:10  Unique         2.89, 2.94 A)
 &rst
  ixpk= 473, nxpk= 10, iat= 442, 440, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 GLU  HA           31 THR  HN          5.50    (#    474:10  Unique         4.59, 4.76 A)
 &rst
  ixpk= 474, nxpk= 10, iat= 412, 440, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   31 THR  HB           31 THR  HN          3.50    (#    475:10  Unique         2.47, 2.66 A)
 &rst
  ixpk= 475, nxpk= 10, iat= 444, 440, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:476     31 THR  HN          4.50    (#    476:10  Single Ambig)
 &rst
  ixpk= 476, nxpk= 10, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 432, 433, 432, 433,
 &end
#
#   30 GLU  HB-          31 THR  HN          4.50    (#    477:10  Unique         1.92, 3.67 A)
 &rst
  ixpk= 477, nxpk= 10, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 429, 430,
 &end
#
#   31 THR  HG1          31 THR  HN          4.50    (#    478:10  Unique         2.51, 3.17 A)
 &rst
  ixpk= 478, nxpk= 10, iat= 450, 440, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HB-          31 THR  HN          4.50    (#    479:10  Unique         3.07, 4.53 A)
 &rst
  ixpk= 479, nxpk= 10, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 383, 384,
 &end
#
#    0 AMB  10-2:480      0 AMB  10-1:480    2.80    (#    480:10  Double Ambig)
 &rst
  ixpk= 480, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 501,1310,1311,
 igr2= 323,1321,
 &end
#
#    0 AMB  10-2:482     58 VAL  HN          4.50    (#    482:10  Single Ambig)
 &rst
  ixpk= 482, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 194, 195, 194, 195, 200, 201, 200, 201,
 &end
#
#   57 GLU  HG+          58 VAL  HN          3.50    (#    483:10  Unique         3.06, 3.72 A)
 &rst
  ixpk= 483, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 836, 837,
 &end
#
#   58 VAL  HB           58 VAL  HN          4.50    (#    484:10  Unique         2.56, 3.22 A)
 &rst
  ixpk= 484, nxpk= 10, iat= 848, 844, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:485     58 VAL  HN          3.50    (#    485:10  Single Ambig)
 &rst
  ixpk= 485, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 175, 176, 177, 197, 198,
 &end
#
#   15 VAL  MGY          58 VAL  HN          4.50    (#    486:10  Unique         3.17, 5.79 A)
 &rst
  ixpk= 486, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   58 VAL  MGY          58 VAL  HN          2.80    (#    487:10  Unique         1.95, 3.70 A)
 &rst
  ixpk= 487, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   58 VAL  MGX          58 VAL  HN          2.80    (#    488:10  Unique         1.95, 3.70 A)
 &rst
  ixpk= 488, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   36 HIS  HB+          39 GLU  HN          4.50    (#    489:10  Unique         1.95, 3.33 A)
 &rst
  ixpk= 489, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
#   87 GLU  HA           88 SER  HN          3.50    (#    490:10  Unique         2.14, 2.22 A)
 &rst
  ixpk= 490, nxpk= 10, iat=1308,1321, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:491     39 GLU  HN          4.50    (#    491:10  Single Ambig)
 &rst
  ixpk= 491, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 553, 554, 553, 554,
 &end
#
#   77 ARG  HD+          39 GLU  HN          5.50    (#    493:10  Unique         4.35, 5.82 A)
 &rst
  ixpk= 493, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1158,1159,
 &end
#
#   87 GLU  HB+          88 SER  HN          4.50    (#    497:10  Unique         2.28, 3.91 A)
 &rst
  ixpk= 497, nxpk= 10, iat=  -1,1321, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1310,1311,
 &end
#
#    0 AMB  10-2:498     39 GLU  HN          3.50    (#    498:10  Single Ambig)
 &rst
  ixpk= 498, nxpk= 10, iat=  -1, 560, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 581, 582, 583, 585, 586, 587, 503, 504, 505, 507,
       508, 509,
 &end
#
#    0 AMB  10-2:502      9 SER  HN          4.50    (#    502:10  Single Ambig)
 &rst
  ixpk= 502, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 104, 105, 106, 108, 109, 110, 900, 901,
 &end
#
#   27 LEU  HA           14 LYS  HN          4.50    (#    503:10  Unique         3.57, 4.08 A)
 &rst
  ixpk= 503, nxpk= 10, iat= 381, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:504     14 LYS  HN          4.50    (#    504:10  Single Ambig)
 &rst
  ixpk= 504, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.22, r4= 6.72,
 igr1= 386, 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  10-2:505     14 LYS  HN          4.50    (#    505:10  Single Ambig)
 &rst
  ixpk= 505, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 850, 851, 852, 854, 855, 856, 383, 384,
 &end
#
#   25 VAL  HA           14 LYS  HN          4.50    (#    506:10  Unique         3.65, 4.44 A)
 &rst
  ixpk= 506, nxpk= 10, iat= 355, 190, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 GLY  HA-          14 LYS  HN          2.80    (#    507:10  Unique         2.14, 2.59 A)
 &rst
  ixpk= 507, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 185, 186,
 &end
#
#    0 AMB  10-2:508     14 LYS  HN          2.80    (#    508:10  Single Ambig)
 &rst
  ixpk= 508, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 200, 201, 200, 201, 194, 195,
 &end
#
#   26 ALA  MB           14 LYS  HN          3.50    (#    509:10  Unique         3.50, 4.52 A)
 &rst
  ixpk= 509, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 373, 374, 375,
 &end
#
#   25 VAL  MGY          14 LYS  HN          2.80    (#    510:10  Unique         2.09, 4.64 A)
 &rst
  ixpk= 510, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   14 LYS  HG-          14 LYS  HN          4.50    (#    511:10  Unique         2.33, 3.51 A)
 &rst
  ixpk= 511, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 197, 198,
 &end
#
#    0 AMB  10-2:513     38 SER  HN          3.50    (#    513:10  Single Ambig)
 &rst
  ixpk= 513, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1= 540, 541, 540, 541, 534,
 &end
#
#    0 AMB  10-2:514     38 SER  HN          4.50    (#    514:10  Single Ambig)
 &rst
  ixpk= 514, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 581, 582, 583, 585, 586, 587, 503, 504, 505, 507,
       508, 509,
 &end
#
#    0 AMB  10-2:515     38 SER  HN          5.50    (#    515:10  Single Ambig)
 &rst
  ixpk= 515, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 8.20, r4= 8.70,
 igr1= 543, 544, 545,1155,1156, 487, 488, 489, 491, 492,
       493,
 &end
#
#    0 AMB  10-2:516     38 SER  HN          4.50    (#    516:10  Single Ambig)
 &rst
  ixpk= 516, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 515, 562, 631,
 &end
#
#   38 SER  HA           38 SER  HN          2.80    (#    517:10  Unique         2.82, 2.87 A)
 &rst
  ixpk= 517, nxpk= 10, iat= 551, 549, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:518     38 SER  HN          2.80    (#    518:10  Single Ambig)
 &rst
  ixpk= 518, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 553, 554, 553, 554,
 &end
#
#   37 ILE  HA           38 SER  HN          4.50    (#    519:10  Unique         3.42, 3.49 A)
 &rst
  ixpk= 519, nxpk= 10, iat= 532, 549, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   36 HIS  HB+          38 SER  HN          4.50    (#    520:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 520, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
#   36 HIS  HB-          38 SER  HN          4.50    (#    521:10  Unique         2.21, 3.39 A)
 &rst
  ixpk= 521, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 517, 518,
 &end
#
#   37 ILE  QG2          38 SER  HN          2.80    (#    523:10  Unique         1.95, 3.00 A)
 &rst
  ixpk= 523, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 536, 537, 538,
 &end
#
#    9 SER  HA            9 SER  HN          2.80    (#    524:10  Unique         2.83, 2.90 A)
 &rst
  ixpk= 524, nxpk= 10, iat= 123, 121, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    8 GLY  HA+           9 SER  HN          3.50    (#    525:10  Unique         2.85, 3.24 A)
 &rst
  ixpk= 525, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 116, 117,
 &end
#
#    9 SER  HB+           9 SER  HN          2.80    (#    526:10  Unique         2.41, 3.15 A)
 &rst
  ixpk= 526, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 125, 126,
 &end
#
#    0 AMB  10-2:527      9 SER  HN          2.80    (#    527:10  Single Ambig)
 &rst
  ixpk= 527, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 125, 126, 116, 117,
 &end
#
#    7 VAL  HA            9 SER  HN          3.50    (#    528:10  Unique         3.19, 3.38 A)
 &rst
  ixpk= 528, nxpk= 10, iat= 100, 121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:529      9 SER  HN          4.50    (#    529:10  Single Ambig)
 &rst
  ixpk= 529, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1=  87,  88,  87,  88, 102,
 &end
#
#   62 VAL  MGY           9 SER  HN          3.50    (#    530:10  Unique         2.83, 5.89 A)
 &rst
  ixpk= 530, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   62 VAL  MGX           9 SER  HN          4.50    (#    531:10  Unique         2.83, 5.89 A)
 &rst
  ixpk= 531, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   62 VAL  HB            9 SER  HN          3.50    (#    532:10  Unique         3.49, 5.53 A)
 &rst
  ixpk= 532, nxpk= 10, iat= 919, 121, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   71 LYS  HA           71 LYS  HN          3.50    (#    533:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 533, nxpk= 10, iat=1049,1047, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:534     71 LYS  HN          2.80    (#    534:10  Single Ambig)
 &rst
  ixpk= 534, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1042,1043,1042,1043,
 &end
#
#   66 ASP  HB+          71 LYS  HN          3.50    (#    535:10  Unique         1.95, 2.78 A)
 &rst
  ixpk= 535, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 980, 981,
 &end
#
#   66 ASP  HB-          71 LYS  HN          3.50    (#    536:10  Unique         1.95, 2.78 A)
 &rst
  ixpk= 536, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 980, 981,
 &end
#
#   71 LYS  HB+          71 LYS  HN          3.50    (#    537:10  Unique         2.28, 2.89 A)
 &rst
  ixpk= 537, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1051,1052,
 &end
#
#   71 LYS  HB-          71 LYS  HN          3.50    (#    538:10  Unique         2.28, 2.89 A)
 &rst
  ixpk= 538, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1051,1052,
 &end
#
#   71 LYS  HG-          71 LYS  HN          4.50    (#    539:10  Unique         3.19, 4.35 A)
 &rst
  ixpk= 539, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1054,1055,
 &end
#
#    0 AMB  10-2:540     47 ASP  HN          3.50    (#    540:10  Single Ambig)
 &rst
  ixpk= 540, nxpk= 10, iat=  -1, 687, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 669, 670, 669, 670,
 &end
#
#    0 AMB  10-2:541      0 AMB  10-1:541    2.80    (#    541:10  Double Ambig)
 &rst
  ixpk= 541, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 689, 720,
 igr2= 687, 764,
 &end
#
#    0 AMB  10-2:542      0 AMB  10-1:542    2.80    (#    542:10  Double Ambig)
 &rst
  ixpk= 542, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 751, 752, 691, 692,
 igr2= 764, 687,
 &end
#
#   52 LEU  HB-          52 LEU  HN          3.50    (#    543:10  Unique         2.27, 3.13 A)
 &rst
  ixpk= 543, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 768, 769,
 &end
#
#   51 HIS  HB-          52 LEU  HN          4.50    (#    544:10  Unique         2.14, 2.95 A)
 &rst
  ixpk= 544, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 751, 752,
 &end
#
#   52 LEU  MDX          52 LEU  HN          4.50    (#    545:10  Unique         3.52, 4.82 A)
 &rst
  ixpk= 545, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 773, 774, 775, 777, 778, 779,
 &end
#
#   52 LEU  HB+          52 LEU  HN          2.80    (#    546:10  Unique         2.27, 3.13 A)
 &rst
  ixpk= 546, nxpk= 10, iat=  -1, 764, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 768, 769,
 &end
#
#    0 AMB  10-2:552     64 ALA  HN          2.80    (#    552:10  Single Ambig)
 &rst
  ixpk= 552, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 952, 933,
 &end
#
#   62 VAL  HA           64 ALA  HN          4.50    (#    553:10  Unique         3.60, 3.88 A)
 &rst
  ixpk= 553, nxpk= 10, iat= 917, 950, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 SER  HB+          64 ALA  HN          2.80    (#    554:10  Unique         2.92, 4.51 A)
 &rst
  ixpk= 554, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1092,1093,
 &end
#
#    0 AMB  10-2:555     64 ALA  HN          7.00    (#    555:10  Single Ambig)
 &rst
  ixpk= 555, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1=1103,1104, 897, 898,
 &end
#
#   64 ALA  MB           64 ALA  HN          2.80    (#    556:10  Unique         2.79, 3.46 A)
 &rst
  ixpk= 556, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 954, 955, 956,
 &end
#
#   62 VAL  MGY          64 ALA  HN          2.80    (#    557:10  Unique         2.02, 4.34 A)
 &rst
  ixpk= 557, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#    0 AMB  10-2:558     64 ALA  HN          2.80    (#    558:10  Single Ambig)
 &rst
  ixpk= 558, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 921, 922, 923, 925, 926, 927, 940, 941, 942, 944,
       945, 946,
 &end
#
#    7 VAL  MGX          64 ALA  HN          4.50    (#    559:10  Unique         3.08, 5.75 A)
 &rst
  ixpk= 559, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#   56 ASP  HB+          55 GLY  HN          4.50    (#    566:10  Unique         4.48, 5.13 A)
 &rst
  ixpk= 566, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 821, 822,
 &end
#
#   55 GLY  HA+          55 GLY  HN          2.80    (#    567:10  Unique         2.29, 2.59 A)
 &rst
  ixpk= 567, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 812, 813,
 &end
#
#   55 GLY  HA-          55 GLY  HN          2.80    (#    568:10  Unique         2.29, 2.59 A)
 &rst
  ixpk= 568, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 812, 813,
 &end
#
#   54 VAL  HA           55 GLY  HN          2.80    (#    569:10  Unique         2.17, 2.23 A)
 &rst
  ixpk= 569, nxpk= 10, iat= 796, 810, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  HB           55 GLY  HN          2.80    (#    570:10  Unique         2.03, 2.34 A)
 &rst
  ixpk= 570, nxpk= 10, iat= 216, 810, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:571     55 GLY  HN          5.50    (#    571:10  Single Ambig)
 &rst
  ixpk= 571, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 7.78, r4= 8.28,
 igr1= 234, 235, 236, 238, 253, 254, 197, 198,
 &end
#
#   15 VAL  MGY          55 GLY  HN          4.50    (#    572:10  Unique         2.72, 4.43 A)
 &rst
  ixpk= 572, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#    0 AMB  10-2:573     55 GLY  HN          2.80    (#    573:10  Single Ambig)
 &rst
  ixpk= 573, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 800, 801, 802, 804, 805, 806, 800, 801, 802, 804,
       805, 806,
 &end
#
#   54 VAL  HB           55 GLY  HN          4.50    (#    574:10  Unique         3.84, 3.98 A)
 &rst
  ixpk= 574, nxpk= 10, iat= 798, 810, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 GLY  HA+           8 GLY  HN          2.80    (#    581:10  Unique         2.33, 2.66 A)
 &rst
  ixpk= 581, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 116, 117,
 &end
#
#    8 GLY  HA-           8 GLY  HN          2.80    (#    582:10  Unique         2.33, 2.66 A)
 &rst
  ixpk= 582, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 116, 117,
 &end
#
#    7 VAL  HA            8 GLY  HN          2.80    (#    583:10  Unique         2.19, 2.24 A)
 &rst
  ixpk= 583, nxpk= 10, iat= 100, 114, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:584      8 GLY  HN          4.50    (#    584:10  Single Ambig)
 &rst
  ixpk= 584, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 906, 907, 906, 907,
 &end
#
#   62 VAL  HB            8 GLY  HN          2.80    (#    585:10  Unique         2.81, 4.83 A)
 &rst
  ixpk= 585, nxpk= 10, iat= 919, 114, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    7 VAL  HB            8 GLY  HN          4.50    (#    586:10  Unique         2.48, 3.23 A)
 &rst
  ixpk= 586, nxpk= 10, iat= 102, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:587      8 GLY  HN          5.50    (#    587:10  Single Ambig)
 &rst
  ixpk= 587, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 897, 898, 938,
 &end
#
#    7 VAL  MGX           8 GLY  HN          3.50    (#    588:10  Unique         2.02, 4.39 A)
 &rst
  ixpk= 588, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 104, 105, 106, 108, 109, 110,
 &end
#
#    0 AMB  10-2:589      8 GLY  HN          3.50    (#    589:10  Single Ambig)
 &rst
  ixpk= 589, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 104, 105, 106, 108, 109, 110, 921, 922, 923, 925,
       926, 927,
 &end
#
#   62 VAL  MGX           8 GLY  HN          3.50    (#    590:10  Unique         2.67, 5.01 A)
 &rst
  ixpk= 590, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 921, 922, 923, 925, 926, 927,
 &end
#
#   63 LEU  HA            8 GLY  HN          4.50    (#    591:10  Unique         2.81, 3.68 A)
 &rst
  ixpk= 591, nxpk= 10, iat= 933, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   12 THR  HB           12 THR  HN          2.80    (#    592:10  Unique         2.66, 2.83 A)
 &rst
  ixpk= 592, nxpk= 10, iat= 173, 169, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   11 TYR  HB+          12 THR  HN          2.80    (#    593:10  Unique         2.12, 3.33 A)
 &rst
  ixpk= 593, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 152, 153,
 &end
#
#   11 TYR  HB-          12 THR  HN          2.80    (#    594:10  Unique         2.12, 3.33 A)
 &rst
  ixpk= 594, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 152, 153,
 &end
#
#   12 THR  HG1          12 THR  HN          3.50    (#    595:10  Unique         2.32, 3.19 A)
 &rst
  ixpk= 595, nxpk= 10, iat= 179, 169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:596     12 THR  HN          4.50    (#    596:10  Single Ambig)
 &rst
  ixpk= 596, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 7.64, r4= 8.14,
 igr1= 883, 884, 885, 887, 888, 889, 138, 139, 140, 142,
       143, 144, 138, 139, 140, 142, 143, 144, 921, 922,
       923, 925, 926, 927,
 &end
#
#   27 LEU  MDY          12 THR  HN          4.50    (#    597:10  Unique         2.17, 5.60 A)
 &rst
  ixpk= 597, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  10-2:610     50 GLU  HN          5.50    (#    610:10  Single Ambig)
 &rst
  ixpk= 610, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.93, r4= 8.43,
 igr1= 712, 713, 714, 258, 259, 260, 262, 263, 264,
 &end
#
#   50 GLU  HG-          50 GLU  HN          2.80    (#    611:10  Unique         2.07, 2.92 A)
 &rst
  ixpk= 611, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 739, 740,
 &end
#
#    0 AMB  10-2:612     50 GLU  HN          3.50    (#    612:10  Single Ambig)
 &rst
  ixpk= 612, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 720, 689,
 &end
#
#   50 GLU  HA           50 GLU  HN          3.50    (#    613:10  Unique         2.77, 2.84 A)
 &rst
  ixpk= 613, nxpk= 10, iat= 734, 732, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ASN  HB+          50 GLU  HN          4.50    (#    615:10  Unique         2.46, 3.73 A)
 &rst
  ixpk= 615, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 722, 723,
 &end
#
#    0 AMB  10-2:616     50 GLU  HN          3.50    (#    616:10  Single Ambig)
 &rst
  ixpk= 616, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 691, 692, 722, 723,
 &end
#
#   50 GLU  HG+          50 GLU  HN          2.80    (#    617:10  Unique         2.07, 2.92 A)
 &rst
  ixpk= 617, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 739, 740,
 &end
#
#   50 GLU  HB+          50 GLU  HN          2.80    (#    618:10  Unique         2.13, 3.02 A)
 &rst
  ixpk= 618, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 736, 737,
 &end
#
#   50 GLU  HB-          50 GLU  HN          2.80    (#    619:10  Unique         2.13, 3.02 A)
 &rst
  ixpk= 619, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 736, 737,
 &end
#
#   48 ILE  QG2          50 GLU  HN          4.50    (#    620:10  Unique         4.31, 5.42 A)
 &rst
  ixpk= 620, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 705, 706, 707,
 &end
#
#   30 GLU  HA           30 GLU  HN          3.50    (#    626:10  Unique         2.91, 2.93 A)
 &rst
  ixpk= 626, nxpk= 10, iat= 427, 425, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   29 GLU  HA           30 GLU  HN          3.50    (#    627:10  Unique         2.82, 2.99 A)
 &rst
  ixpk= 627, nxpk= 10, iat= 412, 425, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HB           30 GLU  HN          4.50    (#    628:10  Unique         4.32, 4.52 A)
 &rst
  ixpk= 628, nxpk= 10, iat= 444, 425, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ASP  HB-          30 GLU  HN          4.50    (#    629:10  Unique         3.32, 3.96 A)
 &rst
  ixpk= 629, nxpk= 10, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 402, 403,
 &end
#
#    0 AMB  10-2:630     30 GLU  HN          3.50    (#    630:10  Single Ambig)
 &rst
  ixpk= 630, nxpk= 10, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 429, 430, 414, 415,
 &end
#
#   28 ASP  HA           30 GLU  HN          5.50    (#    631:10  Unique         4.22, 4.35 A)
 &rst
  ixpk= 631, nxpk= 10, iat= 400, 425, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:632     30 GLU  HN          2.80    (#    632:10  Single Ambig)
 &rst
  ixpk= 632, nxpk= 10, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 432, 433, 432, 433,
 &end
#
#    0 AMB  10-2:633     51 HIS  HN          4.50    (#    633:10  Single Ambig)
 &rst
  ixpk= 633, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 720, 689,
 &end
#
#   51 HIS  HA           51 HIS  HN          3.50    (#    634:10  Unique         2.88, 2.91 A)
 &rst
  ixpk= 634, nxpk= 10, iat= 749, 747, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   51 HIS  HB-          51 HIS  HN          3.50    (#    636:10  Unique         2.20, 2.81 A)
 &rst
  ixpk= 636, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 751, 752,
 &end
#
#   51 HIS  HB+          51 HIS  HN          2.80    (#    637:10  Unique         2.20, 2.81 A)
 &rst
  ixpk= 637, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 751, 752,
 &end
#
#   50 GLU  HB+          51 HIS  HN          4.50    (#    638:10  Unique         2.72, 3.59 A)
 &rst
  ixpk= 638, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 736, 737,
 &end
#
#   50 GLU  HB-          51 HIS  HN          4.50    (#    639:10  Unique         2.72, 3.59 A)
 &rst
  ixpk= 639, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 736, 737,
 &end
#
#    0 AMB  10-2:640     51 HIS  HN          4.50    (#    640:10  Single Ambig)
 &rst
  ixpk= 640, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 771, 581, 582, 583, 585, 586, 587, 712, 713, 714,
      
 &end
#
#   50 GLU  HA           51 HIS  HN          4.50    (#    641:10  Unique         3.43, 3.46 A)
 &rst
  ixpk= 641, nxpk= 10, iat= 734, 747, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 LEU  HB+          51 HIS  HN          4.50    (#    642:10  Unique         4.40, 5.46 A)
 &rst
  ixpk= 642, nxpk= 10, iat=  -1, 747, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 768, 769,
 &end
#
#    0 AMB  10-2:645     30 GLU  HN          4.50    (#    645:10  Single Ambig)
 &rst
  ixpk= 645, nxpk= 10, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 417, 418, 417, 418,
 &end
#
#    0 AMB  10-2:646     49 ASN  HD2-        4.50    (#    646:10  Single Ambig)
 &rst
  ixpk= 646, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 720, 689,
 igr2= 727, 728,
 &end
#
#   49 ASN  HB+          49 ASN  HD2-        2.80    (#    647:10  Unique         2.19, 3.40 A)
 &rst
  ixpk= 647, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 722, 723,
 igr2= 727, 728,
 &end
#
#    0 AMB  10-2:648     49 ASN  HD2-        2.80    (#    648:10  Single Ambig)
 &rst
  ixpk= 648, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1= 722, 723, 691, 692,
 igr2= 727, 728,
 &end
#
#   48 ILE  QG2          49 ASN  HD2-        4.50    (#    649:10  Unique         2.33, 3.98 A)
 &rst
  ixpk= 649, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 705, 706, 707,
 igr2= 727, 728,
 &end
#
#   31 THR  HB           28 ASP  HN          3.50    (#    650:10  Unique         3.52, 4.12 A)
 &rst
  ixpk= 650, nxpk= 10, iat= 444, 398, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  MDY          28 ASP  HN          4.50    (#    651:10  Unique         3.67, 5.22 A)
 &rst
  ixpk= 651, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   27 LEU  MDX          28 ASP  HN          4.50    (#    652:10  Unique         3.67, 5.22 A)
 &rst
  ixpk= 652, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   26 ALA  HA           28 ASP  HN          4.50    (#    653:10  Unique         4.20, 4.55 A)
 &rst
  ixpk= 653, nxpk= 10, iat= 371, 398, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ASP  HA           28 ASP  HN          3.50    (#    654:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 654, nxpk= 10, iat= 400, 398, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   27 LEU  HA           28 ASP  HN          3.50    (#    655:10  Unique         3.55, 3.57 A)
 &rst
  ixpk= 655, nxpk= 10, iat= 381, 398, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:656     28 ASP  HN          3.50    (#    656:10  Single Ambig)
 &rst
  ixpk= 656, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 402, 403, 402, 403,
 &end
#
#    0 AMB  10-2:657     28 ASP  HN          7.00    (#    657:10  Single Ambig)
 &rst
  ixpk= 657, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 8.82, r4= 9.32,
 igr1= 432, 433, 432, 433,
 &end
#
#   26 ALA  MB           28 ASP  HN          4.50    (#    658:10  Unique         4.11, 5.26 A)
 &rst
  ixpk= 658, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 373, 374, 375,
 &end
#
#    0 AMB  10-2:659     28 ASP  HN          4.50    (#    659:10  Single Ambig)
 &rst
  ixpk= 659, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 386, 450,
 &end
#
#   27 LEU  HB-          28 ASP  HN          2.80    (#    660:10  Unique         1.97, 2.66 A)
 &rst
  ixpk= 660, nxpk= 10, iat=  -1, 398, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 383, 384,
 &end
#
#    0 AMB  10-2:661      0 AMB  10-1:661    4.50    (#    661:10  Double Ambig)
 &rst
  ixpk= 661, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 720, 689,
 igr2= 727, 728, 727, 728,
 &end
#
#   49 ASN  HB+          49 ASN  HD2+        3.50    (#    662:10  Unique         2.19, 3.40 A)
 &rst
  ixpk= 662, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 722, 723,
 igr2= 727, 728,
 &end
#
#    0 AMB  10-2:663      0 AMB  10-1:663    4.50    (#    663:10  Double Ambig)
 &rst
  ixpk= 663, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 722, 723, 691, 692,
 igr2= 727, 728, 727, 728,
 &end
#
#   48 ILE  QG2          49 ASN  HD2+        4.50    (#    664:10  Unique         2.33, 3.98 A)
 &rst
  ixpk= 664, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 705, 706, 707,
 igr2= 727, 728,
 &end
#
#   69 LYS  HA           69 LYS  HN          3.50    (#    665:10  Unique         2.83, 2.89 A)
 &rst
  ixpk= 665, nxpk= 10, iat=1020,1018, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:666     69 LYS  HN          3.50    (#    666:10  Single Ambig)
 &rst
  ixpk= 666, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1005, 990,
 &end
#
#    0 AMB  10-2:667     69 LYS  HN          4.50    (#    667:10  Single Ambig)
 &rst
  ixpk= 667, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1042,1043,1042,1043,
 &end
#
#   66 ASP  HB+          69 LYS  HN          4.50    (#    668:10  Unique         2.39, 3.83 A)
 &rst
  ixpk= 668, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   66 ASP  HB-          69 LYS  HN          4.50    (#    669:10  Unique         2.39, 3.83 A)
 &rst
  ixpk= 669, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:670     69 LYS  HN          3.50    (#    670:10  Single Ambig)
 &rst
  ixpk= 670, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1007,1008,1007,1008,
 &end
#
#   69 LYS  HB+          69 LYS  HN          2.80    (#    671:10  Unique         2.18, 2.72 A)
 &rst
  ixpk= 671, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1022,1023,
 &end
#
#    0 AMB  10-2:672     69 LYS  HN          4.50    (#    672:10  Single Ambig)
 &rst
  ixpk= 672, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1028,1029,1028,1029,
 &end
#
#   69 LYS  HB-          69 LYS  HN          2.80    (#    673:10  Unique         2.18, 2.72 A)
 &rst
  ixpk= 673, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1=1022,1023,
 &end
#
#    0 AMB  10-2:674     69 LYS  HN          4.50    (#    674:10  Single Ambig)
 &rst
  ixpk= 674, nxpk= 10, iat=  -1,1018, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1025,1026,1025,1026,
 &end
#
#   28 ASP  HA           29 GLU  HN          2.80    (#    678:10  Unique         2.76, 2.89 A)
 &rst
  ixpk= 678, nxpk= 10, iat= 400, 410, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   29 GLU  HA           29 GLU  HN          2.80    (#    679:10  Unique         2.27, 2.28 A)
 &rst
  ixpk= 679, nxpk= 10, iat= 412, 410, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:680     29 GLU  HN          4.50    (#    680:10  Single Ambig)
 &rst
  ixpk= 680, nxpk= 10, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 402, 403, 185, 186,
 &end
#
#    0 AMB  10-2:681     29 GLU  HN          2.80    (#    681:10  Single Ambig)
 &rst
  ixpk= 681, nxpk= 10, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 417, 418, 417, 418,
 &end
#
#   29 GLU  HB+          29 GLU  HN          3.50    (#    682:10  Unique         2.93, 3.76 A)
 &rst
  ixpk= 682, nxpk= 10, iat=  -1, 410, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 414, 415,
 &end
#
#    0 AMB  10-2:691     13 GLY  HN          4.50    (#    691:10  Single Ambig)
 &rst
  ixpk= 691, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 836, 837, 864, 865,
 &end
#
#   12 THR  HB           13 GLY  HN          4.50    (#    692:10  Unique         3.32, 4.06 A)
 &rst
  ixpk= 692, nxpk= 10, iat= 173, 183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 GLY  HA-          13 GLY  HN          2.80    (#    693:10  Unique         2.51, 2.78 A)
 &rst
  ixpk= 693, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 185, 186,
 &end
#
#   57 GLU  HG+          13 GLY  HN          4.50    (#    694:10  Unique         3.02, 4.27 A)
 &rst
  ixpk= 694, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 836, 837,
 &end
#
#   12 THR  MG2          13 GLY  HN          2.80    (#    695:10  Unique         2.03, 3.65 A)
 &rst
  ixpk= 695, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 175, 176, 177,
 &end
#
#    0 AMB  10-2:696     13 GLY  HN          3.50    (#    696:10  Single Ambig)
 &rst
  ixpk= 696, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 883, 884, 885, 887, 888, 889, 138, 139, 140, 142,
       143, 144,
 &end
#
#   58 VAL  MGX          13 GLY  HN          3.50    (#    697:10  Unique         3.53, 6.32 A)
 &rst
  ixpk= 697, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   25 VAL  MGY          13 GLY  HN          4.50    (#    698:10  Unique         2.51, 5.58 A)
 &rst
  ixpk= 698, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   27 LEU  MDY          13 GLY  HN          4.50    (#    699:10  Unique         3.56, 6.59 A)
 &rst
  ixpk= 699, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   56 ASP  HB-          53 SER  HN          5.50    (#    701:10  Unique         3.67, 4.24 A)
 &rst
  ixpk= 701, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 821, 822,
 &end
#
#    0 AMB  10-2:702     53 SER  HN          4.50    (#    702:10  Single Ambig)
 &rst
  ixpk= 702, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 6.90, r4= 7.40,
 igr1= 771, 359, 360, 361, 363, 364, 365, 581, 582, 583,
       585, 586, 587,
 &end
#
#    0 AMB  10-2:703     53 SER  HN          3.50    (#    703:10  Single Ambig)
 &rst
  ixpk= 703, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 850, 851, 852, 854, 855, 856, 258, 259, 260, 262,
       263, 264,
 &end
#
#   52 LEU  HB+          53 SER  HN          2.80    (#    708:10  Unique         2.27, 3.31 A)
 &rst
  ixpk= 708, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 768, 769,
 &end
#
#   52 LEU  MDX          53 SER  HN          2.80    (#    709:10  Unique         2.95, 5.04 A)
 &rst
  ixpk= 709, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 773, 774, 775, 777, 778, 779,
 &end
#
#   53 SER  HA           53 SER  HN          3.50    (#    710:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 710, nxpk= 10, iat= 785, 783, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   53 SER  HB+          53 SER  HN          3.50    (#    711:10  Unique         2.34, 3.09 A)
 &rst
  ixpk= 711, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 787, 788,
 &end
#
#   53 SER  HB-          53 SER  HN          2.80    (#    712:10  Unique         2.34, 3.09 A)
 &rst
  ixpk= 712, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 787, 788,
 &end
#
#   56 ASP  HB+          53 SER  HN          4.50    (#    713:10  Unique         3.67, 4.24 A)
 &rst
  ixpk= 713, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 821, 822,
 &end
#
#   52 LEU  HB-          53 SER  HN          2.80    (#    714:10  Unique         2.27, 3.31 A)
 &rst
  ixpk= 714, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 768, 769,
 &end
#
#   19 GLN  HA           19 GLN  HE2+        5.50    (#    740:10  Unique         2.78, 4.64 A)
 &rst
  ixpk= 740, nxpk= 10, iat= 270,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 280, 281,
 &end
#
#   19 GLN  HG-          19 GLN  HE2+        4.50    (#    741:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 741, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 275, 276,
 igr2= 280, 281,
 &end
#
#   19 GLN  HG+          19 GLN  HE2+        3.50    (#    742:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 742, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 275, 276,
 igr2= 280, 281,
 &end
#
#   19 GLN  HG-          19 GLN  HE2-        5.50    (#    743:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 743, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 275, 276,
 igr2= 280, 281,
 &end
#
#   19 GLN  HG+          19 GLN  HE2-        4.50    (#    744:10  Unique         2.12, 3.21 A)
 &rst
  ixpk= 744, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 275, 276,
 igr2= 280, 281,
 &end
#
#    0 AMB  10-2:745      0 AMB  10-1:745    4.50    (#    745:10  Double Ambig)
 &rst
  ixpk= 745, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1=1200,1201,1200,1201,
 igr2=1208,1209,1208,1209,
 &end
#
#   76 ILE  QG2          80 GLN  HE2+        3.50    (#    746:10  Unique         1.99, 4.07 A)
 &rst
  ixpk= 746, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1=1135,1136,1137,
 igr2=1208,1209,
 &end
#
#    0 AMB  10-2:747      0 AMB  10-1:747    2.80    (#    747:10  Double Ambig)
 &rst
  ixpk= 747, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1=1203,1204,1203,1204,
 igr2=1208,1209,1208,1209,
 &end
#
#    0 AMB  10-2:748     80 GLN  HE2-        3.50    (#    748:10  Single Ambig)
 &rst
  ixpk= 748, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.95, r4= 5.45,
 igr1=1203,1204,1203,1204,
 igr2=1208,1209,
 &end
#
#   76 ILE  QG2          80 GLN  HE2-        4.50    (#    749:10  Unique         1.99, 4.07 A)
 &rst
  ixpk= 749, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1135,1136,1137,
 igr2=1208,1209,
 &end
#
#   63 LEU  MDX          75 SER  HN          4.50    (#    750:10  Unique         2.05, 4.62 A)
 &rst
  ixpk= 750, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 940, 941, 942, 944, 945, 946,
 &end
#
#   62 VAL  HA           75 SER  HN          5.50    (#    751:10  Unique         3.49, 3.83 A)
 &rst
  ixpk= 751, nxpk= 10, iat= 917,1118, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 SER  HB+          75 SER  HN          3.50    (#    752:10  Unique         2.42, 3.24 A)
 &rst
  ixpk= 752, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1122,1123,
 &end
#
#   75 SER  HB-          75 SER  HN          3.50    (#    753:10  Unique         2.42, 3.24 A)
 &rst
  ixpk= 753, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1122,1123,
 &end
#
#    0 AMB  10-2:754     75 SER  HN          4.50    (#    754:10  Single Ambig)
 &rst
  ixpk= 754, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 5.88, r4= 6.38,
 igr1= 881,1139,1140,1139,1140,
 &end
#
#    0 AMB  10-2:755     75 SER  HN          2.80    (#    755:10  Single Ambig)
 &rst
  ixpk= 755, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1103,1104, 897, 898,
 &end
#
#    0 AMB  10-2:756     75 SER  HN          4.50    (#    756:10  Single Ambig)
 &rst
  ixpk= 756, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 938, 897, 898,1176,1177,1178,
 &end
#
#    0 AMB  10-2:757     75 SER  HN          2.80    (#    757:10  Single Ambig)
 &rst
  ixpk= 757, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 900, 901,1103,1104,
 &end
#
#    0 AMB  10-2:758     75 SER  HN          4.50    (#    758:10  Single Ambig)
 &rst
  ixpk= 758, nxpk= 10, iat=  -1,1118, r1= 1.30, r2= 1.80, r3= 6.71, r4= 7.21,
 igr1=1142,1143,1144, 921, 922, 923, 925, 926, 927,1155,
      1156,
 &end
#
#    0 AMB  10-2:759      0 AMB  10-1:759    2.80    (#    759:10  Double Ambig)
 &rst
  ixpk= 759, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.44, r4= 4.94,
 igr1= 461, 462, 461, 462,
 igr2= 466, 467, 466, 467,
 &end
#
#   26 ALA  MB           32 GLN  HE2+        4.50    (#    760:10  Unique         1.95, 5.00 A)
 &rst
  ixpk= 760, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 373, 374, 375,
 igr2= 466, 467,
 &end
#
#    0 AMB  10-2:761      0 AMB  10-1:761    4.50    (#    761:10  Double Ambig)
 &rst
  ixpk= 761, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 7.14, r4= 7.64,
 igr1= 234, 235, 236, 238,
 igr2= 466, 467, 466, 467,
 &end
#
#    0 AMB  10-2:762     32 GLN  HE2-        4.50    (#    762:10  Single Ambig)
 &rst
  ixpk= 762, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 234, 235, 236, 238,
 igr2= 466, 467,
 &end
#
#    0 AMB  10-2:763     32 GLN  HE2-        4.50    (#    763:10  Single Ambig)
 &rst
  ixpk= 763, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 461, 462, 461, 462,
 igr2= 466, 467,
 &end
#
#   59 GLN  HG+          60 VAL  HN          4.50    (#    764:10  Unique         3.80, 4.65 A)
 &rst
  ixpk= 764, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 867, 868,
 &end
#
#   59 GLN  HG-          60 VAL  HN          4.50    (#    765:10  Unique         3.80, 4.65 A)
 &rst
  ixpk= 765, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 867, 868,
 &end
#
#   59 GLN  HB-          60 VAL  HN          4.50    (#    766:10  Unique         2.39, 3.66 A)
 &rst
  ixpk= 766, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 864, 865,
 &end
#
#   59 GLN  HB+          60 VAL  HN          5.50    (#    767:10  Unique         2.39, 3.66 A)
 &rst
  ixpk= 767, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 864, 865,
 &end
#
#    0 AMB  10-2:768     60 VAL  HN          3.50    (#    768:10  Single Ambig)
 &rst
  ixpk= 768, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 4.58, r4= 5.08,
 igr1=1188,1189,1190, 900, 901,
 &end
#
#   27 LEU  MDY          60 VAL  HN          4.50    (#    769:10  Unique         5.43, 7.71 A)
 &rst
  ixpk= 769, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#    0 AMB  10-2:770     60 VAL  HN          2.80    (#    770:10  Single Ambig)
 &rst
  ixpk= 770, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 4.53, r4= 5.03,
 igr1= 883, 884, 885, 887, 888, 889, 138, 139, 140, 142,
       143, 144, 138, 139, 140, 142, 143, 144,
 &end
#
#   69 LYS  HA           70 GLY  HN          3.50    (#    771:10  Unique         3.46, 3.50 A)
 &rst
  ixpk= 771, nxpk= 10, iat=1020,1040, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:772     70 GLY  HN          2.80    (#    772:10  Single Ambig)
 &rst
  ixpk= 772, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 990,1005,
 &end
#
#    0 AMB  10-2:773     70 GLY  HN          2.80    (#    773:10  Single Ambig)
 &rst
  ixpk= 773, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1042,1043,1042,1043,
 &end
#
#   66 ASP  HB+          70 GLY  HN          4.50    (#    774:10  Unique         2.21, 3.49 A)
 &rst
  ixpk= 774, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#    0 AMB  10-2:775     70 GLY  HN          4.50    (#    775:10  Single Ambig)
 &rst
  ixpk= 775, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1007,1008,1007,1008,
 &end
#
#   69 LYS  HB+          70 GLY  HN          4.50    (#    776:10  Unique         2.69, 3.27 A)
 &rst
  ixpk= 776, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1022,1023,
 &end
#
#   69 LYS  HB-          70 GLY  HN          3.50    (#    778:10  Unique         2.69, 3.27 A)
 &rst
  ixpk= 778, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1022,1023,
 &end
#
#    0 AMB  10-2:779     70 GLY  HN          4.50    (#    779:10  Single Ambig)
 &rst
  ixpk= 779, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1025,1026,1025,1026,1054,1055,
 &end
#
#   42 HIS  HB-          43 GLY  HN          4.50    (#    780:10  Unique         2.28, 3.66 A)
 &rst
  ixpk= 780, nxpk= 10, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 609, 610,
 &end
#
#   42 HIS  HA           43 GLY  HN          3.50    (#    781:10  Unique         2.28, 3.34 A)
 &rst
  ixpk= 781, nxpk= 10, iat= 607, 622, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:782     43 GLY  HN          2.80    (#    782:10  Single Ambig)
 &rst
  ixpk= 782, nxpk= 10, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 624, 625, 624, 625,
 &end
#
#   42 HIS  HB+          43 GLY  HN          4.50    (#    783:10  Unique         2.28, 3.66 A)
 &rst
  ixpk= 783, nxpk= 10, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 609, 610,
 &end
#
#    0 AMB  10-2:784     43 GLY  HN          4.50    (#    784:10  Single Ambig)
 &rst
  ixpk= 784, nxpk= 10, iat=  -1, 622, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 601, 597, 598, 599,
 &end
#
#   45 VAL  MGX          41 THR  HN          5.50    (#    786:10  Unique         4.16, 6.44 A)
 &rst
  ixpk= 786, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#   40 VAL  HA           41 THR  HN          4.50    (#    787:10  Unique         3.43, 3.46 A)
 &rst
  ixpk= 787, nxpk= 10, iat= 577, 591, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   40 VAL  HB           41 THR  HN          4.50    (#    788:10  Unique         2.66, 2.97 A)
 &rst
  ixpk= 788, nxpk= 10, iat= 579, 591, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 ARG  HB+          41 THR  HN          4.50    (#    789:10  Unique         2.92, 3.92 A)
 &rst
  ixpk= 789, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1152,1153,
 &end
#
#    0 AMB  10-2:790     41 THR  HN          3.50    (#    790:10  Single Ambig)
 &rst
  ixpk= 790, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 581, 582, 583, 585, 586, 587, 712, 713, 714,
 &end
#
#    0 AMB  10-2:791     41 THR  HN          3.50    (#    791:10  Single Ambig)
 &rst
  ixpk= 791, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 597, 598, 599, 601,
 &end
#
#    0 AMB  10-2:793     41 THR  HN          3.50    (#    793:10  Single Ambig)
 &rst
  ixpk= 793, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 593, 551,
 &end
#
#   41 THR  HB           41 THR  HN          4.50    (#    794:10  Unique         3.17, 3.47 A)
 &rst
  ixpk= 794, nxpk= 10, iat= 595, 591, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:795     41 THR  HN          3.50    (#    795:10  Single Ambig)
 &rst
  ixpk= 795, nxpk= 10, iat=  -1, 591, r1= 1.30, r2= 1.80, r3= 5.14, r4= 5.64,
 igr1=1152,1153,1155,1156, 581, 582, 583, 585, 586, 587,
      
 &end
#
#    0 AMB  10-2:796     22 GLY  HN          3.50    (#    796:10  Single Ambig)
 &rst
  ixpk= 796, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 297, 270,
 &end
#
#   20 ALA  HA           22 GLY  HN          4.50    (#    797:10  Unique         3.83, 4.21 A)
 &rst
  ixpk= 797, nxpk= 10, iat= 287, 316, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLY  HA-          22 GLY  HN          2.80    (#    798:10  Unique         2.48, 2.79 A)
 &rst
  ixpk= 798, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 318, 319,
 &end
#
#    0 AMB  10-2:799     22 GLY  HN          4.50    (#    799:10  Single Ambig)
 &rst
  ixpk= 799, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 289, 290, 291, 256, 709, 710, 709, 710,
 &end
#
#   37 ILE  HB           22 GLY  HN          4.50    (#    800:10  Unique         2.51, 4.06 A)
 &rst
  ixpk= 800, nxpk= 10, iat= 534, 316, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   19 GLN  HB-          22 GLY  HN          3.50    (#    801:10  Unique         2.14, 3.15 A)
 &rst
  ixpk= 801, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 272, 273,
 &end
#
#    0 AMB  10-2:802     22 GLY  HN          4.50    (#    802:10  Single Ambig)
 &rst
  ixpk= 802, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 543, 544, 545, 705, 706, 707,
 &end
#
#    0 AMB  10-2:803     22 GLY  HN          2.80    (#    803:10  Single Ambig)
 &rst
  ixpk= 803, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.77, r4= 4.27,
 igr1= 712, 713, 714, 536, 537, 538,
 &end
#
#   22 GLY  HA+          22 GLY  HN          3.50    (#    804:10  Unique         2.48, 2.79 A)
 &rst
  ixpk= 804, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 318, 319,
 &end
#
#   19 GLN  HB+          22 GLY  HN          4.50    (#    805:10  Unique         2.14, 3.15 A)
 &rst
  ixpk= 805, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 272, 273,
 &end
#
#   25 VAL  MGX          17 GLY  HN          4.50    (#    806:10  Unique         4.37, 6.84 A)
 &rst
  ixpk= 806, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   15 VAL  HA           17 GLY  HN          4.50    (#    807:10  Unique         3.63, 3.92 A)
 &rst
  ixpk= 807, nxpk= 10, iat= 214, 242, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 PHE  HB+          17 GLY  HN          4.50    (#    808:10  Unique         2.70, 3.64 A)
 &rst
  ixpk= 808, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 337, 338,
 &end
#
#    0 AMB  10-2:809     17 GLY  HN          5.50    (#    809:10  Single Ambig)
 &rst
  ixpk= 809, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1= 256, 373, 374, 375,
 &end
#
#   15 VAL  MGY          17 GLY  HN          3.50    (#    810:10  Unique         2.03, 4.49 A)
 &rst
  ixpk= 810, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 218, 219, 220, 222, 223, 224,
 &end
#
#   16 THR  HA           17 GLY  HN          4.50    (#    811:10  Unique         3.47, 3.50 A)
 &rst
  ixpk= 811, nxpk= 10, iat= 230, 242, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   17 GLY  HA+          17 GLY  HN          2.80    (#    812:10  Unique         2.62, 2.80 A)
 &rst
  ixpk= 812, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 244, 245,
 &end
#
#   17 GLY  HA-          17 GLY  HN          2.80    (#    813:10  Unique         2.62, 2.80 A)
 &rst
  ixpk= 813, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 244, 245,
 &end
#
#   24 PHE  HB-          17 GLY  HN          3.50    (#    814:10  Unique         2.70, 3.64 A)
 &rst
  ixpk= 814, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 337, 338,
 &end
#
#    0 AMB  10-2:815     17 GLY  HN          4.50    (#    815:10  Single Ambig)
 &rst
  ixpk= 815, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 234, 235, 236, 238,
 &end
#
#    0 AMB  10-2:816     17 GLY  HN          2.80    (#    816:10  Single Ambig)
 &rst
  ixpk= 816, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806,
 &end
#
#   33 GLY  HA+          33 GLY  HN          4.50    (#    817:10  Unique         2.29, 2.60 A)
 &rst
  ixpk= 817, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 473, 474,
 &end
#
#   25 VAL  MGY          33 GLY  HN          4.50    (#    818:10  Unique         4.12, 5.65 A)
 &rst
  ixpk= 818, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 359, 360, 361, 363, 364, 365,
 &end
#
#   26 ALA  HA           33 GLY  HN          4.50    (#    819:10  Unique         3.47, 3.63 A)
 &rst
  ixpk= 819, nxpk= 10, iat= 371, 471, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   33 GLY  HA-          33 GLY  HN          2.80    (#    820:10  Unique         2.29, 2.60 A)
 &rst
  ixpk= 820, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 473, 474,
 &end
#
#    0 AMB  10-2:821     33 GLY  HN          3.50    (#    821:10  Single Ambig)
 &rst
  ixpk= 821, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1= 461, 462, 461, 462,
 &end
#
#   32 GLN  HB-          33 GLY  HN          4.50    (#    822:10  Unique         3.12, 3.79 A)
 &rst
  ixpk= 822, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 458, 459,
 &end
#
#   25 VAL  HB           33 GLY  HN          4.50    (#    823:10  Unique         3.10, 3.62 A)
 &rst
  ixpk= 823, nxpk= 10, iat= 357, 471, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HG           33 GLY  HN          4.50    (#    824:10  Unique         2.62, 3.56 A)
 &rst
  ixpk= 824, nxpk= 10, iat= 386, 471, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:825     33 GLY  HN          3.50    (#    825:10  Single Ambig)
 &rst
  ixpk= 825, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,
 igr1=1108,1109,1110,1112,1113,1114,1075,1076,1077, 883,
       884, 885, 887, 888, 889,
 &end
#
#    0 AMB  10-2:826     33 GLY  HN          2.80    (#    826:10  Single Ambig)
 &rst
  ixpk= 826, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 3.96, r4= 4.46,
 igr1=1108,1109,1110,1112,1113,1114, 383, 384,
 &end
#
#   27 LEU  MDX          33 GLY  HN          4.50    (#    827:10  Unique         2.67, 5.14 A)
 &rst
  ixpk= 827, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 388, 389, 390, 392, 393, 394,
 &end
#
#   80 GLN  HA           79 THR  HN          5.50    (#    828:10  Unique         4.66, 5.03 A)
 &rst
  ixpk= 828, nxpk= 10, iat=1198,1182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   77 ARG  HA           79 THR  HN          4.50    (#    829:10  Unique         3.81, 4.19 A)
 &rst
  ixpk= 829, nxpk= 10, iat=1150,1182, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:830     79 THR  HN          4.50    (#    830:10  Single Ambig)
 &rst
  ixpk= 830, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1200,1201,1200,1201,
 &end
#
#    0 AMB  10-2:831     79 THR  HN          4.50    (#    831:10  Single Ambig)
 &rst
  ixpk= 831, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1192, 900, 901,
 &end
#
#   76 ILE  HA           79 THR  HN          5.50    (#    832:10  Unique         3.03, 3.32 A)
 &rst
  ixpk= 832, nxpk= 10, iat=1131,1182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:833     79 THR  HN          3.50    (#    833:10  Single Ambig)
 &rst
  ixpk= 833, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1184,1174,
 &end
#
#    0 AMB  10-2:834     79 THR  HN          4.50    (#    834:10  Single Ambig)
 &rst
  ixpk= 834, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1203,1204,1203,1204,
 &end
#
#   78 ALA  MB           79 THR  HN          3.50    (#    835:10  Unique         2.59, 3.58 A)
 &rst
  ixpk= 835, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1=1176,1177,1178,
 &end
#
#    0 AMB  10-2:838     21 TYR  HN          3.50    (#    838:10  Single Ambig)
 &rst
  ixpk= 838, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 297, 270,
 &end
#
#   20 ALA  HA           21 TYR  HN          4.50    (#    839:10  Unique         3.13, 3.37 A)
 &rst
  ixpk= 839, nxpk= 10, iat= 287, 295, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   21 TYR  HB+          21 TYR  HN          4.50    (#    840:10  Unique         2.23, 3.10 A)
 &rst
  ixpk= 840, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#   21 TYR  HB-          21 TYR  HN          4.50    (#    841:10  Unique         2.23, 3.10 A)
 &rst
  ixpk= 841, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#   19 GLN  HB+          21 TYR  HN          3.50    (#    842:10  Unique         2.14, 2.90 A)
 &rst
  ixpk= 842, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 272, 273,
 &end
#
#   20 ALA  MB           21 TYR  HN          3.50    (#    843:10  Unique         2.52, 3.86 A)
 &rst
  ixpk= 843, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 289, 290, 291,
 &end
#
#   19 GLN  HB-          21 TYR  HN          4.50    (#    844:10  Unique         2.14, 2.90 A)
 &rst
  ixpk= 844, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 272, 273,
 &end
#
#   32 GLN  HA           26 ALA  HN          5.50    (#    857:10  Unique         4.37, 4.75 A)
 &rst
  ixpk= 857, nxpk= 10, iat= 456, 369, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:858      0 AMB  10-1:858    4.50    (#    858:10  Double Ambig)
 &rst
  ixpk= 858, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 513, 212,
 igr2= 497, 369,
 &end
#
#   14 LYS  HN           26 ALA  HN          3.50    (#    859:10  Unique         2.21, 2.92 A)
 &rst
  ixpk= 859, nxpk= 10, iat= 190, 369, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:860     63 LEU  HN          4.50    (#    860:10  Single Ambig)
 &rst
  ixpk= 860, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1118,1088,
 &end
#
#   62 VAL  HN           63 LEU  HN          4.50    (#    861:10  Unique         4.14, 4.48 A)
 &rst
  ixpk= 861, nxpk= 10, iat= 915, 931, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   64 ALA  HN           63 LEU  HN          2.80    (#    862:10  Unique         1.95, 2.20 A)
 &rst
  ixpk= 862, nxpk= 10, iat= 950, 931, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   74 LEU  HA           63 LEU  HN          3.50    (#    863:10  Unique         2.85, 3.13 A)
 &rst
  ixpk= 863, nxpk= 10, iat=1101, 931, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:864     35 VAL  HN          4.50    (#    864:10  Single Ambig)
 &rst
  ixpk= 864, nxpk= 10, iat=  -1, 497, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353, 471,
 &end
#
#   49 ASN  HN           48 ILE  HN          3.50    (#    865:10  Unique         2.19, 2.35 A)
 &rst
  ixpk= 865, nxpk= 10, iat= 718, 699, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   78 ALA  HN           76 ILE  HN          4.50    (#    866:10  Unique         3.78, 4.00 A)
 &rst
  ixpk= 866, nxpk= 10, iat=1172,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 ARG  HN           76 ILE  HN          2.80    (#    867:10  Unique         2.14, 2.36 A)
 &rst
  ixpk= 867, nxpk= 10, iat=1148,1129, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 SER  HA           76 ILE  HN          2.80    (#    868:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 868, nxpk= 10, iat=1120,1129, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   23 ALA  HN           35 VAL  HN          3.50    (#    870:10  Unique         2.91, 3.49 A)
 &rst
  ixpk= 870, nxpk= 10, iat= 323, 497, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 LEU  HA           35 VAL  HN          2.80    (#    871:10  Unique         2.16, 2.20 A)
 &rst
  ixpk= 871, nxpk= 10, iat= 480, 497, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   34 LEU  HN           35 VAL  HN          4.50    (#    872:10  Unique         4.22, 4.30 A)
 &rst
  ixpk= 872, nxpk= 10, iat= 478, 497, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 PHE  HA           35 VAL  HN          4.50    (#    873:10  Unique         3.23, 3.73 A)
 &rst
  ixpk= 873, nxpk= 10, iat= 335, 497, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 PHE  HD           45 VAL  HN          5.50    (#    876:10  Unique         2.41, 4.70 A)
 &rst
  ixpk= 876, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 637, 645,
 &end
#
#   35 VAL  HN           36 HIS  HN          4.50    (#    877:10  Unique         3.81, 4.09 A)
 &rst
  ixpk= 877, nxpk= 10, iat= 497, 513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:878     36 HIS  HN          4.50    (#    878:10  Single Ambig)
 &rst
  ixpk= 878, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1099, 560,
 &end
#
#   37 ILE  HN           36 HIS  HN          4.50    (#    879:10  Unique         4.57, 4.62 A)
 &rst
  ixpk= 879, nxpk= 10, iat= 530, 513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 SER  HA           36 HIS  HN          4.50    (#    881:10  Unique         4.54, 5.24 A)
 &rst
  ixpk= 881, nxpk= 10, iat=1120, 513, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           32 GLN  HN          4.50    (#    883:10  Unique         4.32, 4.83 A)
 &rst
  ixpk= 883, nxpk= 10, iat= 379, 454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 THR  HN           32 GLN  HN          4.50    (#    884:10  Unique         3.61, 3.86 A)
 &rst
  ixpk= 884, nxpk= 10, iat= 440, 454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   32 GLN  HA           32 GLN  HN          3.50    (#    885:10  Unique         2.90, 2.91 A)
 &rst
  ixpk= 885, nxpk= 10, iat= 456, 454, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:886     27 LEU  HN          4.50    (#    886:10  Single Ambig)
 &rst
  ixpk= 886, nxpk= 10, iat=  -1, 379, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 471, 454,
 &end
#
#   28 ASP  HN           27 LEU  HN          2.80    (#    887:10  Unique         2.08, 2.54 A)
 &rst
  ixpk= 887, nxpk= 10, iat= 398, 379, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   32 GLN  HA           27 LEU  HN          4.50    (#    888:10  Unique         2.38, 3.02 A)
 &rst
  ixpk= 888, nxpk= 10, iat= 456, 379, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   26 ALA  HN           27 LEU  HN          4.50    (#    889:10  Unique         4.40, 4.47 A)
 &rst
  ixpk= 889, nxpk= 10, iat= 369, 379, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 LEU  HN           72 ILE  HN          4.50    (#    894:10  Unique         4.11, 4.65 A)
 &rst
  ixpk= 894, nxpk= 10, iat= 478,1069, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   71 LYS  HN           72 ILE  HN          4.50    (#    895:10  Unique         4.23, 4.45 A)
 &rst
  ixpk= 895, nxpk= 10, iat=1047,1069, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   34 LEU  HA           72 ILE  HN          7.00    (#    896:10  Unique         6.21, 6.83 A)
 &rst
  ixpk= 896, nxpk= 10, iat= 480,1069, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   80 GLN  HN           81 ALA  HN          4.50    (#    898:10  Unique         2.17, 3.73 A)
 &rst
  ixpk= 898, nxpk= 10, iat=1196,1213, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   35 VAL  HN           37 ILE  HN          7.00    (#    900:10  Unique         6.07, 6.51 A)
 &rst
  ixpk= 900, nxpk= 10, iat= 497, 530, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:902     66 ASP  HN          4.50    (#    902:10  Single Ambig)
 &rst
  ixpk= 902, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1088,1069,
 &end
#
#   71 LYS  HN           66 ASP  HN          3.50    (#    903:10  Unique         3.09, 3.37 A)
 &rst
  ixpk= 903, nxpk= 10, iat=1047, 976, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   67 GLU  HN           66 ASP  HN          4.50    (#    904:10  Unique         4.13, 4.25 A)
 &rst
  ixpk= 904, nxpk= 10, iat= 988, 976, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HN           62 VAL  HN          4.50    (#    905:10  Unique         3.21, 4.22 A)
 &rst
  ixpk= 905, nxpk= 10, iat= 148, 915, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 SER  HN           62 VAL  HN          4.50    (#    906:10  Unique         3.93, 4.39 A)
 &rst
  ixpk= 906, nxpk= 10, iat= 121, 915, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PHE  HD           62 VAL  HN          5.50    (#    908:10  Unique         5.33, 7.87 A)
 &rst
  ixpk= 908, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  71,  79,
 &end
#
#   61 LYS  HA           62 VAL  HN          2.80    (#    909:10  Unique         2.14, 2.25 A)
 &rst
  ixpk= 909, nxpk= 10, iat= 895, 915, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    8 GLY  HN           62 VAL  HN          4.50    (#    910:10  Unique         3.35, 3.91 A)
 &rst
  ixpk= 910, nxpk= 10, iat= 114, 915, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:913     37 ILE  HN          4.50    (#    913:10  Single Ambig)
 &rst
  ixpk= 913, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 560, 323,
 &end
#
#   36 HIS  HN           37 ILE  HN          4.50    (#    914:10  Unique         4.57, 4.62 A)
 &rst
  ixpk= 914, nxpk= 10, iat= 513, 530, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   38 SER  HN           37 ILE  HN          4.50    (#    915:10  Unique         2.57, 2.68 A)
 &rst
  ixpk= 915, nxpk= 10, iat= 549, 530, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLY  HN           37 ILE  HN          5.50    (#    916:10  Unique         4.11, 4.82 A)
 &rst
  ixpk= 916, nxpk= 10, iat= 316, 530, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:917     67 GLU  HN          4.50    (#    917:10  Single Ambig)
 &rst
  ixpk= 917, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 976, 960,
 &end
#
#   39 GLU  HN           40 VAL  HN          2.80    (#    918:10  Unique         2.24, 2.38 A)
 &rst
  ixpk= 918, nxpk= 10, iat= 560, 575, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:920     15 VAL  HN          4.50    (#    920:10  Single Ambig)
 &rst
  ixpk= 920, nxpk= 10, iat=  -1, 212, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 228, 369,
 &end
#
#   68 GLU  HN           67 GLU  HN          3.50    (#    922:10  Unique         2.26, 2.39 A)
 &rst
  ixpk= 922, nxpk= 10, iat=1003, 988, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 VAL  HN           15 VAL  HN          5.50    (#    924:10  Unique         3.20, 3.44 A)
 &rst
  ixpk= 924, nxpk= 10, iat= 844, 212, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   56 ASP  HN           15 VAL  HN          4.50    (#    925:10  Unique         2.92, 3.19 A)
 &rst
  ixpk= 925, nxpk= 10, iat= 817, 212, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 LYS  HN           15 VAL  HN          4.50    (#    926:10  Unique         4.13, 4.36 A)
 &rst
  ixpk= 926, nxpk= 10, iat= 190, 212, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 LYS  HA           15 VAL  HN          2.80    (#    927:10  Unique         2.14, 2.20 A)
 &rst
  ixpk= 927, nxpk= 10, iat= 192, 212, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   57 GLU  HA           15 VAL  HN          3.50    (#    928:10  Unique         3.34, 3.57 A)
 &rst
  ixpk= 928, nxpk= 10, iat= 831, 212, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 VAL  HN           11 TYR  HN          4.50    (#    929:10  Unique         3.92, 4.24 A)
 &rst
  ixpk= 929, nxpk= 10, iat= 132, 148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 SER  HA           74 LEU  HN          2.80    (#    930:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 930, nxpk= 10, iat=1090,1099, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:931     74 LEU  HN          4.50    (#    931:10  Single Ambig)
 &rst
  ixpk= 931, nxpk= 10, iat=  -1,1099, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1118,1069,
 &end
#
#   74 LEU  HA           74 LEU  HN          3.50    (#    932:10  Unique         2.94, 2.94 A)
 &rst
  ixpk= 932, nxpk= 10, iat=1101,1099, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   12 THR  HN           11 TYR  HN          4.50    (#    933:10  Unique         4.45, 4.56 A)
 &rst
  ixpk= 933, nxpk= 10, iat= 169, 148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 VAL  HN           11 TYR  HN          4.50    (#    934:10  Unique         3.21, 4.22 A)
 &rst
  ixpk= 934, nxpk= 10, iat= 915, 148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HD           11 TYR  HN          4.50    (#    935:10  Unique         2.16, 3.95 A)
 &rst
  ixpk= 935, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 156, 165,
 &end
#
#    5 PHE  HD           11 TYR  HN          5.50    (#    936:10  Unique         4.13, 6.50 A)
 &rst
  ixpk= 936, nxpk= 10, iat=  -1, 148, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  71,  79,
 &end
#
#   10 VAL  HA           11 TYR  HN          2.80    (#    937:10  Unique         2.14, 2.17 A)
 &rst
  ixpk= 937, nxpk= 10, iat= 134, 148, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   55 GLY  HN           54 VAL  HN          4.50    (#    940:10  Unique         4.57, 4.61 A)
 &rst
  ixpk= 940, nxpk= 10, iat= 810, 794, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 SER  HN           54 VAL  HN          4.50    (#    941:10  Unique         4.16, 4.36 A)
 &rst
  ixpk= 941, nxpk= 10, iat= 783, 794, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:943      0 AMB  10-1:943    2.80    (#    943:10  Double Ambig)
 &rst
  ixpk= 943, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 950, 242,
 igr2=1088, 249,
 &end
#
#   73 SER  HA           73 SER  HN          3.50    (#    944:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 944, nxpk= 10, iat=1090,1088, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:945      0 AMB  10-1:945    4.50    (#    945:10  Double Ambig)
 &rst
  ixpk= 945, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 931, 810,
 igr2=1088, 249,
 &end
#
#    0 AMB  10-2:950     77 ARG  HN          4.50    (#    950:10  Single Ambig)
 &rst
  ixpk= 950, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1182, 591,
 &end
#
#   78 ALA  HN           77 ARG  HN          4.50    (#    951:10  Unique         2.35, 2.58 A)
 &rst
  ixpk= 951, nxpk= 10, iat=1172,1148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 ILE  HN           77 ARG  HN          2.80    (#    952:10  Unique         2.14, 2.36 A)
 &rst
  ixpk= 952, nxpk= 10, iat=1129,1148, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 SER  HA           77 ARG  HN          4.50    (#    953:10  Unique         3.40, 3.61 A)
 &rst
  ixpk= 953, nxpk= 10, iat=1120,1148, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 PHE  HD           25 VAL  HN          4.50    (#    954:10  Unique         2.43, 4.34 A)
 &rst
  ixpk= 954, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 341, 349,
 &end
#
#   32 GLN  HA           25 VAL  HN          5.50    (#    955:10  Unique         4.08, 4.63 A)
 &rst
  ixpk= 955, nxpk= 10, iat= 456, 353, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   24 PHE  HA           25 VAL  HN          2.80    (#    956:10  Unique         2.15, 2.21 A)
 &rst
  ixpk= 956, nxpk= 10, iat= 335, 353, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:957     25 VAL  HN          4.50    (#    957:10  Single Ambig)
 &rst
  ixpk= 957, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 369, 228, 497,
 &end
#
#   34 LEU  HA           25 VAL  HN          4.50    (#    958:10  Unique         3.24, 3.69 A)
 &rst
  ixpk= 958, nxpk= 10, iat= 480, 353, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   24 PHE  HD           25 VAL  HN          4.50    (#    959:10  Unique         2.43, 4.34 A)
 &rst
  ixpk= 959, nxpk= 10, iat=  -1, 353, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 341, 349,
 &end
#
#    0 AMB  10-2:960     24 PHE  HN          4.50    (#    960:10  Single Ambig)
 &rst
  ixpk= 960, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 228, 497,
 &end
#
#    0 AMB  10-2:961     24 PHE  HN          4.50    (#    961:10  Single Ambig)
 &rst
  ixpk= 961, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 268, 323,
 &end
#
#   17 GLY  HN           24 PHE  HN          3.50    (#    962:10  Unique         2.63, 3.08 A)
 &rst
  ixpk= 962, nxpk= 10, iat= 242, 333, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   24 PHE  HD           24 PHE  HN          4.50    (#    963:10  Unique         3.05, 4.46 A)
 &rst
  ixpk= 963, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 341, 349,
 &end
#
#   23 ALA  HA           24 PHE  HN          2.80    (#    964:10  Unique         2.16, 2.30 A)
 &rst
  ixpk= 964, nxpk= 10, iat= 325, 333, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    8 GLY  HN            7 VAL  HN          4.50    (#    965:10  Unique         4.27, 4.56 A)
 &rst
  ixpk= 965, nxpk= 10, iat= 114,  98, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 VAL  HN           57 GLU  HN          4.50    (#    967:10  Unique         4.36, 4.37 A)
 &rst
  ixpk= 967, nxpk= 10, iat= 844, 829, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ASP  HN           57 GLU  HN          4.50    (#    968:10  Unique         4.35, 4.44 A)
 &rst
  ixpk= 968, nxpk= 10, iat= 817, 829, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 LYS  HA           57 GLU  HN          5.50    (#    969:10  Unique         4.24, 4.57 A)
 &rst
  ixpk= 969, nxpk= 10, iat= 192, 829, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HA           57 GLU  HN          3.50    (#    970:10  Unique         2.86, 2.86 A)
 &rst
  ixpk= 970, nxpk= 10, iat= 831, 829, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:971     57 GLU  HN          5.50    (#    971:10  Single Ambig)
 &rst
  ixpk= 971, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 212, 183,
 &end
#
#    5 PHE  HN            6 GLU  HN          4.50    (#    977:10  Unique         3.09, 4.16 A)
 &rst
  ixpk= 977, nxpk= 10, iat=  63,  83, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HD            6 GLU  HN          7.00    (#    978:10  Unique         5.87, 8.51 A)
 &rst
  ixpk= 978, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 156, 165,
 &end
#
#    5 PHE  HD            6 GLU  HN          4.50    (#    979:10  Unique         3.42, 4.96 A)
 &rst
  ixpk= 979, nxpk= 10, iat=  -1,  83, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  71,  79,
 &end
#
#   74 LEU  HA           61 LYS  HN          4.50    (#    981:10  Unique         4.04, 5.02 A)
 &rst
  ixpk= 981, nxpk= 10, iat=1101, 893, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   61 LYS  HA           61 LYS  HN          3.50    (#    982:10  Unique         2.92, 2.94 A)
 &rst
  ixpk= 982, nxpk= 10, iat= 895, 893, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   15 VAL  HN           56 ASP  HN          3.50    (#    985:10  Unique         2.92, 3.19 A)
 &rst
  ixpk= 985, nxpk= 10, iat= 212, 817, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   55 GLY  HN           56 ASP  HN          2.80    (#    986:10  Unique         2.29, 2.51 A)
 &rst
  ixpk= 986, nxpk= 10, iat= 810, 817, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:987     56 ASP  HN          5.50    (#    987:10  Single Ambig)
 &rst
  ixpk= 987, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 794, 844,
 &end
#
#   14 LYS  HA           56 ASP  HN          5.50    (#    988:10  Unique         4.36, 4.74 A)
 &rst
  ixpk= 988, nxpk= 10, iat= 192, 817, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   57 GLU  HN           56 ASP  HN          4.50    (#    989:10  Unique         4.35, 4.44 A)
 &rst
  ixpk= 989, nxpk= 10, iat= 829, 817, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   53 SER  HN           56 ASP  HN          7.00    (#    990:10  Unique         4.98, 5.32 A)
 &rst
  ixpk= 990, nxpk= 10, iat= 783, 817, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   15 VAL  HN           16 THR  HN          4.50    (#    991:10  Unique         4.48, 4.60 A)
 &rst
  ixpk= 991, nxpk= 10, iat= 212, 228, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:992     16 THR  HN          4.50    (#    992:10  Single Ambig)
 &rst
  ixpk= 992, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 353, 249,
 &end
#
#   17 GLY  HN           16 THR  HN          2.80    (#    993:10  Unique         1.89, 2.03 A)
 &rst
  ixpk= 993, nxpk= 10, iat= 242, 228, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:994     80 GLN  HN          4.50    (#    994:10  Single Ambig)
 &rst
  ixpk= 994, nxpk= 10, iat=  -1,1196, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1223,1172,
 &end
#
#   81 ALA  HN           80 GLN  HN          4.50    (#    995:10  Unique         2.17, 3.73 A)
 &rst
  ixpk= 995, nxpk= 10, iat=1213,1196, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   79 THR  HN           80 GLN  HN          2.80    (#    996:10  Unique         2.28, 2.67 A)
 &rst
  ixpk= 996, nxpk= 10, iat=1182,1196, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 PHE  HD           10 VAL  HN          5.50    (#   1000:10  Unique         3.77, 6.02 A)
 &rst
  ixpk= 1000, nxpk= 10, iat=  -1, 132, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=  71,  79,
 &end
#
#    5 PHE  HN            4 LYS  HN          2.80    (#   1001:10  Unique         1.90, 2.13 A)
 &rst
  ixpk= 1001, nxpk= 10, iat=  63,  41, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   11 TYR  HN           10 VAL  HN          4.50    (#   1002:10  Unique         3.92, 4.24 A)
 &rst
  ixpk= 1002, nxpk= 10, iat= 148, 132, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   10 VAL  HA           10 VAL  HN          3.50    (#   1003:10  Unique         2.89, 2.93 A)
 &rst
  ixpk= 1003, nxpk= 10, iat= 134, 132, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 VAL  HN           59 GLN  HN          4.50    (#   1004:10  Unique         3.53, 4.37 A)
 &rst
  ixpk= 1004, nxpk= 10, iat= 877, 860, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   58 VAL  HN           59 GLN  HN          4.50    (#   1005:10  Unique         4.37, 4.46 A)
 &rst
  ixpk= 1005, nxpk= 10, iat= 844, 860, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 GLN  HA           59 GLN  HN          3.50    (#   1006:10  Unique         2.76, 2.90 A)
 &rst
  ixpk= 1006, nxpk= 10, iat= 862, 860, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   35 VAL  HN           34 LEU  HN          4.50    (#   1007:10  Unique         4.22, 4.30 A)
 &rst
  ixpk= 1007, nxpk= 10, iat= 497, 478, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1008    34 LEU  HN          4.50    (#   1008:10  Single Ambig)
 &rst
  ixpk= 1008, nxpk= 10, iat=  -1, 478, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1=1069, 471, 353,
 &end
#
#   74 LEU  HN           34 LEU  HN          4.50    (#   1009:10  Unique         3.28, 3.85 A)
 &rst
  ixpk= 1009, nxpk= 10, iat=1099, 478, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   73 SER  HA           34 LEU  HN          3.50    (#   1010:10  Unique         3.11, 4.01 A)
 &rst
  ixpk= 1010, nxpk= 10, iat=1090, 478, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 LEU  HA           34 LEU  HN          3.50    (#   1011:10  Unique         2.91, 2.92 A)
 &rst
  ixpk= 1011, nxpk= 10, iat= 480, 478, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   21 TYR  HN           20 ALA  HN          4.50    (#   1013:10  Unique         2.36, 2.53 A)
 &rst
  ixpk= 1013, nxpk= 10, iat= 295, 285, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1017    19 GLN  HN          3.50    (#   1017:10  Single Ambig)
 &rst
  ixpk= 1017, nxpk= 10, iat=  -1, 268, r1= 1.30, r2= 1.80, r3= 4.20, r4= 4.70,
 igr1= 316, 280, 281,
 &end
#
#   23 ALA  HA           19 GLN  HN          3.50    (#   1018:10  Unique         2.41, 2.89 A)
 &rst
  ixpk= 1018, nxpk= 10, iat= 325, 268, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   64 ALA  HN           65 VAL  HN          4.50    (#   1020:10  Unique         4.11, 4.26 A)
 &rst
  ixpk= 1020, nxpk= 10, iat= 950, 960, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#  127 LEU  HN          126 ASP  HN          4.50    (#   1021:10  Unique         2.48, 3.88 A)
 &rst
  ixpk= 1021, nxpk= 10, iat=1947,1935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   44 PHE  HD           44 PHE  HN          4.50    (#   1022:10  Unique         2.05, 4.09 A)
 &rst
  ixpk= 1022, nxpk= 10, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 637, 645,
 &end
#
#   67 GLU  HN           68 GLU  HN          2.80    (#   1024:10  Unique         2.26, 2.39 A)
 &rst
  ixpk= 1024, nxpk= 10, iat= 988,1003, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   69 LYS  HN           68 GLU  HN          2.80    (#   1025:10  Unique         2.33, 2.67 A)
 &rst
  ixpk= 1025, nxpk= 10, iat=1018,1003, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    6 GLU  HN            5 PHE  HN          4.50    (#   1026:10  Unique         3.09, 4.16 A)
 &rst
  ixpk= 1026, nxpk= 10, iat=  83,  63, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    4 LYS  HN            5 PHE  HN          3.50    (#   1027:10  Unique         1.90, 2.13 A)
 &rst
  ixpk= 1027, nxpk= 10, iat=  41,  63, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    5 PHE  HD            5 PHE  HN          4.50    (#   1028:10  Unique         1.95, 3.87 A)
 &rst
  ixpk= 1028, nxpk= 10, iat=  -1,  63, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=  71,  79,
 &end
#
#   35 VAL  HN           23 ALA  HN          3.50    (#   1030:10  Unique         2.91, 3.49 A)
 &rst
  ixpk= 1030, nxpk= 10, iat= 497, 323, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1031    23 ALA  HN          4.50    (#   1031:10  Single Ambig)
 &rst
  ixpk= 1031, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 333, 285,
 &end
#
#    0 AMB  10-2:1032    23 ALA  HN          4.50    (#   1032:10  Single Ambig)
 &rst
  ixpk= 1032, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 316, 280, 281,
 &end
#
#   23 ALA  HA           23 ALA  HN          3.50    (#   1033:10  Unique         2.93, 2.93 A)
 &rst
  ixpk= 1033, nxpk= 10, iat= 325, 323, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   48 ILE  HN           49 ASN  HN          3.50    (#   1034:10  Unique         2.19, 2.35 A)
 &rst
  ixpk= 1034, nxpk= 10, iat= 699, 718, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   49 ASN  HD2-         49 ASN  HN          2.80    (#   1035:10  Unique         1.81, 2.62 A)
 &rst
  ixpk= 1035, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 727, 728,
 &end
#
#   50 GLU  HN           49 ASN  HN          2.80    (#   1036:10  Unique         2.34, 2.56 A)
 &rst
  ixpk= 1036, nxpk= 10, iat= 732, 718, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1037    49 ASN  HN          4.50    (#   1037:10  Single Ambig)
 &rst
  ixpk= 1037, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 747, 764,
 &end
#
#   49 ASN  HD2+         49 ASN  HN          3.50    (#   1038:10  Unique         1.81, 2.62 A)
 &rst
  ixpk= 1038, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 727, 728,
 &end
#
#   79 THR  HN           78 ALA  HN          3.50    (#   1039:10  Unique         2.24, 2.47 A)
 &rst
  ixpk= 1039, nxpk= 10, iat=1182,1172, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   76 ILE  HN           78 ALA  HN          4.50    (#   1040:10  Unique         3.78, 4.00 A)
 &rst
  ixpk= 1040, nxpk= 10, iat=1129,1172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   80 GLN  HN           78 ALA  HN          4.50    (#   1041:10  Unique         3.74, 4.10 A)
 &rst
  ixpk= 1041, nxpk= 10, iat=1196,1172, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   75 SER  HA           78 ALA  HN          5.50    (#   1042:10  Unique         4.04, 4.43 A)
 &rst
  ixpk= 1042, nxpk= 10, iat=1120,1172, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 GLN  HN           31 THR  HN          4.50    (#   1043:10  Unique         3.61, 3.86 A)
 &rst
  ixpk= 1043, nxpk= 10, iat= 454, 440, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           31 THR  HN          5.50    (#   1044:10  Unique         3.77, 3.91 A)
 &rst
  ixpk= 1044, nxpk= 10, iat= 379, 440, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   30 GLU  HN           31 THR  HN          2.80    (#   1045:10  Unique         1.87, 1.96 A)
 &rst
  ixpk= 1045, nxpk= 10, iat= 425, 440, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   37 ILE  HN            0 AMB  10-1:1046   5.50    (#   1046:10  Single Ambig)
 &rst
  ixpk= 1046, nxpk= 10, iat= 530,  -1, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr2= 560, 323,
 &end
#
#    0 AMB  10-2:1048    58 VAL  HN          2.80    (#   1048:10  Single Ambig)
 &rst
  ixpk= 1048, nxpk= 10, iat=  -1, 844, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 212, 183,
 &end
#
#   57 GLU  HN           58 VAL  HN          4.50    (#   1049:10  Unique         4.36, 4.37 A)
 &rst
  ixpk= 1049, nxpk= 10, iat= 829, 844, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   57 GLU  HA           58 VAL  HN          2.80    (#   1050:10  Unique         2.15, 2.15 A)
 &rst
  ixpk= 1050, nxpk= 10, iat= 831, 844, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   59 GLN  HN           58 VAL  HN          4.50    (#   1051:10  Unique         4.37, 4.46 A)
 &rst
  ixpk= 1051, nxpk= 10, iat= 860, 844, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   14 LYS  HA           58 VAL  HN          3.50    (#   1052:10  Unique         1.94, 2.57 A)
 &rst
  ixpk= 1052, nxpk= 10, iat= 192, 844, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   36 HIS  HN           39 GLU  HN          5.50    (#   1053:10  Unique         4.18, 4.37 A)
 &rst
  ixpk= 1053, nxpk= 10, iat= 513, 560, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1054     0 AMB  10-1:1054   2.80    (#   1054:10  Double Ambig)
 &rst
  ixpk= 1054, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1332, 549,
 igr2=1321, 560,
 &end
#
#   41 THR  HN           39 GLU  HN          7.00    (#   1055:10  Unique         4.00, 4.20 A)
 &rst
  ixpk= 1055, nxpk= 10, iat= 591, 560, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   40 VAL  HN           39 GLU  HN          2.80    (#   1056:10  Unique         2.24, 2.38 A)
 &rst
  ixpk= 1056, nxpk= 10, iat= 575, 560, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   26 ALA  HN           14 LYS  HN          3.50    (#   1058:10  Unique         2.21, 2.92 A)
 &rst
  ixpk= 1058, nxpk= 10, iat= 369, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1059    14 LYS  HN          4.50    (#   1059:10  Single Ambig)
 &rst
  ixpk= 1059, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 183, 212,
 &end
#
#   14 LYS  HA           14 LYS  HN          3.50    (#   1060:10  Unique         2.90, 2.93 A)
 &rst
  ixpk= 1060, nxpk= 10, iat= 192, 190, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   57 GLU  HA           14 LYS  HN          5.50    (#   1061:10  Unique         4.19, 4.64 A)
 &rst
  ixpk= 1061, nxpk= 10, iat= 831, 190, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 LYS  HN           71 LYS  HN          4.50    (#   1062:10  Unique         3.82, 4.16 A)
 &rst
  ixpk= 1062, nxpk= 10, iat=1018,1047, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1063    38 SER  HN          7.00    (#   1063:10  Single Ambig)
 &rst
  ixpk= 1063, nxpk= 10, iat=  -1, 549, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1= 591, 649,
 &end
#
#   39 GLU  HN           38 SER  HN          2.80    (#   1064:10  Unique         2.38, 2.49 A)
 &rst
  ixpk= 1064, nxpk= 10, iat= 560, 549, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   37 ILE  HN           38 SER  HN          3.50    (#   1065:10  Unique         2.57, 2.68 A)
 &rst
  ixpk= 1065, nxpk= 10, iat= 530, 549, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   62 VAL  HN            9 SER  HN          4.50    (#   1067:10  Unique         3.93, 4.39 A)
 &rst
  ixpk= 1067, nxpk= 10, iat= 915, 121, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    8 GLY  HN            9 SER  HN          2.80    (#   1068:10  Unique         2.49, 2.73 A)
 &rst
  ixpk= 1068, nxpk= 10, iat= 114, 121, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    5 PHE  HD            9 SER  HN          7.00    (#   1069:10  Unique         4.15, 6.70 A)
 &rst
  ixpk= 1069, nxpk= 10, iat=  -1, 121, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  71,  79,
 &end
#
#   72 ILE  HN           71 LYS  HN          4.50    (#   1070:10  Unique         4.23, 4.45 A)
 &rst
  ixpk= 1070, nxpk= 10, iat=1069,1047, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   66 ASP  HN           71 LYS  HN          3.50    (#   1071:10  Unique         3.09, 3.37 A)
 &rst
  ixpk= 1071, nxpk= 10, iat= 976,1047, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   70 GLY  HN           71 LYS  HN          2.80    (#   1072:10  Unique         2.15, 2.39 A)
 &rst
  ixpk= 1072, nxpk= 10, iat=1040,1047, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   50 GLU  HN            0 AMB  10-1:1076   4.50    (#   1076:10  Single Ambig)
 &rst
  ixpk= 1076, nxpk= 10, iat= 732,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 764, 687,
 &end
#
#   53 SER  HN           52 LEU  HN          4.50    (#   1078:10  Unique         4.32, 4.49 A)
 &rst
  ixpk= 1078, nxpk= 10, iat= 783, 764, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   63 LEU  HN           64 ALA  HN          2.80    (#   1080:10  Unique         1.95, 2.20 A)
 &rst
  ixpk= 1080, nxpk= 10, iat= 931, 950, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   73 SER  HN           64 ALA  HN          3.50    (#   1081:10  Unique         3.76, 4.05 A)
 &rst
  ixpk= 1081, nxpk= 10, iat=1088, 950, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   74 LEU  HA           64 ALA  HN          4.50    (#   1082:10  Unique         4.27, 4.75 A)
 &rst
  ixpk= 1082, nxpk= 10, iat=1101, 950, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1085    55 GLY  HN          4.50    (#   1085:10  Single Ambig)
 &rst
  ixpk= 1085, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 794, 249, 333,
 &end
#
#   56 ASP  HN           55 GLY  HN          2.80    (#   1086:10  Unique         2.29, 2.51 A)
 &rst
  ixpk= 1086, nxpk= 10, iat= 817, 810, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    7 VAL  HN            8 GLY  HN          4.50    (#   1090:10  Unique         4.27, 4.56 A)
 &rst
  ixpk= 1090, nxpk= 10, iat=  98, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 SER  HN            8 GLY  HN          2.80    (#   1091:10  Unique         2.49, 2.73 A)
 &rst
  ixpk= 1091, nxpk= 10, iat= 121, 114, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   62 VAL  HN            8 GLY  HN          4.50    (#   1092:10  Unique         3.35, 3.91 A)
 &rst
  ixpk= 1092, nxpk= 10, iat= 915, 114, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   11 TYR  HD           12 THR  HN          3.50    (#   1093:10  Unique         2.22, 4.14 A)
 &rst
  ixpk= 1093, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 156, 165,
 &end
#
#   12 THR  HA           12 THR  HN          3.50    (#   1094:10  Unique         2.87, 2.93 A)
 &rst
  ixpk= 1094, nxpk= 10, iat= 171, 169, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 GLY  HN           12 THR  HN          4.50    (#   1095:10  Unique         3.82, 4.25 A)
 &rst
  ixpk= 1095, nxpk= 10, iat= 183, 169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    5 PHE  HD           12 THR  HN          7.00    (#   1096:10  Unique         4.01, 6.79 A)
 &rst
  ixpk= 1096, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 7.86, r4= 8.36,
 igr1=  71,  79,
 &end
#
#   49 ASN  HN           50 GLU  HN          2.80    (#   1099:10  Unique         2.34, 2.56 A)
 &rst
  ixpk= 1099, nxpk= 10, iat= 718, 732, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   51 HIS  HN           50 GLU  HN          2.80    (#   1100:10  Unique         2.18, 2.51 A)
 &rst
  ixpk= 1100, nxpk= 10, iat= 747, 732, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   29 GLU  HN           30 GLU  HN          3.50    (#   1102:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 1102, nxpk= 10, iat= 410, 425, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HN           30 GLU  HN          2.80    (#   1103:10  Unique         1.87, 1.96 A)
 &rst
  ixpk= 1103, nxpk= 10, iat= 440, 425, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   49 ASN  HN           51 HIS  HN          4.50    (#   1104:10  Unique         3.77, 4.07 A)
 &rst
  ixpk= 1104, nxpk= 10, iat= 718, 747, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   50 GLU  HN           51 HIS  HN          2.80    (#   1105:10  Unique         2.18, 2.51 A)
 &rst
  ixpk= 1105, nxpk= 10, iat= 732, 747, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   49 ASN  HN           49 ASN  HD2-        3.50    (#   1107:10  Unique         1.81, 2.62 A)
 &rst
  ixpk= 1107, nxpk= 10, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr2= 727, 728,
 &end
#
#   29 GLU  HN           28 ASP  HN          4.50    (#   1110:10  Unique         2.34, 2.51 A)
 &rst
  ixpk= 1110, nxpk= 10, iat= 410, 398, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   27 LEU  HN           28 ASP  HN          2.80    (#   1111:10  Unique         2.08, 2.54 A)
 &rst
  ixpk= 1111, nxpk= 10, iat= 379, 398, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   30 GLU  HN           28 ASP  HN          4.50    (#   1112:10  Unique         2.62, 2.77 A)
 &rst
  ixpk= 1112, nxpk= 10, iat= 425, 398, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   31 THR  HN           28 ASP  HN          3.50    (#   1113:10  Unique         2.67, 2.96 A)
 &rst
  ixpk= 1113, nxpk= 10, iat= 440, 398, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   32 GLN  HA           28 ASP  HN          7.00    (#   1115:10  Unique         4.69, 5.10 A)
 &rst
  ixpk= 1115, nxpk= 10, iat= 456, 398, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   49 ASN  HN           49 ASN  HD2+        4.50    (#   1116:10  Unique         1.81, 2.62 A)
 &rst
  ixpk= 1116, nxpk= 10, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 727, 728,
 &end
#
#   67 GLU  HN           69 LYS  HN          4.50    (#   1120:10  Unique         4.10, 4.40 A)
 &rst
  ixpk= 1120, nxpk= 10, iat= 988,1018, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   68 GLU  HN           69 LYS  HN          2.80    (#   1121:10  Unique         2.33, 2.67 A)
 &rst
  ixpk= 1121, nxpk= 10, iat=1003,1018, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   70 GLY  HN           69 LYS  HN          2.80    (#   1122:10  Unique         1.99, 2.32 A)
 &rst
  ixpk= 1122, nxpk= 10, iat=1040,1018, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   71 LYS  HN           69 LYS  HN          4.50    (#   1123:10  Unique         3.82, 4.16 A)
 &rst
  ixpk= 1123, nxpk= 10, iat=1047,1018, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   30 GLU  HN           29 GLU  HN          3.50    (#   1125:10  Unique         2.62, 2.68 A)
 &rst
  ixpk= 1125, nxpk= 10, iat= 425, 410, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   31 THR  HN           29 GLU  HN          4.50    (#   1127:10  Unique         4.00, 4.13 A)
 &rst
  ixpk= 1127, nxpk= 10, iat= 440, 410, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   28 ASP  HN           29 GLU  HN          5.50    (#   1129:10  Unique         2.34, 2.51 A)
 &rst
  ixpk= 1129, nxpk= 10, iat= 398, 410, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1132    13 GLY  HN          2.80    (#   1132:10  Single Ambig)
 &rst
  ixpk= 1132, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 844, 169,
 &end
#
#   14 LYS  HN           13 GLY  HN          4.50    (#   1133:10  Unique         3.85, 4.23 A)
 &rst
  ixpk= 1133, nxpk= 10, iat= 190, 183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1134    13 GLY  HN          2.80    (#   1134:10  Single Ambig)
 &rst
  ixpk= 1134, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 171, 862,
 &end
#
#    0 AMB  10-2:1136    53 SER  HN          4.50    (#   1136:10  Single Ambig)
 &rst
  ixpk= 1136, nxpk= 10, iat=  -1, 783, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 794, 844,
 &end
#
#   56 ASP  HN           53 SER  HN          7.00    (#   1138:10  Unique         4.98, 5.32 A)
 &rst
  ixpk= 1138, nxpk= 10, iat= 817, 783, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   52 LEU  HN           53 SER  HN          4.50    (#   1139:10  Unique         4.32, 4.49 A)
 &rst
  ixpk= 1139, nxpk= 10, iat= 764, 783, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   76 ILE  HN           75 SER  HN          4.50    (#   1162:10  Unique         3.91, 4.15 A)
 &rst
  ixpk= 1162, nxpk= 10, iat=1129,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HN           75 SER  HN          4.50    (#   1163:10  Unique         4.44, 4.50 A)
 &rst
  ixpk= 1163, nxpk= 10, iat=1099,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   74 LEU  HA           75 SER  HN          2.80    (#   1164:10  Unique         2.19, 2.29 A)
 &rst
  ixpk= 1164, nxpk= 10, iat=1101,1118, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   75 SER  HA           75 SER  HN          3.50    (#   1165:10  Unique         2.93, 2.94 A)
 &rst
  ixpk= 1165, nxpk= 10, iat=1120,1118, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 GLY  HN           60 VAL  HN          4.50    (#   1168:10  Unique         3.84, 4.55 A)
 &rst
  ixpk= 1168, nxpk= 10, iat= 183, 877, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   59 GLN  HN           60 VAL  HN          4.50    (#   1169:10  Unique         3.53, 4.37 A)
 &rst
  ixpk= 1169, nxpk= 10, iat= 860, 877, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1170    60 VAL  HN          2.80    (#   1170:10  Single Ambig)
 &rst
  ixpk= 1170, nxpk= 10, iat=  -1, 877, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 862, 171,
 &end
#
#   68 GLU  HN           70 GLY  HN          5.50    (#   1176:10  Unique         3.37, 3.68 A)
 &rst
  ixpk= 1176, nxpk= 10, iat=1003,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 LYS  HN           70 GLY  HN          2.80    (#   1177:10  Unique         1.99, 2.32 A)
 &rst
  ixpk= 1177, nxpk= 10, iat=1018,1040, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   71 LYS  HN           70 GLY  HN          2.80    (#   1178:10  Unique         2.15, 2.39 A)
 &rst
  ixpk= 1178, nxpk= 10, iat=1047,1040, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   40 VAL  HN           41 THR  HN          3.50    (#   1179:10  Unique         1.91, 2.27 A)
 &rst
  ixpk= 1179, nxpk= 10, iat= 575, 591, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   39 GLU  HN           41 THR  HN          5.50    (#   1180:10  Unique         4.00, 4.20 A)
 &rst
  ixpk= 1180, nxpk= 10, iat= 560, 591, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1181    22 GLY  HN          3.50    (#   1181:10  Single Ambig)
 &rst
  ixpk= 1181, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1= 268, 323,
 &end
#
#   21 TYR  HD           22 GLY  HN          5.50    (#   1182:10  Unique         3.16, 4.94 A)
 &rst
  ixpk= 1182, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 303, 312,
 &end
#
#   21 TYR  HN           22 GLY  HN          2.80    (#   1183:10  Unique         1.79, 2.16 A)
 &rst
  ixpk= 1183, nxpk= 10, iat= 295, 316, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   15 VAL  HN           17 GLY  HN          7.00    (#   1184:10  Unique         5.93, 6.17 A)
 &rst
  ixpk= 1184, nxpk= 10, iat= 212, 242, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1185    17 GLY  HN          2.80    (#   1185:10  Single Ambig)
 &rst
  ixpk= 1185, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 333, 249,
 &end
#
#   23 ALA  HA           17 GLY  HN          5.50    (#   1186:10  Unique         4.50, 4.83 A)
 &rst
  ixpk= 1186, nxpk= 10, iat= 325, 242, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   16 THR  HN           17 GLY  HN          2.80    (#   1187:10  Unique         1.89, 2.03 A)
 &rst
  ixpk= 1187, nxpk= 10, iat= 228, 242, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   24 PHE  HD           17 GLY  HN          4.50    (#   1188:10  Unique         5.18, 5.94 A)
 &rst
  ixpk= 1188, nxpk= 10, iat=  -1, 242, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 341, 349,
 &end
#
#    0 AMB  10-2:1191    33 GLY  HN          5.50    (#   1191:10  Single Ambig)
 &rst
  ixpk= 1191, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 369, 497,
 &end
#
#   27 LEU  HN           33 GLY  HN          5.50    (#   1192:10  Unique         3.73, 4.34 A)
 &rst
  ixpk= 1192, nxpk= 10, iat= 379, 471, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   32 GLN  HA           33 GLY  HN          2.80    (#   1193:10  Unique         2.14, 2.15 A)
 &rst
  ixpk= 1193, nxpk= 10, iat= 456, 471, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1194    33 GLY  HN          5.50    (#   1194:10  Single Ambig)
 &rst
  ixpk= 1194, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 335,1090,
 &end
#
#   34 LEU  HA           33 GLY  HN          5.50    (#   1195:10  Unique         4.90, 5.30 A)
 &rst
  ixpk= 1195, nxpk= 10, iat= 480, 471, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1196    33 GLY  HN          4.50    (#   1196:10  Single Ambig)
 &rst
  ixpk= 1196, nxpk= 10, iat=  -1, 471, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 478, 398,
 &end
#
#   75 SER  HA           79 THR  HN          7.00    (#   1197:10  Unique         5.47, 5.92 A)
 &rst
  ixpk= 1197, nxpk= 10, iat=1120,1182, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   78 ALA  HN           79 THR  HN          3.50    (#   1198:10  Unique         2.24, 2.47 A)
 &rst
  ixpk= 1198, nxpk= 10, iat=1172,1182, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   80 GLN  HN           79 THR  HN          2.80    (#   1199:10  Unique         2.28, 2.67 A)
 &rst
  ixpk= 1199, nxpk= 10, iat=1196,1182, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   20 ALA  HN           21 TYR  HN          4.50    (#   1200:10  Unique         2.36, 2.53 A)
 &rst
  ixpk= 1200, nxpk= 10, iat= 285, 295, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   22 GLY  HN           21 TYR  HN          2.80    (#   1201:10  Unique         1.79, 2.16 A)
 &rst
  ixpk= 1201, nxpk= 10, iat= 316, 295, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   21 TYR  HD           21 TYR  HN          4.50    (#   1202:10  Unique         2.28, 3.82 A)
 &rst
  ixpk= 1202, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 303, 312,
 &end
#
#    0 AMB  10-2:1205     0 AMB  10-1:1205   4.50    (#   1205:10  Double Ambig)
 &rst
  ixpk= 1205, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 976,1099, 268, 960,
 igr2=1088, 249,
 &end
#
#   20 ALA  HN           19 GLN  HN          4.50    (#   1206:10  Unique         1.89, 4.18 A)
 &rst
  ixpk= 1206, nxpk= 10, iat= 285, 268, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1207    12 THR  HN          4.50    (#   1207:10  Single Ambig)
 &rst
  ixpk= 1207, nxpk= 10, iat=  -1, 169, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 148, 877,
 &end
#
#   63 LEU  HN           75 SER  HN          4.50    (#   1208:10  Unique         3.73, 4.18 A)
 &rst
  ixpk= 1208, nxpk= 10, iat= 931,1118, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   72 ILE  HG1-         72 ILE  HN          4.50    (#   1222:10  Unique         2.23, 3.22 A)
 &rst
  ixpk= 1222, nxpk= 10, iat=  -1,1069, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1079,1080,
 &end
#
#    0 AMB  10-2:1227    66 ASP  HN          2.80    (#   1227:10  Single Ambig)
 &rst
  ixpk= 1227, nxpk= 10, iat=  -1, 976, r1= 1.30, r2= 1.80, r3= 4.24, r4= 4.74,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   66 ASP  HA           66 ASP  HN          3.50    (#   1228:10  Unique         2.88, 2.92 A)
 &rst
  ixpk= 1228, nxpk= 10, iat= 978, 976, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   10 VAL  HA           62 VAL  HN          3.50    (#   1229:10  Unique         3.19, 3.87 A)
 &rst
  ixpk= 1229, nxpk= 10, iat= 134, 915, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   66 ASP  HA           67 GLU  HN          3.50    (#   1230:10  Unique         2.14, 2.16 A)
 &rst
  ixpk= 1230, nxpk= 10, iat= 978, 988, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   41 THR  HN           40 VAL  HN          3.50    (#   1231:10  Unique         1.91, 2.27 A)
 &rst
  ixpk= 1231, nxpk= 10, iat= 591, 575, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   34 LEU  HN           74 LEU  HN          4.50    (#   1232:10  Unique         3.28, 3.85 A)
 &rst
  ixpk= 1232, nxpk= 10, iat= 478,1099, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   18 LEU  HA           24 PHE  HN          3.50    (#   1236:10  Unique         3.02, 3.46 A)
 &rst
  ixpk= 1236, nxpk= 10, iat= 251, 333, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1238    84 GLU  HN          4.50    (#   1238:10  Single Ambig)
 &rst
  ixpk= 1238, nxpk= 10, iat=  -1,1247, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1=1254,1255,1254,1255,1240,1241,
 &end
#
#  106 GLN  HB+         106 GLN  HN          3.50    (#   1239:10  Unique         2.21, 3.19 A)
 &rst
  ixpk= 1239, nxpk= 10, iat=  -1,1593, r1= 1.30, r2= 1.80, r3= 3.93, r4= 4.43,
 igr1=1597,1598,
 &end
#
#   18 LEU  HA           19 GLN  HN          2.80    (#   1241:10  Unique         2.14, 2.23 A)
 &rst
  ixpk= 1241, nxpk= 10, iat= 251, 268, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#    0 AMB  10-2:1244    31 THR  HN          7.00    (#   1244:10  Single Ambig)
 &rst
  ixpk= 1244, nxpk= 10, iat=  -1, 440, r1= 1.30, r2= 1.80, r3=10.10, r4=10.60,
 igr1=1082,1083,1084, 359, 360, 361, 363, 364, 365,
 &end
#
#   28 ASP  HN           31 THR  HN          3.50    (#   1246:10  Unique         2.67, 2.96 A)
 &rst
  ixpk= 1246, nxpk= 10, iat= 398, 440, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   58 VAL  HA           58 VAL  HN          3.50    (#   1247:10  Unique         2.93, 2.95 A)
 &rst
  ixpk= 1247, nxpk= 10, iat= 846, 844, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   13 GLY  HA+          14 LYS  HN          2.80    (#   1248:10  Unique         2.14, 2.59 A)
 &rst
  ixpk= 1248, nxpk= 10, iat=  -1, 190, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 185, 186,
 &end
#
#    0 AMB  10-2:1249    64 ALA  HN          4.50    (#   1249:10  Single Ambig)
 &rst
  ixpk= 1249, nxpk= 10, iat=  -1, 950, r1= 1.30, r2= 1.80, r3= 5.40, r4= 5.90,
 igr1= 960,  98,1099,
 &end
#
#   11 TYR  HA           12 THR  HN          2.80    (#   1250:10  Unique         2.22, 2.37 A)
 &rst
  ixpk= 1250, nxpk= 10, iat= 150, 169, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   28 ASP  HN           30 GLU  HN          4.50    (#   1251:10  Unique         2.62, 2.77 A)
 &rst
  ixpk= 1251, nxpk= 10, iat= 398, 425, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   13 GLY  HA+          13 GLY  HN          2.80    (#   1255:10  Unique         2.51, 2.78 A)
 &rst
  ixpk= 1255, nxpk= 10, iat=  -1, 183, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 185, 186,
 &end
#
#   60 VAL  HN           13 GLY  HN          4.50    (#   1256:10  Unique         3.84, 4.55 A)
 &rst
  ixpk= 1256, nxpk= 10, iat= 877, 183, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   52 LEU  HA           80 GLN  HE2+        4.50    (#   1257:10  Unique         3.98, 7.69 A)
 &rst
  ixpk= 1257, nxpk= 10, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1208,1209,
 &end
#
#   52 LEU  HA           80 GLN  HE2-        4.50    (#   1258:10  Unique         3.98, 7.69 A)
 &rst
  ixpk= 1258, nxpk= 10, iat= 766,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2=1208,1209,
 &end
#
#   18 LEU  HA           22 GLY  HN          5.50    (#   1263:10  Unique         4.51, 5.38 A)
 &rst
  ixpk= 1263, nxpk= 10, iat= 251, 316, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1265    54 VAL  HN          3.50    (#   1265:10  Single Ambig)
 &rst
  ixpk= 1265, nxpk= 10, iat=  -1, 794, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 &end
#
#   58 VAL  HA           59 GLN  HN          2.80    (#   1266:10  Unique         2.17, 2.26 A)
 &rst
  ixpk= 1266, nxpk= 10, iat= 846, 860, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   11 TYR  HA           11 TYR  HN          3.50    (#   1267:10  Unique         2.77, 2.90 A)
 &rst
  ixpk= 1267, nxpk= 10, iat= 150, 148, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1268    23 ALA  HN          4.50    (#   1268:10  Single Ambig)
 &rst
  ixpk= 1268, nxpk= 10, iat=  -1, 323, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 515, 499,
 &end
#
#   52 LEU  HA           52 LEU  HN          3.50    (#   1270:10  Unique         2.89, 2.93 A)
 &rst
  ixpk= 1270, nxpk= 10, iat= 766, 764, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#   60 VAL  MGY          61 LYS  HN          3.50    (#   1273:10  Unique         3.31, 4.50 A)
 &rst
  ixpk= 1273, nxpk= 10, iat=  -1, 893, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 883, 884, 885, 887, 888, 889,
 &end
#
#   70 GLY  HN           68 GLU  HN          4.50    (#   1275:10  Unique         3.37, 3.68 A)
 &rst
  ixpk= 1275, nxpk= 10, iat=1040,1003, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1278   116 GLU  HN          4.50    (#   1278:10  Single Ambig)
 &rst
  ixpk= 1278, nxpk= 10, iat=  -1,1759, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1763,1764,1763,1764,
 &end
#
#   77 ARG  HD+          77 ARG  HN          4.50    (#   1287:10  Unique         3.53, 4.29 A)
 &rst
  ixpk= 1287, nxpk= 10, iat=  -1,1148, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1158,1159,
 &end
#
#  126 ASP  HA          126 ASP  HN          4.50    (#   1288:10  Unique         2.28, 2.81 A)
 &rst
  ixpk= 1288, nxpk= 10, iat=1937,1935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    9 SER  HN            6 GLU  HN          4.50    (#   1291:10  Unique         4.05, 4.68 A)
 &rst
  ixpk= 1291, nxpk= 10, iat= 121,  83, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   62 VAL  HB            7 VAL  HN          5.50    (#   1292:10  Unique         3.90, 6.10 A)
 &rst
  ixpk= 1292, nxpk= 10, iat= 919,  98, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1293     8 GLY  HN          5.50    (#   1293:10  Single Ambig)
 &rst
  ixpk= 1293, nxpk= 10, iat=  -1, 114, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 897, 898, 935, 936, 935, 936,
 &end
#
#   54 VAL  HA           16 THR  HN          5.50    (#   1294:10  Unique         4.43, 4.76 A)
 &rst
  ixpk= 1294, nxpk= 10, iat= 796, 228, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   17 GLY  HA-          16 THR  HN          4.50    (#   1295:10  Unique         4.46, 4.65 A)
 &rst
  ixpk= 1295, nxpk= 10, iat=  -1, 228, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 244, 245,
 &end
#
#   16 THR  HA           16 THR  HN          3.50    (#   1296:10  Unique         2.91, 2.94 A)
 &rst
  ixpk= 1296, nxpk= 10, iat= 230, 228, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1297    21 TYR  HN          4.50    (#   1297:10  Single Ambig)
 &rst
  ixpk= 1297, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 712, 713, 714, 536, 537, 538,
 &end
#
#    0 AMB  10-2:1298    21 TYR  HN          4.50    (#   1298:10  Single Ambig)
 &rst
  ixpk= 1298, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 543, 544, 545, 258, 259, 260, 262, 263, 264,
 &end
#
#   19 GLN  HG-          21 TYR  HN          5.50    (#   1299:10  Unique         2.94, 4.93 A)
 &rst
  ixpk= 1299, nxpk= 10, iat=  -1, 295, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 275, 276,
 &end
#
#   34 LEU  MDY          22 GLY  HN          4.50    (#   1300:10  Unique         4.84, 6.88 A)
 &rst
  ixpk= 1300, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   19 GLN  HG+          22 GLY  HN          4.50    (#   1301:10  Unique         4.16, 5.18 A)
 &rst
  ixpk= 1301, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 275, 276,
 &end
#
#   19 GLN  HG-          22 GLY  HN          4.50    (#   1302:10  Unique         4.16, 5.18 A)
 &rst
  ixpk= 1302, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 275, 276,
 &end
#
#   21 TYR  HB-          22 GLY  HN          4.50    (#   1303:10  Unique         2.78, 3.64 A)
 &rst
  ixpk= 1303, nxpk= 10, iat=  -1, 316, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 299, 300,
 &end
#
#   37 ILE  HA           22 GLY  HN          7.00    (#   1304:10  Unique         4.02, 5.39 A)
 &rst
  ixpk= 1304, nxpk= 10, iat= 532, 316, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#    0 AMB  10-2:1305     0 AMB  10-1:1305   2.80    (#   1305:10  Double Ambig)
 &rst
  ixpk= 1305, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1=1323, 562,
 igr2=1321, 560,
 &end
#
#    0 AMB  10-2:1306    24 PHE  HN          3.50    (#   1306:10  Single Ambig)
 &rst
  ixpk= 1306, nxpk= 10, iat=  -1, 333, r1= 1.30, r2= 1.80, r3= 5.30, r4= 5.80,
 igr1= 218, 219, 220, 222, 223, 224, 800, 801, 802, 804,
       805, 806,
 &end
#
#    0 AMB  10-2:1307    30 GLU  HN          4.50    (#   1307:10  Single Ambig)
 &rst
  ixpk= 1307, nxpk= 10, iat=  -1, 425, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 450, 446, 447, 448,
 &end
#
#   26 ALA  MB           31 THR  HN          7.00    (#   1308:10  Unique         4.89, 6.33 A)
 &rst
  ixpk= 1308, nxpk= 10, iat=  -1, 440, r1= 1.30, r2= 1.80, r3= 8.41, r4= 8.91,
 igr1= 373, 374, 375,
 &end
#
#   34 LEU  MDY          36 HIS  HN          4.50    (#   1310:10  Unique         3.37, 5.44 A)
 &rst
  ixpk= 1310, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#   74 LEU  HB+          36 HIS  HN          5.50    (#   1311:10  Unique         4.33, 6.08 A)
 &rst
  ixpk= 1311, nxpk= 10, iat=  -1, 513, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1=1103,1104,
 &end
#
#   34 LEU  MDY          37 ILE  HN          4.50    (#   1312:10  Unique         4.88, 6.90 A)
 &rst
  ixpk= 1312, nxpk= 10, iat=  -1, 530, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 487, 488, 489, 491, 492, 493,
 &end
#
#    0 AMB  10-2:1313    40 VAL  HN          4.50    (#   1313:10  Single Ambig)
 &rst
  ixpk= 1313, nxpk= 10, iat=  -1, 575, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 540, 541, 540, 541,
 &end
#
#   40 VAL  HB           40 VAL  HN          2.80    (#   1314:10  Unique         2.51, 2.56 A)
 &rst
  ixpk= 1314, nxpk= 10, iat= 579, 575, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   77 ARG  HA           41 THR  HN          7.00    (#   1315:10  Unique         4.95, 5.38 A)
 &rst
  ixpk= 1315, nxpk= 10, iat=1150, 591, r1= 1.30, r2= 1.80, r3= 7.00, r4= 7.50,  &end
#
#   37 ILE  QD1          45 VAL  HN          5.50    (#   1316:10  Unique         3.37, 5.28 A)
 &rst
  ixpk= 1316, nxpk= 10, iat=  -1, 649, r1= 1.30, r2= 1.80, r3= 6.61, r4= 7.11,
 igr1= 543, 544, 545,
 &end
#
#   49 ASN  HN            0 AMB  10-1:1317   4.50    (#   1317:10  Single Ambig)
 &rst
  ixpk= 1317, nxpk= 10, iat= 718,  -1, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr2= 764, 687,
 &end
#
#    0 AMB  10-2:1318    48 ILE  HN          4.50    (#   1318:10  Single Ambig)
 &rst
  ixpk= 1318, nxpk= 10, iat=  -1, 699, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 709, 710, 709, 710, 289, 290, 291, 256,
 &end
#
#   48 ILE  QG2          49 ASN  HN          2.80    (#   1319:10  Unique         1.91, 3.09 A)
 &rst
  ixpk= 1319, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1= 705, 706, 707,
 &end
#
#    0 AMB  10-2:1320    49 ASN  HN          4.50    (#   1320:10  Single Ambig)
 &rst
  ixpk= 1320, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 6.49, r4= 6.99,
 igr1= 258, 259, 260, 262, 263, 264, 712, 713, 714,
 &end
#
#   50 GLU  HB+          49 ASN  HN          5.50    (#   1321:10  Unique         4.44, 5.41 A)
 &rst
  ixpk= 1321, nxpk= 10, iat=  -1, 718, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 736, 737,
 &end
#
#    0 AMB  10-2:1324     0 AMB  10-1:1324   4.50    (#   1324:10  Double Ambig)
 &rst
  ixpk= 1324, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 8.58, r4= 9.08,
 igr1= 258, 259, 260, 262, 263, 264, 258, 259, 260, 262,
       263, 264,
 igr2= 727, 728, 727, 728,
 &end
#
#   45 VAL  MGY          50 GLU  HN          5.50    (#   1325:10  Unique         5.01, 7.35 A)
 &rst
  ixpk= 1325, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 7.41, r4= 7.91,
 igr1= 655, 656, 657, 659, 660, 661,
 &end
#
#   51 HIS  HA           50 GLU  HN          5.50    (#   1326:10  Unique         4.87, 5.16 A)
 &rst
  ixpk= 1326, nxpk= 10, iat= 749, 732, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   49 ASN  HD2+         50 GLU  HN          5.50    (#   1327:10  Unique         1.91, 4.21 A)
 &rst
  ixpk= 1327, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 727, 728,
 &end
#
#   49 ASN  HD2-         50 GLU  HN          4.50    (#   1328:10  Unique         1.91, 4.21 A)
 &rst
  ixpk= 1328, nxpk= 10, iat=  -1, 732, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 727, 728,
 &end
#
#   48 ILE  HN           50 GLU  HN          4.50    (#   1329:10  Unique         3.64, 4.01 A)
 &rst
  ixpk= 1329, nxpk= 10, iat= 699, 732, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   56 ASP  HN           54 VAL  HN          5.50    (#   1332:10  Unique         4.64, 5.00 A)
 &rst
  ixpk= 1332, nxpk= 10, iat= 817, 794, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#    0 AMB  10-2:1333    55 GLY  HN          4.50    (#   1333:10  Single Ambig)
 &rst
  ixpk= 1333, nxpk= 10, iat=  -1, 810, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 194, 195, 194, 195, 200, 201,
 &end
#
#    0 AMB  10-2:1334    56 ASP  HN          4.50    (#   1334:10  Single Ambig)
 &rst
  ixpk= 1334, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 197, 198, 768, 769, 253, 254,
 &end
#
#   53 SER  HB+          56 ASP  HN          5.50    (#   1335:10  Unique         4.17, 5.00 A)
 &rst
  ixpk= 1335, nxpk= 10, iat=  -1, 817, r1= 1.30, r2= 1.80, r3= 6.17, r4= 6.67,
 igr1= 787, 788,
 &end
#
#    0 AMB  10-2:1336    57 GLU  HN          4.50    (#   1336:10  Single Ambig)
 &rst
  ixpk= 1336, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 6.07, r4= 6.57,
 igr1= 200, 201, 200, 201, 194, 195,
 &end
#
#   57 GLU  HB+          57 GLU  HN          2.80    (#   1337:10  Unique         2.28, 2.56 A)
 &rst
  ixpk= 1337, nxpk= 10, iat=  -1, 829, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 833, 834,
 &end
#
#   58 VAL  MGX          59 GLN  HN          3.50    (#   1338:10  Unique         2.00, 4.20 A)
 &rst
  ixpk= 1338, nxpk= 10, iat=  -1, 860, r1= 1.30, r2= 1.80, r3= 4.72, r4= 5.22,
 igr1= 850, 851, 852, 854, 855, 856,
 &end
#
#   60 VAL  HA           61 LYS  HN          2.80    (#   1339:10  Unique         2.16, 2.34 A)
 &rst
  ixpk= 1339, nxpk= 10, iat= 879, 893, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   62 VAL  HN           61 LYS  HN          4.50    (#   1340:10  Unique         4.28, 4.44 A)
 &rst
  ixpk= 1340, nxpk= 10, iat= 915, 893, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1341    62 VAL  HN          4.50    (#   1341:10  Single Ambig)
 &rst
  ixpk= 1341, nxpk= 10, iat=  -1, 915, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 125, 126, 116, 117,
 &end
#
#   63 LEU  HN           62 VAL  HN          4.50    (#   1342:10  Unique         4.14, 4.48 A)
 &rst
  ixpk= 1342, nxpk= 10, iat= 931, 915, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1343    63 LEU  HN          4.50    (#   1343:10  Single Ambig)
 &rst
  ixpk= 1343, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 6.36, r4= 6.86,
 igr1= 104, 105, 106, 108, 109, 110,1103,1104,
 &end
#
#    0 AMB  10-2:1344    63 LEU  HN          2.80    (#   1344:10  Single Ambig)
 &rst
  ixpk= 1344, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 3.53, r4= 4.03,
 igr1= 935, 936, 935, 936,
 &end
#
#    0 AMB  10-2:1345    63 LEU  HN          4.50    (#   1345:10  Single Ambig)
 &rst
  ixpk= 1345, nxpk= 10, iat=  -1, 931, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1099, 960,
 &end
#
#    0 AMB  10-2:1346    67 GLU  HN          4.50    (#   1346:10  Single Ambig)
 &rst
  ixpk= 1346, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 6.81, r4= 7.31,
 igr1= 966, 967, 968, 970, 971, 972, 966, 967, 968, 970,
       971, 972,
 &end
#
#   67 GLU  HB+          67 GLU  HN          2.80    (#   1347:10  Unique         2.21, 3.00 A)
 &rst
  ixpk= 1347, nxpk= 10, iat=  -1, 988, r1= 1.30, r2= 1.80, r3= 3.14, r4= 3.64,
 igr1= 992, 993,
 &end
#
#   66 ASP  HB-          70 GLY  HN          4.50    (#   1351:10  Unique         2.21, 3.49 A)
 &rst
  ixpk= 1351, nxpk= 10, iat=  -1,1040, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1= 980, 981,
 &end
#
#   71 LYS  HA           70 GLY  HN          5.50    (#   1352:10  Unique         4.84, 5.03 A)
 &rst
  ixpk= 1352, nxpk= 10, iat=1049,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   66 ASP  HN           70 GLY  HN          5.50    (#   1353:10  Unique         4.28, 4.69 A)
 &rst
  ixpk= 1353, nxpk= 10, iat= 976,1040, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   69 LYS  HB+          71 LYS  HN          4.50    (#   1354:10  Unique         2.76, 3.87 A)
 &rst
  ixpk= 1354, nxpk= 10, iat=  -1,1047, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1022,1023,
 &end
#
#   66 ASP  HA           71 LYS  HN          5.50    (#   1355:10  Unique         4.32, 4.64 A)
 &rst
  ixpk= 1355, nxpk= 10, iat= 978,1047, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   75 SER  HN           76 ILE  HN          4.50    (#   1356:10  Unique         3.91, 4.15 A)
 &rst
  ixpk= 1356, nxpk= 10, iat=1118,1129, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#   77 ARG  HN           78 ALA  HN          2.80    (#   1357:10  Unique         2.35, 2.58 A)
 &rst
  ixpk= 1357, nxpk= 10, iat=1148,1172, r1= 1.30, r2= 1.80, r3= 2.80, r4= 3.30,  &end
#
#   79 THR  MG2          79 THR  HN          2.80    (#   1358:10  Unique         1.96, 2.93 A)
 &rst
  ixpk= 1358, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1188,1189,1190,
 &end
#
#    0 AMB  10-2:1359    79 THR  HN          4.50    (#   1359:10  Single Ambig)
 &rst
  ixpk= 1359, nxpk= 10, iat=  -1,1182, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1= 897, 898, 935, 936,
 &end
#
#   61 LYS  HN           79 THR  HN          5.50    (#   1360:10  Unique         4.67, 5.35 A)
 &rst
  ixpk= 1360, nxpk= 10, iat= 893,1182, r1= 1.30, r2= 1.80, r3= 5.50, r4= 6.00,  &end
#
#   82 ALA  HA           82 ALA  HN          4.50    (#   1363:10  Unique         2.86, 2.94 A)
 &rst
  ixpk= 1363, nxpk= 10, iat=1225,1223, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1364     0 AMB  10-1:1364   3.50    (#   1364:10  Double Ambig)
 &rst
  ixpk= 1364, nxpk= 10, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1531,1215,
 igr2=1544,1223,
 &end
#
#   82 ALA  MB           82 ALA  HN          2.80    (#   1365:10  Unique         2.15, 3.17 A)
 &rst
  ixpk= 1365, nxpk= 10, iat=  -1,1223, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1227,1228,1229,
 &end
#
#  102 ALA  MB          102 ALA  HN          2.80    (#   1366:10  Unique         2.09, 2.98 A)
 &rst
  ixpk= 1366, nxpk= 10, iat=  -1,1544, r1= 1.30, r2= 1.80, r3= 3.36, r4= 3.86,
 igr1=1548,1549,1550,
 &end
#
#   87 GLU  HB+          87 GLU  HN          4.50    (#   1368:10  Unique         2.26, 2.86 A)
 &rst
  ixpk= 1368, nxpk= 10, iat=  -1,1306, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1310,1311,
 &end
#
#   87 GLU  HB-          87 GLU  HN          4.50    (#   1369:10  Unique         2.26, 2.86 A)
 &rst
  ixpk= 1369, nxpk= 10, iat=  -1,1306, r1= 1.30, r2= 1.80, r3= 5.05, r4= 5.55,
 igr1=1310,1311,
 &end
#
#    0 AMB  10-2:1370    87 GLU  HN          5.50    (#   1370:10  Single Ambig)
 &rst
  ixpk= 1370, nxpk= 10, iat=  -1,1306, r1= 1.30, r2= 1.80, r3= 6.93, r4= 7.43,
 igr1=1313,1314,1313,1314,
 &end
#
#   91 ARG  HA           92 LYS  HN          3.50    (#   1371:10  Unique         2.14, 2.55 A)
 &rst
  ixpk= 1371, nxpk= 10, iat=1370,1392, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1373    44 PHE  HN          5.50    (#   1373:10  Single Ambig)
 &rst
  ixpk= 1373, nxpk= 10, iat=  -1, 629, r1= 1.30, r2= 1.80, r3= 8.07, r4= 8.57,
 igr1= 597, 598, 599, 601, 655, 656, 657, 659, 660, 661,
      
 &end
#
#   93 PRO  HA           94 LYS  HN          3.50    (#   1376:10  Unique         2.16, 2.36 A)
 &rst
  ixpk= 1376, nxpk= 10, iat=1424,1428, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
#    0 AMB  10-2:1388   112 LYS  HN          3.50    (#   1388:10  Single Ambig)
 &rst
  ixpk= 1388, nxpk= 10, iat=  -1,1684, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1688,1689,1688,1689,
 &end
#
#    0 AMB  10-2:1389   118 TRP  HN          4.50    (#   1389:10  Single Ambig)
 &rst
  ixpk= 1389, nxpk= 10, iat=  -1,1789, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1778,1779,1778,1779,
 &end
#
#    0 AMB  10-2:1390   118 TRP  HN          3.50    (#   1390:10  Single Ambig)
 &rst
  ixpk= 1390, nxpk= 10, iat=  -1,1789, r1= 1.30, r2= 1.80, r3= 4.41, r4= 4.91,
 igr1=1793,1794,1793,1794,
 &end
#
#  117 GLU  HA          118 TRP  HN          4.50    (#   1391:10  Unique         2.14, 2.48 A)
 &rst
  ixpk= 1391, nxpk= 10, iat=1776,1789, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1392   115 LEU  HN          4.50    (#   1392:10  Single Ambig)
 &rst
  ixpk= 1392, nxpk= 10, iat=  -1,1740, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1722,1723,1722,1723,
 &end
#
#  116 GLU  HA          116 GLU  HN          4.50    (#   1393:10  Unique         2.27, 2.87 A)
 &rst
  ixpk= 1393, nxpk= 10, iat=1761,1759, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
#    0 AMB  10-2:1394   116 GLU  HN          4.50    (#   1394:10  Single Ambig)
 &rst
  ixpk= 1394, nxpk= 10, iat=  -1,1759, r1= 1.30, r2= 1.80, r3= 5.67, r4= 6.17,
 igr1=1744,1745,1744,1745,
 &end
# 2028 atoms read from pdb file prm1.pdb.
# 10 VAL PHI:  (9 SER C)-(10 VAL N)-(10 VAL CA)-(10 VAL C) -144.5 -84.5
 &rst     iat =   129,   131,   133,   145,
   r1 = -145.5, r2 = -144.5, r3 = -84.5, r4 = -83.5,
   rk2 =   2.0, rk3 =   2.0,    &end

# 10 VAL PSI:  (10 VAL N)-(10 VAL CA)-(10 VAL C)-(11 TYR N) 106.3 166.3
 &rst     iat =   131,   133,   145,   147,
   r1 = 105.3, r2 = 106.3, r3 = 166.3, r4 = 167.3,
 &end

# 12 THR PHI:  (11 TYR C)-(12 THR N)-(12 THR CA)-(12 THR C) -133.2 -73.2
 &rst     iat =   166,   168,   170,   180,
   r1 = -134.2, r2 = -133.2, r3 = -73.2, r4 = -72.2,
 &end

# 12 THR PSI:  (12 THR N)-(12 THR CA)-(12 THR C)-(13 GLY N)  97.4 157.4
 &rst     iat =   168,   170,   180,   182,
   r1 =  96.4, r2 =  97.4, r3 = 157.4, r4 = 158.4,
 &end

# 14 LYS PHI:  (13 GLY C)-(14 LYS N)-(14 LYS CA)-(14 LYS C) -157.3 -97.3
 &rst     iat =   187,   189,   191,   209,
   r1 = -158.3, r2 = -157.3, r3 = -97.3, r4 = -96.3,
 &end

# 14 LYS PSI:  (14 LYS N)-(14 LYS CA)-(14 LYS C)-(15 VAL N) 106.3 166.3
 &rst     iat =   189,   191,   209,   211,
   r1 = 105.3, r2 = 106.3, r3 = 166.3, r4 = 167.3,
 &end

# 15 VAL PHI:  (14 LYS C)-(15 VAL N)-(15 VAL CA)-(15 VAL C) -122.2 -62.2
 &rst     iat =   209,   211,   213,   225,
   r1 = -123.2, r2 = -122.2, r3 = -62.2, r4 = -61.2,
 &end

# 15 VAL PSI:  (15 VAL N)-(15 VAL CA)-(15 VAL C)-(16 THR N)  88.3 148.3
 &rst     iat =   211,   213,   225,   227,
   r1 =  87.3, r2 =  88.3, r3 = 148.3, r4 = 149.3,
 &end

# 18 LEU PHI:  (17 GLY C)-(18 LEU N)-(18 LEU CA)-(18 LEU C) -126.1 -66.1
 &rst     iat =   246,   248,   250,   265,
   r1 = -127.1, r2 = -126.1, r3 = -66.1, r4 = -65.1,
 &end

# 18 LEU PSI:  (18 LEU N)-(18 LEU CA)-(18 LEU C)-(19 GLN N) 115.3 175.3
 &rst     iat =   248,   250,   265,   267,
   r1 = 114.3, r2 = 115.3, r3 = 175.3, r4 = 176.3,
 &end

# 23 ALA PHI:  (22 GLY C)-(23 ALA N)-(23 ALA CA)-(23 ALA C) -158.5 -98.5
 &rst     iat =   320,   322,   324,   330,
   r1 = -159.5, r2 = -158.5, r3 = -98.5, r4 = -97.5,
 &end

# 23 ALA PSI:  (23 ALA N)-(23 ALA CA)-(23 ALA C)-(24 PHE N) 110.3 170.3
 &rst     iat =   322,   324,   330,   332,
   r1 = 109.3, r2 = 110.3, r3 = 170.3, r4 = 171.3,
 &end

# 24 PHE PHI:  (23 ALA C)-(24 PHE N)-(24 PHE CA)-(24 PHE C) -129.0 -69.0
 &rst     iat =   330,   332,   334,   350,
   r1 = -130.0, r2 = -129.0, r3 = -69.0, r4 = -68.0,
 &end

# 24 PHE PSI:  (24 PHE N)-(24 PHE CA)-(24 PHE C)-(25 VAL N)  96.8 156.8
 &rst     iat =   332,   334,   350,   352,
   r1 =  95.8, r2 =  96.8, r3 = 156.8, r4 = 157.8,
 &end

# 26 ALA PHI:  (25 VAL C)-(26 ALA N)-(26 ALA CA)-(26 ALA C) -140.9 -80.9
 &rst     iat =   366,   368,   370,   376,
   r1 = -141.9, r2 = -140.9, r3 = -80.9, r4 = -79.9,
 &end

# 26 ALA PSI:  (26 ALA N)-(26 ALA CA)-(26 ALA C)-(27 LEU N)  85.9 145.9
 &rst     iat =   368,   370,   376,   378,
   r1 =  84.9, r2 =  85.9, r3 = 145.9, r4 = 146.9,
 &end

# 34 LEU PHI:  (33 GLY C)-(34 LEU N)-(34 LEU CA)-(34 LEU C) -148.7 -88.7
 &rst     iat =   475,   477,   479,   494,
   r1 = -149.7, r2 = -148.7, r3 = -88.7, r4 = -87.7,
 &end

# 34 LEU PSI:  (34 LEU N)-(34 LEU CA)-(34 LEU C)-(35 VAL N) 102.4 162.4
 &rst     iat =   477,   479,   494,   496,
   r1 = 101.4, r2 = 102.4, r3 = 162.4, r4 = 163.4,
 &end

# 35 VAL PHI:  (34 LEU C)-(35 VAL N)-(35 VAL CA)-(35 VAL C) -127.3 -67.3
 &rst     iat =   494,   496,   498,   510,
   r1 = -128.3, r2 = -127.3, r3 = -67.3, r4 = -66.3,
 &end

# 35 VAL PSI:  (35 VAL N)-(35 VAL CA)-(35 VAL C)-(36 HIS N)  87.3 147.3
 &rst     iat =   496,   498,   510,   512,
   r1 =  86.3, r2 =  87.3, r3 = 147.3, r4 = 148.3,
 &end

# 37 ILE PHI:  (36 HIS C)-(37 ILE N)-(37 ILE CA)-(37 ILE C) -105.6 -45.6
 &rst     iat =   527,   529,   531,   546,
   r1 = -106.6, r2 = -105.6, r3 = -45.6, r4 = -44.6,
 &end

# 37 ILE PSI:  (37 ILE N)-(37 ILE CA)-(37 ILE C)-(38 SER N) -68.6  -8.6
 &rst     iat =   529,   531,   546,   548,
   r1 = -69.6, r2 = -68.6, r3 =  -8.6, r4 =  -7.6,
 &end

# 38 SER PHI:  (37 ILE C)-(38 SER N)-(38 SER CA)-(38 SER C) -114.7 -54.7
 &rst     iat =   546,   548,   550,   557,
   r1 = -115.7, r2 = -114.7, r3 = -54.7, r4 = -53.7,
 &end

# 38 SER PSI:  (38 SER N)-(38 SER CA)-(38 SER C)-(39 GLU N) -53.4   6.6
 &rst     iat =   548,   550,   557,   559,
   r1 = -54.4, r2 = -53.4, r3 =   6.6, r4 =   7.6,
 &end

# 44 PHE PHI:  (43 GLY C)-(44 PHE N)-(44 PHE CA)-(44 PHE C) -121.4 -61.4
 &rst     iat =   626,   628,   630,   646,
   r1 = -122.4, r2 = -121.4, r3 = -61.4, r4 = -60.4,
 &end

# 44 PHE PSI:  (44 PHE N)-(44 PHE CA)-(44 PHE C)-(45 VAL N)  87.8 147.8
 &rst     iat =   628,   630,   646,   648,
   r1 =  86.8, r2 =  87.8, r3 = 147.8, r4 = 148.8,
 &end

# 45 VAL PHI:  (44 PHE C)-(45 VAL N)-(45 VAL CA)-(45 VAL C) -137.8 -77.8
 &rst     iat =   646,   648,   650,   662,
   r1 = -138.8, r2 = -137.8, r3 = -77.8, r4 = -76.8,
 &end

# 45 VAL PSI:  (45 VAL N)-(45 VAL CA)-(45 VAL C)-(46 LYS N)  91.3 151.3
 &rst     iat =   648,   650,   662,   664,
   r1 =  90.3, r2 =  91.3, r3 = 151.3, r4 = 152.3,
 &end

# 47 ASP PSI:  (47 ASP N)-(47 ASP CA)-(47 ASP C)-(48 ILE N)  92.6 152.6
 &rst     iat =   686,   688,   696,   698,
   r1 =  91.6, r2 =  92.6, r3 = 152.6, r4 = 153.6,
 &end

# 48 ILE PHI:  (47 ASP C)-(48 ILE N)-(48 ILE CA)-(48 ILE C) -94.0 -34.0
 &rst     iat =   696,   698,   700,   715,
   r1 = -95.0, r2 = -94.0, r3 = -34.0, r4 = -33.0,
 &end

# 48 ILE PSI:  (48 ILE N)-(48 ILE CA)-(48 ILE C)-(49 ASN N) -66.1  -6.1
 &rst     iat =   698,   700,   715,   717,
   r1 = -67.1, r2 = -66.1, r3 =  -6.1, r4 =  -5.1,
 &end

# 49 ASN PHI:  (48 ILE C)-(49 ASN N)-(49 ASN CA)-(49 ASN C) -97.2 -37.2
 &rst     iat =   715,   717,   719,   729,
   r1 = -98.2, r2 = -97.2, r3 = -37.2, r4 = -36.2,
 &end

# 49 ASN PSI:  (49 ASN N)-(49 ASN CA)-(49 ASN C)-(50 GLU N) -65.7  -5.7
 &rst     iat =   717,   719,   729,   731,
   r1 = -66.7, r2 = -65.7, r3 =  -5.7, r4 =  -4.7,
 &end

# 50 GLU PHI:  (49 ASN C)-(50 GLU N)-(50 GLU CA)-(50 GLU C) -113.3 -53.3
 &rst     iat =   729,   731,   733,   744,
   r1 = -114.3, r2 = -113.3, r3 = -53.3, r4 = -52.3,
 &end

# 50 GLU PSI:  (50 GLU N)-(50 GLU CA)-(50 GLU C)-(51 HIS N) -49.3  10.7
 &rst     iat =   731,   733,   744,   746,
   r1 = -50.3, r2 = -49.3, r3 =  10.7, r4 =  11.7,
 &end

# 53 SER PHI:  (52 LEU C)-(53 SER N)-(53 SER CA)-(53 SER C) -137.5 -77.5
 &rst     iat =   780,   782,   784,   791,
   r1 = -138.5, r2 = -137.5, r3 = -77.5, r4 = -76.5,
 &end

# 53 SER PSI:  (53 SER N)-(53 SER CA)-(53 SER C)-(54 VAL N) 115.5 175.5
 &rst     iat =   782,   784,   791,   793,
   r1 = 114.5, r2 = 115.5, r3 = 175.5, r4 = 176.5,
 &end

# 54 VAL PSI:  (54 VAL N)-(54 VAL CA)-(54 VAL C)-(55 GLY N)  99.3 159.3
 &rst     iat =   793,   795,   807,   809,
   r1 =  98.3, r2 =  99.3, r3 = 159.3, r4 = 160.3,
 &end

# 57 GLU PHI:  (56 ASP C)-(57 GLU N)-(57 GLU CA)-(57 GLU C) -135.1 -75.1
 &rst     iat =   826,   828,   830,   841,
   r1 = -136.1, r2 = -135.1, r3 = -75.1, r4 = -74.1,
 &end

# 57 GLU PSI:  (57 GLU N)-(57 GLU CA)-(57 GLU C)-(58 VAL N) 109.7 169.7
 &rst     iat =   828,   830,   841,   843,
   r1 = 108.7, r2 = 109.7, r3 = 169.7, r4 = 170.7,
 &end

# 60 VAL PHI:  (59 GLN C)-(60 VAL N)-(60 VAL CA)-(60 VAL C) -163.5 -103.5
 &rst     iat =   874,   876,   878,   890,
   r1 = -164.5, r2 = -163.5, r3 = -103.5, r4 = -102.5,
 &end

# 60 VAL PSI:  (60 VAL N)-(60 VAL CA)-(60 VAL C)-(61 LYS N) 122.1 182.1
 &rst     iat =   876,   878,   890,   892,
   r1 = 121.1, r2 = 122.1, r3 = 182.1, r4 = 183.1,
 &end

# 61 LYS PHI:  (60 VAL C)-(61 LYS N)-(61 LYS CA)-(61 LYS C) -156.3 -96.3
 &rst     iat =   890,   892,   894,   912,
   r1 = -157.3, r2 = -156.3, r3 = -96.3, r4 = -95.3,
 &end

# 61 LYS PSI:  (61 LYS N)-(61 LYS CA)-(61 LYS C)-(62 VAL N) 112.9 172.9
 &rst     iat =   892,   894,   912,   914,
   r1 = 111.9, r2 = 112.9, r3 = 172.9, r4 = 173.9,
 &end

# 63 LEU PHI:  (62 VAL C)-(63 LEU N)-(63 LEU CA)-(63 LEU C) -123.9 -63.9
 &rst     iat =   928,   930,   932,   947,
   r1 = -124.9, r2 = -123.9, r3 = -63.9, r4 = -62.9,
 &end

# 63 LEU PSI:  (63 LEU N)-(63 LEU CA)-(63 LEU C)-(64 ALA N) -64.5  -4.5
 &rst     iat =   930,   932,   947,   949,
   r1 = -65.5, r2 = -64.5, r3 =  -4.5, r4 =  -3.5,
 &end

# 65 VAL PHI:  (64 ALA C)-(65 VAL N)-(65 VAL CA)-(65 VAL C) -143.1 -83.1
 &rst     iat =   957,   959,   961,   973,
   r1 = -144.1, r2 = -143.1, r3 = -83.1, r4 = -82.1,
 &end

# 65 VAL PSI:  (65 VAL N)-(65 VAL CA)-(65 VAL C)-(66 ASP N)  99.4 159.4
 &rst     iat =   959,   961,   973,   975,
   r1 =  98.4, r2 =  99.4, r3 = 159.4, r4 = 160.4,
 &end

# 66 ASP PHI:  (65 VAL C)-(66 ASP N)-(66 ASP CA)-(66 ASP C) -139.7 -79.7
 &rst     iat =   973,   975,   977,   985,
   r1 = -140.7, r2 = -139.7, r3 = -79.7, r4 = -78.7,
 &end

# 68 GLU PHI:  (67 GLU C)-(68 GLU N)-(68 GLU CA)-(68 GLU C) -99.3 -39.3
 &rst     iat =  1000,  1002,  1004,  1015,
   r1 = -100.3, r2 = -99.3, r3 = -39.3, r4 = -38.3,
 &end

# 68 GLU PSI:  (68 GLU N)-(68 GLU CA)-(68 GLU C)-(69 LYS N) -59.5   0.5
 &rst     iat =  1002,  1004,  1015,  1017,
   r1 = -60.5, r2 = -59.5, r3 =   0.5, r4 =   1.5,
 &end

# 69 LYS PHI:  (68 GLU C)-(69 LYS N)-(69 LYS CA)-(69 LYS C) -123.8 -63.8
 &rst     iat =  1015,  1017,  1019,  1037,
   r1 = -124.8, r2 = -123.8, r3 = -63.8, r4 = -62.8,
 &end

# 69 LYS PSI:  (69 LYS N)-(69 LYS CA)-(69 LYS C)-(70 GLY N) -37.3  22.7
 &rst     iat =  1017,  1019,  1037,  1039,
   r1 = -38.3, r2 = -37.3, r3 =  22.7, r4 =  23.7,
 &end

# 71 LYS PHI:  (70 GLY C)-(71 LYS N)-(71 LYS CA)-(71 LYS C) -137.3 -77.3
 &rst     iat =  1044,  1046,  1048,  1066,
   r1 = -138.3, r2 = -137.3, r3 = -77.3, r4 = -76.3,
 &end

# 71 LYS PSI:  (71 LYS N)-(71 LYS CA)-(71 LYS C)-(72 ILE N) 114.1 174.1
 &rst     iat =  1046,  1048,  1066,  1068,
   r1 = 113.1, r2 = 114.1, r3 = 174.1, r4 = 175.1,
 &end

# 72 ILE PHI:  (71 LYS C)-(72 ILE N)-(72 ILE CA)-(72 ILE C) -140.4 -80.4
 &rst     iat =  1066,  1068,  1070,  1085,
   r1 = -141.4, r2 = -140.4, r3 = -80.4, r4 = -79.4,
 &end

# 72 ILE PSI:  (72 ILE N)-(72 ILE CA)-(72 ILE C)-(73 SER N)  91.6 151.6
 &rst     iat =  1068,  1070,  1085,  1087,
   r1 =  90.6, r2 =  91.6, r3 = 151.6, r4 = 152.6,
 &end

# 73 SER PHI:  (72 ILE C)-(73 SER N)-(73 SER CA)-(73 SER C) -122.2 -62.2
 &rst     iat =  1085,  1087,  1089,  1096,
   r1 = -123.2, r2 = -122.2, r3 = -62.2, r4 = -61.2,
 &end

# 73 SER PSI:  (73 SER N)-(73 SER CA)-(73 SER C)-(74 LEU N)  99.2 159.2
 &rst     iat =  1087,  1089,  1096,  1098,
   r1 =  98.2, r2 =  99.2, r3 = 159.2, r4 = 160.2,
 &end

# 74 LEU PHI:  (73 SER C)-(74 LEU N)-(74 LEU CA)-(74 LEU C) -166.1 -106.1
 &rst     iat =  1096,  1098,  1100,  1115,
   r1 = -167.1, r2 = -166.1, r3 = -106.1, r4 = -105.1,
 &end

# 74 LEU PSI:  (74 LEU N)-(74 LEU CA)-(74 LEU C)-(75 SER N) 124.2 184.2
 &rst     iat =  1098,  1100,  1115,  1117,
   r1 = 123.2, r2 = 124.2, r3 = 184.2, r4 = 185.2,
 &end

# 75 SER PHI:  (74 LEU C)-(75 SER N)-(75 SER CA)-(75 SER C) -137.2 -77.2
 &rst     iat =  1115,  1117,  1119,  1126,
   r1 = -138.2, r2 = -137.2, r3 = -77.2, r4 = -76.2,
 &end

# 75 SER PSI:  (75 SER N)-(75 SER CA)-(75 SER C)-(76 ILE N)  96.2 156.2
 &rst     iat =  1117,  1119,  1126,  1128,
   r1 =  95.2, r2 =  96.2, r3 = 156.2, r4 = 157.2,
 &end

# 86 LYS PHI:  (85 LYS C)-(86 LYS N)-(86 LYS CA)-(86 LYS C) -117.4 -57.4
 &rst     iat =  1281,  1283,  1285,  1303,
   r1 = -118.4, r2 = -117.4, r3 = -57.4, r4 = -56.4,
 &end

# 86 LYS PSI:  (86 LYS N)-(86 LYS CA)-(86 LYS C)-(87 GLU N) 100.3 160.3
 &rst     iat =  1283,  1285,  1303,  1305,
   r1 =  99.3, r2 = 100.3, r3 = 160.3, r4 = 161.3,
 &end

# 87 GLU PHI:  (86 LYS C)-(87 GLU N)-(87 GLU CA)-(87 GLU C) -118.8 -58.8
 &rst     iat =  1303,  1305,  1307,  1318,
   r1 = -119.8, r2 = -118.8, r3 = -58.8, r4 = -57.8,
 &end

# 87 GLU PSI:  (87 GLU N)-(87 GLU CA)-(87 GLU C)-(88 SER N) 109.3 169.3
 &rst     iat =  1305,  1307,  1318,  1320,
   r1 = 108.3, r2 = 109.3, r3 = 169.3, r4 = 170.3,
 &end

# 96 ALA PHI:  (95 ALA C)-(96 ALA N)-(96 ALA CA)-(96 ALA C) -114.6 -54.6
 &rst     iat =  1457,  1459,  1461,  1467,
   r1 = -115.6, r2 = -114.6, r3 = -54.6, r4 = -53.6,
 &end

# 96 ALA PSI:  (96 ALA N)-(96 ALA CA)-(96 ALA C)-(97 GLN N)  97.2 157.2
 &rst     iat =  1459,  1461,  1467,  1469,
   r1 =  96.2, r2 =  97.2, r3 = 157.2, r4 = 158.2,
 &end

# 97 GLN PHI:  (96 ALA C)-(97 GLN N)-(97 GLN CA)-(97 GLN C) -111.1 -51.1
 &rst     iat =  1467,  1469,  1471,  1484,
   r1 = -112.1, r2 = -111.1, r3 = -51.1, r4 = -50.1,
 &end

# 97 GLN PSI:  (97 GLN N)-(97 GLN CA)-(97 GLN C)-(98 VAL N) 113.2 173.2
 &rst     iat =  1469,  1471,  1484,  1486,
   r1 = 112.2, r2 = 113.2, r3 = 173.2, r4 = 174.2,
 &end

# 100 GLU PSI:  (100 GLU N)-(100 GLU CA)-(100 GLU C)-(101 GLU N) 108.4 168.4
 &rst     iat =  1513,  1515,  1526,  1528,
   r1 = 107.4, r2 = 108.4, r3 = 168.4, r4 = 169.4,
 &end

# 102 ALA PHI:  (101 GLU C)-(102 ALA N)-(102 ALA CA)-(102 ALA C) -109.5 -49.5
 &rst     iat =  1541,  1543,  1545,  1551,
   r1 = -110.5, r2 = -109.5, r3 = -49.5, r4 = -48.5,
 &end

# 109 ASN PSI:  (109 ASN N)-(109 ASN CA)-(109 ASN C)-(110 THR N)  99.8 159.8
 &rst     iat =  1636,  1638,  1648,  1650,
   r1 =  98.8, r2 =  99.8, r3 = 159.8, r4 = 160.8,
 &end

# 114 LYS PHI:  (113 ASP C)-(114 LYS N)-(114 LYS CA)-(114 LYS C) -110.9 -50.9
 &rst     iat =  1715,  1717,  1719,  1737,
   r1 = -111.9, r2 = -110.9, r3 = -50.9, r4 = -49.9,
 &end

# 114 LYS PSI:  (114 LYS N)-(114 LYS CA)-(114 LYS C)-(115 LEU N) 111.7 171.7
 &rst     iat =  1717,  1719,  1737,  1739,
   r1 = 110.7, r2 = 111.7, r3 = 171.7, r4 = 172.7,
 &end

# 124 ARG PSI:  (124 ARG N)-(124 ARG CA)-(124 ARG C)-(125 LYS N) 106.7 166.7
 &rst     iat =  1888,  1890,  1910,  1912,
   r1 = 105.7, r2 = 106.7, r3 = 166.7, r4 = 167.7,
 &end

# 127 LEU PHI:  (126 ASP C)-(127 LEU N)-(127 LEU CA)-(127 LEU C) -106.4 -46.4
 &rst     iat =  1944,  1946,  1948,  1963,
   r1 = -107.4, r2 = -106.4, r3 = -46.4, r4 = -45.4,
 &end

# 127 LEU PSI:  (127 LEU N)-(127 LEU CA)-(127 LEU C)-(128 ILE N) 106.2 166.2
 &rst     iat =  1946,  1948,  1963,  1965,
   r1 = 105.2, r2 = 106.2, r3 = 166.2, r4 = 167.2,
 &end

# 128 ILE PHI:  (127 LEU C)-(128 ILE N)-(128 ILE CA)-(128 ILE C) -127.9 -67.9
 &rst     iat =  1963,  1965,  1967,  1982,
   r1 = -128.9, r2 = -127.9, r3 = -67.9, r4 = -66.9,
 &end

# 128 ILE PSI:  (128 ILE N)-(128 ILE CA)-(128 ILE C)-(129 LYS N)  96.0 156.0
 &rst     iat =  1965,  1967,  1982,  1984,
   r1 =  95.0, r2 =  96.0, r3 = 156.0, r4 = 157.0,
 &end

# 129 LYS PHI:  (128 ILE C)-(129 LYS N)-(129 LYS CA)-(129 LYS C) -107.2 -47.2
 &rst     iat =  1982,  1984,  1986,  2004,
   r1 = -108.2, r2 = -107.2, r3 = -47.2, r4 = -46.2,
 &end

# 129 LYS PSI:  (129 LYS N)-(129 LYS CA)-(129 LYS C)-(130 LYS N) 101.6 161.6
 &rst     iat =  1984,  1986,  2004,  2006,
   r1 = 100.6, r2 = 101.6, r3 = 161.6, r4 = 162.6,
 &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:  N C HA CB
 &rst iat=20,28,23,24, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=30,38,33,34, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=42,47,45,46, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=44,50,48,49, &end
#
#  chirality for residue 4 atoms:  CD NZ HE2 HE3
 &rst iat=50,56,54,55, &end
#
#  chirality for residue 4 atoms:  CG CE HD2 HD3
 &rst iat=47,53,51,52, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=40,60,43,44, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=64,69,67,68, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=62,80,65,66, &end
#
#  chirality for residue 6 atoms:  CA CG HB2 HB3
 &rst iat=84,89,87,88, &end
#
#  chirality for residue 6 atoms:  CB CD HG2 HG3
 &rst iat=86,92,90,91, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=82,95,85,86, &end
#
#  chirality for residue 7 atoms:  CA CG1 CG2 HB
 &rst iat=99,103,107,102, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=97,111,100,101, &end
#
#  chirality for residue 8 atoms:  N C HA2 HA3
 &rst iat=113,118,116,117, &end
#
#  chirality for residue 9 atoms:  CA OG HB2 HB3
 &rst iat=122,127,125,126, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=120,129,123,124, &end
#
#  chirality for residue 10 atoms:  CA CG1 CG2 HB
 &rst iat=133,137,141,136, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=131,145,134,135, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=149,154,152,153, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=147,166,150,151, &end
#
#  chirality for residue 12 atoms:  CA CG2 OG1 HB
 &rst iat=170,174,178,173, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=168,180,171,172, &end
#
#  chirality for residue 13 atoms:  N C HA2 HA3
 &rst iat=182,187,185,186, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=191,196,194,195, &end
#
#  chirality for residue 14 atoms:  CB CD HG2 HG3
 &rst iat=193,199,197,198, &end
#
#  chirality for residue 14 atoms:  CD NZ HE2 HE3
 &rst iat=199,205,203,204, &end
#
#  chirality for residue 14 atoms:  CG CE HD2 HD3
 &rst iat=196,202,200,201, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=189,209,192,193, &end
#
#  chirality for residue 15 atoms:  CA CG1 CG2 HB
 &rst iat=213,217,221,216, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=211,225,214,215, &end
#
#  chirality for residue 16 atoms:  CA CG2 OG1 HB
 &rst iat=229,233,237,232, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=227,239,230,231, &end
#
#  chirality for residue 17 atoms:  N C HA2 HA3
 &rst iat=241,246,244,245, &end
#
#  chirality for residue 18 atoms:  CA CG HB2 HB3
 &rst iat=250,255,253,254, &end
#
#  chirality for residue 18 atoms:  CB CD1 CD2 HG
 &rst iat=252,257,261,256, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=248,265,251,252, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=269,274,272,273, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=271,277,275,276, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=267,282,270,271, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=284,292,287,288, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=296,301,299,300, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=294,313,297,298, &end
#
#  chirality for residue 22 atoms:  N C HA2 HA3
 &rst iat=315,320,318,319, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=322,330,325,326, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=334,339,337,338, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=332,350,335,336, &end
#
#  chirality for residue 25 atoms:  CA CG1 CG2 HB
 &rst iat=354,358,362,357, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=352,366,355,356, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=368,376,371,372, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=380,385,383,384, &end
#
#  chirality for residue 27 atoms:  CB CD1 CD2 HG
 &rst iat=382,387,391,386, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=378,395,381,382, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=399,404,402,403, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=397,407,400,401, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=411,416,414,415, &end
#
#  chirality for residue 29 atoms:  CB CD HG2 HG3
 &rst iat=413,419,417,418, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=409,422,412,413, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=426,431,429,430, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=428,434,432,433, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=424,437,427,428, &end
#
#  chirality for residue 31 atoms:  CA CG2 OG1 HB
 &rst iat=441,445,449,444, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=439,451,442,443, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=455,460,458,459, &end
#
#  chirality for residue 32 atoms:  CB CD HG2 HG3
 &rst iat=457,463,461,462, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=453,468,456,457, &end
#
#  chirality for residue 33 atoms:  N C HA2 HA3
 &rst iat=470,475,473,474, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=479,484,482,483, &end
#
#  chirality for residue 34 atoms:  CB CD1 CD2 HG
 &rst iat=481,486,490,485, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=477,494,480,481, &end
#
#  chirality for residue 35 atoms:  CA CG1 CG2 HB
 &rst iat=498,502,506,501, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=496,510,499,500, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=514,519,517,518, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=512,527,515,516, &end
#
#  chirality for residue 37 atoms:  CA CG2 CG1 HB
 &rst iat=531,535,539,534, &end
#
#  chirality for residue 37 atoms:  CB CD1 HG12 HG13
 &rst iat=533,542,540,541, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=529,546,532,533, &end
#
#  chirality for residue 38 atoms:  CA OG HB2 HB3
 &rst iat=550,555,553,554, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=548,557,551,552, &end
#
#  chirality for residue 39 atoms:  CA CG HB2 HB3
 &rst iat=561,566,564,565, &end
#
#  chirality for residue 39 atoms:  CB CD HG2 HG3
 &rst iat=563,569,567,568, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=559,572,562,563, &end
#
#  chirality for residue 40 atoms:  CA CG1 CG2 HB
 &rst iat=576,580,584,579, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=574,588,577,578, &end
#
#  chirality for residue 41 atoms:  CA CG2 OG1 HB
 &rst iat=592,596,600,595, &end
#
#  chirality for residue 41 atoms:  N C HA CB
 &rst iat=590,602,593,594, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=606,611,609,610, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=604,619,607,608, &end
#
#  chirality for residue 43 atoms:  N C HA2 HA3
 &rst iat=621,626,624,625, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=630,635,633,634, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=628,646,631,632, &end
#
#  chirality for residue 45 atoms:  CA CG1 CG2 HB
 &rst iat=650,654,658,653, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=648,662,651,652, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=666,671,669,670, &end
#
#  chirality for residue 46 atoms:  CB CD HG2 HG3
 &rst iat=668,674,672,673, &end
#
#  chirality for residue 46 atoms:  CD NZ HE2 HE3
 &rst iat=674,680,678,679, &end
#
#  chirality for residue 46 atoms:  CG CE HD2 HD3
 &rst iat=671,677,675,676, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=664,684,667,668, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=688,693,691,692, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=686,696,689,690, &end
#
#  chirality for residue 48 atoms:  CA CG2 CG1 HB
 &rst iat=700,704,708,703, &end
#
#  chirality for residue 48 atoms:  CB CD1 HG12 HG13
 &rst iat=702,711,709,710, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=698,715,701,702, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=719,724,722,723, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=717,729,720,721, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=733,738,736,737, &end
#
#  chirality for residue 50 atoms:  CB CD HG2 HG3
 &rst iat=735,741,739,740, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=731,744,734,735, &end
#
#  chirality for residue 51 atoms:  CA CG HB2 HB3
 &rst iat=748,753,751,752, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=746,761,749,750, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=765,770,768,769, &end
#
#  chirality for residue 52 atoms:  CB CD1 CD2 HG
 &rst iat=767,772,776,771, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=763,780,766,767, &end
#
#  chirality for residue 53 atoms:  CA OG HB2 HB3
 &rst iat=784,789,787,788, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=782,791,785,786, &end
#
#  chirality for residue 54 atoms:  CA CG1 CG2 HB
 &rst iat=795,799,803,798, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=793,807,796,797, &end
#
#  chirality for residue 55 atoms:  N C HA2 HA3
 &rst iat=809,814,812,813, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=818,823,821,822, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=816,826,819,820, &end
#
#  chirality for residue 57 atoms:  CA CG HB2 HB3
 &rst iat=830,835,833,834, &end
#
#  chirality for residue 57 atoms:  CB CD HG2 HG3
 &rst iat=832,838,836,837, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=828,841,831,832, &end
#
#  chirality for residue 58 atoms:  CA CG1 CG2 HB
 &rst iat=845,849,853,848, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=843,857,846,847, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=861,866,864,865, &end
#
#  chirality for residue 59 atoms:  CB CD HG2 HG3
 &rst iat=863,869,867,868, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=859,874,862,863, &end
#
#  chirality for residue 60 atoms:  CA CG1 CG2 HB
 &rst iat=878,882,886,881, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=876,890,879,880, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=894,899,897,898, &end
#
#  chirality for residue 61 atoms:  CB CD HG2 HG3
 &rst iat=896,902,900,901, &end
#
#  chirality for residue 61 atoms:  CD NZ HE2 HE3
 &rst iat=902,908,906,907, &end
#
#  chirality for residue 61 atoms:  CG CE HD2 HD3
 &rst iat=899,905,903,904, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=892,912,895,896, &end
#
#  chirality for residue 62 atoms:  CA CG1 CG2 HB
 &rst iat=916,920,924,919, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=914,928,917,918, &end
#
#  chirality for residue 63 atoms:  CA CG HB2 HB3
 &rst iat=932,937,935,936, &end
#
#  chirality for residue 63 atoms:  CB CD1 CD2 HG
 &rst iat=934,939,943,938, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=930,947,933,934, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=949,957,952,953, &end
#
#  chirality for residue 65 atoms:  CA CG1 CG2 HB
 &rst iat=961,965,969,964, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=959,973,962,963, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=977,982,980,981, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=975,985,978,979, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=989,994,992,993, &end
#
#  chirality for residue 67 atoms:  CB CD HG2 HG3
 &rst iat=991,997,995,996, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=987,1000,990,991, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1004,1009,1007,1008, &end
#
#  chirality for residue 68 atoms:  CB CD HG2 HG3
 &rst iat=1006,1012,1010,1011, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1002,1015,1005,1006, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1019,1024,1022,1023, &end
#
#  chirality for residue 69 atoms:  CB CD HG2 HG3
 &rst iat=1021,1027,1025,1026, &end
#
#  chirality for residue 69 atoms:  CD NZ HE2 HE3
 &rst iat=1027,1033,1031,1032, &end
#
#  chirality for residue 69 atoms:  CG CE HD2 HD3
 &rst iat=1024,1030,1028,1029, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1017,1037,1020,1021, &end
#
#  chirality for residue 70 atoms:  N C HA2 HA3
 &rst iat=1039,1044,1042,1043, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1048,1053,1051,1052, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1050,1056,1054,1055, &end
#
#  chirality for residue 71 atoms:  CD NZ HE2 HE3
 &rst iat=1056,1062,1060,1061, &end
#
#  chirality for residue 71 atoms:  CG CE HD2 HD3
 &rst iat=1053,1059,1057,1058, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1046,1066,1049,1050, &end
#
#  chirality for residue 72 atoms:  CA CG2 CG1 HB
 &rst iat=1070,1074,1078,1073, &end
#
#  chirality for residue 72 atoms:  CB CD1 HG12 HG13
 &rst iat=1072,1081,1079,1080, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1068,1085,1071,1072, &end
#
#  chirality for residue 73 atoms:  CA OG HB2 HB3
 &rst iat=1089,1094,1092,1093, &end
#
#  chirality for residue 73 atoms:  N C HA CB
 &rst iat=1087,1096,1090,1091, &end
#
#  chirality for residue 74 atoms:  CA CG HB2 HB3
 &rst iat=1100,1105,1103,1104, &end
#
#  chirality for residue 74 atoms:  CB CD1 CD2 HG
 &rst iat=1102,1107,1111,1106, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1098,1115,1101,1102, &end
#
#  chirality for residue 75 atoms:  CA OG HB2 HB3
 &rst iat=1119,1124,1122,1123, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1117,1126,1120,1121, &end
#
#  chirality for residue 76 atoms:  CA CG2 CG1 HB
 &rst iat=1130,1134,1138,1133, &end
#
#  chirality for residue 76 atoms:  CB CD1 HG12 HG13
 &rst iat=1132,1141,1139,1140, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1128,1145,1131,1132, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1149,1154,1152,1153, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1151,1157,1155,1156, &end
#
#  chirality for residue 77 atoms:  CG NE HD2 HD3
 &rst iat=1154,1160,1158,1159, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1147,1169,1150,1151, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1171,1179,1174,1175, &end
#
#  chirality for residue 79 atoms:  CA CG2 OG1 HB
 &rst iat=1183,1187,1191,1186, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1181,1193,1184,1185, &end
#
#  chirality for residue 80 atoms:  CA CG HB2 HB3
 &rst iat=1197,1202,1200,1201, &end
#
#  chirality for residue 80 atoms:  CB CD HG2 HG3
 &rst iat=1199,1205,1203,1204, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1195,1210,1198,1199, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1212,1220,1215,1216, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1222,1230,1225,1226, &end
#
#  chirality for residue 83 atoms:  CA CG HB2 HB3
 &rst iat=1242,1236,1240,1241, &end
#
#  chirality for residue 83 atoms:  CB CD HG2 HG3
 &rst iat=1239,1233,1237,1238, &end
#
#  chirality for residue 83 atoms:  CG N HD2 HD3
 &rst iat=1236,1232,1234,1235, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1232,1244,1243,1239, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1248,1253,1251,1252, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1250,1256,1254,1255, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1246,1259,1249,1250, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1263,1268,1266,1267, &end
#
#  chirality for residue 85 atoms:  CB CD HG2 HG3
 &rst iat=1265,1271,1269,1270, &end
#
#  chirality for residue 85 atoms:  CD NZ HE2 HE3
 &rst iat=1271,1277,1275,1276, &end
#
#  chirality for residue 85 atoms:  CG CE HD2 HD3
 &rst iat=1268,1274,1272,1273, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1261,1281,1264,1265, &end
#
#  chirality for residue 86 atoms:  CA CG HB2 HB3
 &rst iat=1285,1290,1288,1289, &end
#
#  chirality for residue 86 atoms:  CB CD HG2 HG3
 &rst iat=1287,1293,1291,1292, &end
#
#  chirality for residue 86 atoms:  CD NZ HE2 HE3
 &rst iat=1293,1299,1297,1298, &end
#
#  chirality for residue 86 atoms:  CG CE HD2 HD3
 &rst iat=1290,1296,1294,1295, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1283,1303,1286,1287, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1307,1312,1310,1311, &end
#
#  chirality for residue 87 atoms:  CB CD HG2 HG3
 &rst iat=1309,1315,1313,1314, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1305,1318,1308,1309, &end
#
#  chirality for residue 88 atoms:  CA OG HB2 HB3
 &rst iat=1322,1327,1325,1326, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1320,1329,1323,1324, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1333,1338,1336,1337, &end
#
#  chirality for residue 89 atoms:  CB CD HG2 HG3
 &rst iat=1335,1341,1339,1340, &end
#
#  chirality for residue 89 atoms:  CD NZ HE2 HE3
 &rst iat=1341,1347,1345,1346, &end
#
#  chirality for residue 89 atoms:  CG CE HD2 HD3
 &rst iat=1338,1344,1342,1343, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1331,1351,1334,1335, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1363,1357,1361,1362, &end
#
#  chirality for residue 90 atoms:  CB CD HG2 HG3
 &rst iat=1360,1354,1358,1359, &end
#
#  chirality for residue 90 atoms:  CG N HD2 HD3
 &rst iat=1357,1353,1355,1356, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1353,1365,1364,1360, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1369,1374,1372,1373, &end
#
#  chirality for residue 91 atoms:  CB CD HG2 HG3
 &rst iat=1371,1377,1375,1376, &end
#
#  chirality for residue 91 atoms:  CG NE HD2 HD3
 &rst iat=1374,1380,1378,1379, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1367,1389,1370,1371, &end
#
#  chirality for residue 92 atoms:  CA CG HB2 HB3
 &rst iat=1393,1398,1396,1397, &end
#
#  chirality for residue 92 atoms:  CB CD HG2 HG3
 &rst iat=1395,1401,1399,1400, &end
#
#  chirality for residue 92 atoms:  CD NZ HE2 HE3
 &rst iat=1401,1407,1405,1406, &end
#
#  chirality for residue 92 atoms:  CG CE HD2 HD3
 &rst iat=1398,1404,1402,1403, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1391,1411,1394,1395, &end
#
#  chirality for residue 93 atoms:  CA CG HB2 HB3
 &rst iat=1423,1417,1421,1422, &end
#
#  chirality for residue 93 atoms:  CB CD HG2 HG3
 &rst iat=1420,1414,1418,1419, &end
#
#  chirality for residue 93 atoms:  CG N HD2 HD3
 &rst iat=1417,1413,1415,1416, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1413,1425,1424,1420, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1429,1434,1432,1433, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1431,1437,1435,1436, &end
#
#  chirality for residue 94 atoms:  CD NZ HE2 HE3
 &rst iat=1437,1443,1441,1442, &end
#
#  chirality for residue 94 atoms:  CG CE HD2 HD3
 &rst iat=1434,1440,1438,1439, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1427,1447,1430,1431, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1449,1457,1452,1453, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1459,1467,1462,1463, &end
#
#  chirality for residue 97 atoms:  CA CG HB2 HB3
 &rst iat=1471,1476,1474,1475, &end
#
#  chirality for residue 97 atoms:  CB CD HG2 HG3
 &rst iat=1473,1479,1477,1478, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1469,1484,1472,1473, &end
#
#  chirality for residue 98 atoms:  CA CG1 CG2 HB
 &rst iat=1488,1492,1496,1491, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1486,1500,1489,1490, &end
#
#  chirality for residue 99 atoms:  CA OG HB2 HB3
 &rst iat=1504,1509,1507,1508, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1502,1511,1505,1506, &end
#
#  chirality for residue 100 atoms:  CA CG HB2 HB3
 &rst iat=1515,1520,1518,1519, &end
#
#  chirality for residue 100 atoms:  CB CD HG2 HG3
 &rst iat=1517,1523,1521,1522, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1513,1526,1516,1517, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1530,1535,1533,1534, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=1532,1538,1536,1537, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1528,1541,1531,1532, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1543,1551,1546,1547, &end
#
#  chirality for residue 103 atoms:  CA OG HB2 HB3
 &rst iat=1555,1560,1558,1559, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1553,1562,1556,1557, &end
#
#  chirality for residue 104 atoms:  CA CG2 OG1 HB
 &rst iat=1566,1570,1574,1569, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1564,1576,1567,1568, &end
#
#  chirality for residue 105 atoms:  CA CG HB2 HB3
 &rst iat=1588,1582,1586,1587, &end
#
#  chirality for residue 105 atoms:  CB CD HG2 HG3
 &rst iat=1585,1579,1583,1584, &end
#
#  chirality for residue 105 atoms:  CG N HD2 HD3
 &rst iat=1582,1578,1580,1581, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1578,1590,1589,1585, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1594,1599,1597,1598, &end
#
#  chirality for residue 106 atoms:  CB CD HG2 HG3
 &rst iat=1596,1602,1600,1601, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1592,1607,1595,1596, &end
#
#  chirality for residue 107 atoms:  N C HA2 HA3
 &rst iat=1609,1614,1612,1613, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1618,1623,1621,1622, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1616,1634,1619,1620, &end
#
#  chirality for residue 109 atoms:  CA CG HB2 HB3
 &rst iat=1638,1643,1641,1642, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1636,1648,1639,1640, &end
#
#  chirality for residue 110 atoms:  CA CG2 OG1 HB
 &rst iat=1652,1656,1660,1655, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1650,1662,1653,1654, &end
#
#  chirality for residue 111 atoms:  CA CG HB2 HB3
 &rst iat=1666,1671,1669,1670, &end
#
#  chirality for residue 111 atoms:  CB CD1 CD2 HG
 &rst iat=1668,1673,1677,1672, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1664,1681,1667,1668, &end
#
#  chirality for residue 112 atoms:  CA CG HB2 HB3
 &rst iat=1685,1690,1688,1689, &end
#
#  chirality for residue 112 atoms:  CB CD HG2 HG3
 &rst iat=1687,1693,1691,1692, &end
#
#  chirality for residue 112 atoms:  CD NZ HE2 HE3
 &rst iat=1693,1699,1697,1698, &end
#
#  chirality for residue 112 atoms:  CG CE HD2 HD3
 &rst iat=1690,1696,1694,1695, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1683,1703,1686,1687, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1707,1712,1710,1711, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1705,1715,1708,1709, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1719,1724,1722,1723, &end
#
#  chirality for residue 114 atoms:  CB CD HG2 HG3
 &rst iat=1721,1727,1725,1726, &end
#
#  chirality for residue 114 atoms:  CD NZ HE2 HE3
 &rst iat=1727,1733,1731,1732, &end
#
#  chirality for residue 114 atoms:  CG CE HD2 HD3
 &rst iat=1724,1730,1728,1729, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1717,1737,1720,1721, &end
#
#  chirality for residue 115 atoms:  CA CG HB2 HB3
 &rst iat=1741,1746,1744,1745, &end
#
#  chirality for residue 115 atoms:  CB CD1 CD2 HG
 &rst iat=1743,1748,1752,1747, &end
#
#  chirality for residue 115 atoms:  N C HA CB
 &rst iat=1739,1756,1742,1743, &end
#
#  chirality for residue 116 atoms:  CA CG HB2 HB3
 &rst iat=1760,1765,1763,1764, &end
#
#  chirality for residue 116 atoms:  CB CD HG2 HG3
 &rst iat=1762,1768,1766,1767, &end
#
#  chirality for residue 116 atoms:  N C HA CB
 &rst iat=1758,1771,1761,1762, &end
#
#  chirality for residue 117 atoms:  CA CG HB2 HB3
 &rst iat=1775,1780,1778,1779, &end
#
#  chirality for residue 117 atoms:  CB CD HG2 HG3
 &rst iat=1777,1783,1781,1782, &end
#
#  chirality for residue 117 atoms:  N C HA CB
 &rst iat=1773,1786,1776,1777, &end
#
#  chirality for residue 118 atoms:  CA CG HB2 HB3
 &rst iat=1790,1795,1793,1794, &end
#
#  chirality for residue 118 atoms:  N C HA CB
 &rst iat=1788,1810,1791,1792, &end
#
#  chirality for residue 119 atoms:  CA CG2 CG1 HB
 &rst iat=1814,1818,1822,1817, &end
#
#  chirality for residue 119 atoms:  CB CD1 HG12 HG13
 &rst iat=1816,1825,1823,1824, &end
#
#  chirality for residue 119 atoms:  N C HA CB
 &rst iat=1812,1829,1815,1816, &end
#
#  chirality for residue 120 atoms:  CA CG HB2 HB3
 &rst iat=1833,1838,1836,1837, &end
#
#  chirality for residue 120 atoms:  CB CD HG2 HG3
 &rst iat=1835,1841,1839,1840, &end
#
#  chirality for residue 120 atoms:  N C HA CB
 &rst iat=1831,1844,1834,1835, &end
#
#  chirality for residue 121 atoms:  CA CG HB2 HB3
 &rst iat=1848,1853,1851,1852, &end
#
#  chirality for residue 121 atoms:  CB SD HG2 HG3
 &rst iat=1850,1856,1854,1855, &end
#
#  chirality for residue 121 atoms:  N C HA CB
 &rst iat=1846,1861,1849,1850, &end
#
#  chirality for residue 122 atoms:  CA OG HB2 HB3
 &rst iat=1865,1870,1868,1869, &end
#
#  chirality for residue 122 atoms:  N C HA CB
 &rst iat=1863,1872,1866,1867, &end
#
#  chirality for residue 123 atoms:  CA CG HB2 HB3
 &rst iat=1876,1881,1879,1880, &end
#
#  chirality for residue 123 atoms:  N C HA CB
 &rst iat=1874,1886,1877,1878, &end
#
#  chirality for residue 124 atoms:  CA CG HB2 HB3
 &rst iat=1890,1895,1893,1894, &end
#
#  chirality for residue 124 atoms:  CB CD HG2 HG3
 &rst iat=1892,1898,1896,1897, &end
#
#  chirality for residue 124 atoms:  CG NE HD2 HD3
 &rst iat=1895,1901,1899,1900, &end
#
#  chirality for residue 124 atoms:  N C HA CB
 &rst iat=1888,1910,1891,1892, &end
#
#  chirality for residue 125 atoms:  CA CG HB2 HB3
 &rst iat=1914,1919,1917,1918, &end
#
#  chirality for residue 125 atoms:  CB CD HG2 HG3
 &rst iat=1916,1922,1920,1921, &end
#
#  chirality for residue 125 atoms:  CD NZ HE2 HE3
 &rst iat=1922,1928,1926,1927, &end
#
#  chirality for residue 125 atoms:  CG CE HD2 HD3
 &rst iat=1919,1925,1923,1924, &end
#
#  chirality for residue 125 atoms:  N C HA CB
 &rst iat=1912,1932,1915,1916, &end
#
#  chirality for residue 126 atoms:  CA CG HB2 HB3
 &rst iat=1936,1941,1939,1940, &end
#
#  chirality for residue 126 atoms:  N C HA CB
 &rst iat=1934,1944,1937,1938, &end
#
#  chirality for residue 127 atoms:  CA CG HB2 HB3
 &rst iat=1948,1953,1951,1952, &end
#
#  chirality for residue 127 atoms:  CB CD1 CD2 HG
 &rst iat=1950,1955,1959,1954, &end
#
#  chirality for residue 127 atoms:  N C HA CB
 &rst iat=1946,1963,1949,1950, &end
#
#  chirality for residue 128 atoms:  CA CG2 CG1 HB
 &rst iat=1967,1971,1975,1970, &end
#
#  chirality for residue 128 atoms:  CB CD1 HG12 HG13
 &rst iat=1969,1978,1976,1977, &end
#
#  chirality for residue 128 atoms:  N C HA CB
 &rst iat=1965,1982,1968,1969, &end
#
#  chirality for residue 129 atoms:  CA CG HB2 HB3
 &rst iat=1986,1991,1989,1990, &end
#
#  chirality for residue 129 atoms:  CB CD HG2 HG3
 &rst iat=1988,1994,1992,1993, &end
#
#  chirality for residue 129 atoms:  CD NZ HE2 HE3
 &rst iat=1994,2000,1998,1999, &end
#
#  chirality for residue 129 atoms:  CG CE HD2 HD3
 &rst iat=1991,1997,1995,1996, &end
#
#  chirality for residue 129 atoms:  N C HA CB
 &rst iat=1984,2004,1987,1988, &end
#
#  chirality for residue 130 atoms:  CA CG HB2 HB3
 &rst iat=2008,2013,2011,2012, &end
#
#  chirality for residue 130 atoms:  CB CD HG2 HG3
 &rst iat=2010,2016,2014,2015, &end
#
#  chirality for residue 130 atoms:  CD NZ HE2 HE3
 &rst iat=2016,2022,2020,2021, &end
#
#  chirality for residue 130 atoms:  CG CE HD2 HD3
 &rst iat=2013,2019,2017,2018, &end
#
#  chirality for residue 130 atoms:  N C HA CB
 &rst iat=2006,2026,2009,2010, &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=32,30,28,22, &end
#
#  trans-omega constraint for residue 4
 &rst iat=42,40,38,32, &end
#
#  trans-omega constraint for residue 5
 &rst iat=64,62,60,42, &end
#
#  trans-omega constraint for residue 6
 &rst iat=84,82,80,64, &end
#
#  trans-omega constraint for residue 7
 &rst iat=99,97,95,84, &end
#
#  trans-omega constraint for residue 8
 &rst iat=115,113,111,99, &end
#
#  trans-omega constraint for residue 9
 &rst iat=122,120,118,115, &end
#
#  trans-omega constraint for residue 10
 &rst iat=133,131,129,122, &end
#
#  trans-omega constraint for residue 11
 &rst iat=149,147,145,133, &end
#
#  trans-omega constraint for residue 12
 &rst iat=170,168,166,149, &end
#
#  trans-omega constraint for residue 13
 &rst iat=184,182,180,170, &end
#
#  trans-omega constraint for residue 14
 &rst iat=191,189,187,184, &end
#
#  trans-omega constraint for residue 15
 &rst iat=213,211,209,191, &end
#
#  trans-omega constraint for residue 16
 &rst iat=229,227,225,213, &end
#
#  trans-omega constraint for residue 17
 &rst iat=243,241,239,229, &end
#
#  trans-omega constraint for residue 18
 &rst iat=250,248,246,243, &end
#
#  trans-omega constraint for residue 19
 &rst iat=269,267,265,250, &end
#
#  trans-omega constraint for residue 20
 &rst iat=286,284,282,269, &end
#
#  trans-omega constraint for residue 21
 &rst iat=296,294,292,286, &end
#
#  trans-omega constraint for residue 22
 &rst iat=317,315,313,296, &end
#
#  trans-omega constraint for residue 23
 &rst iat=324,322,320,317, &end
#
#  trans-omega constraint for residue 24
 &rst iat=334,332,330,324, &end
#
#  trans-omega constraint for residue 25
 &rst iat=354,352,350,334, &end
#
#  trans-omega constraint for residue 26
 &rst iat=370,368,366,354, &end
#
#  trans-omega constraint for residue 27
 &rst iat=380,378,376,370, &end
#
#  trans-omega constraint for residue 28
 &rst iat=399,397,395,380, &end
#
#  trans-omega constraint for residue 29
 &rst iat=411,409,407,399, &end
#
#  trans-omega constraint for residue 30
 &rst iat=426,424,422,411, &end
#
#  trans-omega constraint for residue 31
 &rst iat=441,439,437,426, &end
#
#  trans-omega constraint for residue 32
 &rst iat=455,453,451,441, &end
#
#  trans-omega constraint for residue 33
 &rst iat=472,470,468,455, &end
#
#  trans-omega constraint for residue 34
 &rst iat=479,477,475,472, &end
#
#  trans-omega constraint for residue 35
 &rst iat=498,496,494,479, &end
#
#  trans-omega constraint for residue 36
 &rst iat=514,512,510,498, &end
#
#  trans-omega constraint for residue 37
 &rst iat=531,529,527,514, &end
#
#  trans-omega constraint for residue 38
 &rst iat=550,548,546,531, &end
#
#  trans-omega constraint for residue 39
 &rst iat=561,559,557,550, &end
#
#  trans-omega constraint for residue 40
 &rst iat=576,574,572,561, &end
#
#  trans-omega constraint for residue 41
 &rst iat=592,590,588,576, &end
#
#  trans-omega constraint for residue 42
 &rst iat=606,604,602,592, &end
#
#  trans-omega constraint for residue 43
 &rst iat=623,621,619,606, &end
#
#  trans-omega constraint for residue 44
 &rst iat=630,628,626,623, &end
#
#  trans-omega constraint for residue 45
 &rst iat=650,648,646,630, &end
#
#  trans-omega constraint for residue 46
 &rst iat=666,664,662,650, &end
#
#  trans-omega constraint for residue 47
 &rst iat=688,686,684,666, &end
#
#  trans-omega constraint for residue 48
 &rst iat=700,698,696,688, &end
#
#  trans-omega constraint for residue 49
 &rst iat=719,717,715,700, &end
#
#  trans-omega constraint for residue 50
 &rst iat=733,731,729,719, &end
#
#  trans-omega constraint for residue 51
 &rst iat=748,746,744,733, &end
#
#  trans-omega constraint for residue 52
 &rst iat=765,763,761,748, &end
#
#  trans-omega constraint for residue 53
 &rst iat=784,782,780,765, &end
#
#  trans-omega constraint for residue 54
 &rst iat=795,793,791,784, &end
#
#  trans-omega constraint for residue 55
 &rst iat=811,809,807,795, &end
#
#  trans-omega constraint for residue 56
 &rst iat=818,816,814,811, &end
#
#  trans-omega constraint for residue 57
 &rst iat=830,828,826,818, &end
#
#  trans-omega constraint for residue 58
 &rst iat=845,843,841,830, &end
#
#  trans-omega constraint for residue 59
 &rst iat=861,859,857,845, &end
#
#  trans-omega constraint for residue 60
 &rst iat=878,876,874,861, &end
#
#  trans-omega constraint for residue 61
 &rst iat=894,892,890,878, &end
#
#  trans-omega constraint for residue 62
 &rst iat=916,914,912,894, &end
#
#  trans-omega constraint for residue 63
 &rst iat=932,930,928,916, &end
#
#  trans-omega constraint for residue 64
 &rst iat=951,949,947,932, &end
#
#  trans-omega constraint for residue 65
 &rst iat=961,959,957,951, &end
#
#  trans-omega constraint for residue 66
 &rst iat=977,975,973,961, &end
#
#  trans-omega constraint for residue 67
 &rst iat=989,987,985,977, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1004,1002,1000,989, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1019,1017,1015,1004, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1041,1039,1037,1019, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1048,1046,1044,1041, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1070,1068,1066,1048, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1089,1087,1085,1070, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1100,1098,1096,1089, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1119,1117,1115,1100, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1130,1128,1126,1119, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1149,1147,1145,1130, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1173,1171,1169,1149, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1183,1181,1179,1173, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1197,1195,1193,1183, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1214,1212,1210,1197, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1224,1222,1220,1214, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1242,1232,1230,1224, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1248,1246,1244,1242, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1263,1261,1259,1248, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1285,1283,1281,1263, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1307,1305,1303,1285, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1322,1320,1318,1307, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1333,1331,1329,1322, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1363,1353,1351,1333, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1369,1367,1365,1363, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1393,1391,1389,1369, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1423,1413,1411,1393, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1429,1427,1425,1423, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1451,1449,1447,1429, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1461,1459,1457,1451, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1471,1469,1467,1461, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1488,1486,1484,1471, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1504,1502,1500,1488, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1515,1513,1511,1504, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1530,1528,1526,1515, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1545,1543,1541,1530, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1555,1553,1551,1545, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1566,1564,1562,1555, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1588,1578,1576,1566, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1594,1592,1590,1588, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1611,1609,1607,1594, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1618,1616,1614,1611, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1638,1636,1634,1618, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1652,1650,1648,1638, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1666,1664,1662,1652, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1685,1683,1681,1666, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1707,1705,1703,1685, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1719,1717,1715,1707, &end
#
#  trans-omega constraint for residue 115
 &rst iat=1741,1739,1737,1719, &end
#
#  trans-omega constraint for residue 116
 &rst iat=1760,1758,1756,1741, &end
#
#  trans-omega constraint for residue 117
 &rst iat=1775,1773,1771,1760, &end
#
#  trans-omega constraint for residue 118
 &rst iat=1790,1788,1786,1775, &end
#
#  trans-omega constraint for residue 119
 &rst iat=1814,1812,1810,1790, &end
#
#  trans-omega constraint for residue 120
 &rst iat=1833,1831,1829,1814, &end
#
#  trans-omega constraint for residue 121
 &rst iat=1848,1846,1844,1833, &end
#
#  trans-omega constraint for residue 122
 &rst iat=1865,1863,1861,1848, &end
#
#  trans-omega constraint for residue 123
 &rst iat=1876,1874,1872,1865, &end
#
#  trans-omega constraint for residue 124
 &rst iat=1890,1888,1886,1876, &end
#
#  trans-omega constraint for residue 125
 &rst iat=1914,1912,1910,1890, &end
#
#  trans-omega constraint for residue 126
 &rst iat=1936,1934,1932,1914, &end
#
#  trans-omega constraint for residue 127
 &rst iat=1948,1946,1944,1936, &end
#
#  trans-omega constraint for residue 128
 &rst iat=1967,1965,1963,1948, &end
#
#  trans-omega constraint for residue 129
 &rst iat=1986,1984,1982,1967, &end
#
#  trans-omega constraint for residue 130
 &rst iat=2008,2006,2004,1986, &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1   0.336 -22.108   3.133
    2    H2   MET   1           H2       MET   1  -0.965 -21.985   4.127
    3    H3   MET   1           H3       MET   1  -0.191 -20.604   3.517
    4    HA   MET   1           HA       MET   1  -2.354 -21.967   2.519
    5    HB2  MET   1           2HB      MET   1  -1.980 -19.510   2.503
    6    HB3  MET   1           3HB      MET   1  -0.696 -19.732   1.304
    7    HG2  MET   1           2HG      MET   1  -2.796 -19.019   0.263
    8    HG3  MET   1           3HG      MET   1  -2.284 -20.614  -0.306
    9    HE1  MET   1           3HE      MET   1  -5.177 -19.404  -0.839
   10    HE2  MET   1           1HE      MET   1  -4.655 -21.009  -1.402
   11    HE3  MET   1           2HE      MET   1  -6.196 -20.829  -0.530
   12    H    ALA   2           H        ALA   2   0.158 -21.150   0.146
   13    HA   ALA   2           HA       ALA   2   0.783 -23.890  -0.591
   14    HB1  ALA   2           1HB      ALA   2  -1.186 -22.297  -2.303
   15    HB2  ALA   2           2HB      ALA   2  -0.377 -23.805  -2.785
   16    HB3  ALA   2           3HB      ALA   2  -1.542 -23.818  -1.449
   17    H    ALA   3           H        ALA   3   2.193 -23.874  -2.482
   18    HA   ALA   3           HA       ALA   3   2.847 -21.364  -3.849
   19    HB1  ALA   3           1HB      ALA   3   4.945 -22.901  -2.251
   20    HB2  ALA   3           2HB      ALA   3   5.275 -21.592  -3.407
   21    HB3  ALA   3           3HB      ALA   3   4.380 -21.247  -1.913
   22    H    LYS   4           H        LYS   4   3.785 -21.774  -5.831
   23    HA   LYS   4           HA       LYS   4   4.687 -24.464  -6.629
   24    HB2  LYS   4           2HB      LYS   4   3.134 -24.603  -8.503
   25    HB3  LYS   4           3HB      LYS   4   2.304 -24.639  -6.941
   26    HG2  LYS   4           2HG      LYS   4   1.714 -22.201  -7.254
   27    HG3  LYS   4           3HG      LYS   4   2.430 -22.286  -8.879
   28    HD2  LYS   4           2HD      LYS   4   0.826 -24.083  -9.485
   29    HD3  LYS   4           3HD      LYS   4   0.109 -23.989  -7.858
   30    HE2  LYS   4           2HE      LYS   4  -0.496 -21.618  -8.267
   31    HE3  LYS   4           3HE      LYS   4   0.203 -21.728  -9.900
   32    HZ1  LYS   4           3HZ      LYS   4  -1.451 -23.399 -10.418
   33    HZ2  LYS   4           1HZ      LYS   4  -2.112 -23.292  -8.900
   34    HZ3  LYS   4           2HZ      LYS   4  -2.179 -22.013  -9.924
   35    H    PHE   5           H        PHE   5   5.905 -21.906  -6.242
   36    HA   PHE   5           HA       PHE   5   7.238 -21.593  -8.879
   37    HB2  PHE   5           2HB      PHE   5   6.270 -19.355  -7.041
   38    HB3  PHE   5           3HB      PHE   5   7.481 -19.148  -8.308
   39    HD1  PHE   5           HD1      PHE   5   3.929 -20.260  -7.807
   40    HD2  PHE   5           HD2      PHE   5   6.819 -18.454 -10.440
   41    HE1  PHE   5           HE1      PHE   5   2.136 -19.809  -9.471
   42    HE2  PHE   5           HE2      PHE   5   5.001 -17.932 -12.053
   43    HZ   PHE   5           HZ       PHE   5   2.671 -18.627 -11.593
   44    H    GLU   6           H        GLU   6   9.487 -20.581  -8.452
   45    HA   GLU   6           HA       GLU   6  10.492 -20.883  -5.684
   46    HB2  GLU   6           2HB      GLU   6  10.763 -23.059  -6.939
   47    HB3  GLU   6           3HB      GLU   6  11.800 -22.193  -8.092
   48    HG2  GLU   6           2HG      GLU   6  13.415 -21.691  -6.319
   49    HG3  GLU   6           3HG      GLU   6  12.323 -22.359  -5.098
   50    H    VAL   7           H        VAL   7  12.269 -19.646  -5.293
   51    HA   VAL   7           HA       VAL   7  12.538 -17.148  -6.528
   52    HB   VAL   7           HB       VAL   7  14.500 -16.889  -5.082
   53   HG11  VAL   7          1HG1      VAL   7  12.276 -18.528  -3.756
   54   HG12  VAL   7          2HG1      VAL   7  13.419 -17.467  -2.916
   55   HG13  VAL   7          3HG1      VAL   7  12.249 -16.790  -4.072
   56   HG21  VAL   7          3HG2      VAL   7  14.307 -19.874  -4.525
   57   HG22  VAL   7          1HG2      VAL   7  15.612 -19.056  -5.407
   58   HG23  VAL   7          2HG2      VAL   7  15.358 -18.709  -3.687
   59    H    GLY   8           H        GLY   8  13.691 -16.208  -7.971
   60    HA2  GLY   8           2HA      GLY   8  15.361 -15.897  -9.544
   61    HA3  GLY   8           3HA      GLY   8  15.869 -17.588  -9.364
   62    H    SER   9           H        SER   9  12.770 -18.261  -9.753
   63    HA   SER   9           HA       SER   9  12.862 -18.728 -12.571
   64    HB2  SER   9           2HB      SER   9  10.385 -18.601 -10.823
   65    HB3  SER   9           3HB      SER   9  10.621 -19.515 -12.331
   66    HG   SER   9           HG       SER   9  10.829 -20.833 -10.437
   67    H    VAL  10           H        VAL  10  11.154 -17.955 -14.107
   68    HA   VAL  10           HA       VAL  10  10.392 -15.106 -13.770
   69    HB   VAL  10           HB       VAL  10  11.948 -16.264 -16.122
   70   HG11  VAL  10          1HG1      VAL  10  10.864 -13.441 -15.683
   71   HG12  VAL  10          2HG1      VAL  10  11.887 -13.958 -17.042
   72   HG13  VAL  10          3HG1      VAL  10  10.251 -14.614 -16.868
   73   HG21  VAL  10          3HG2      VAL  10  12.757 -14.108 -14.138
   74   HG22  VAL  10          1HG2      VAL  10  13.443 -15.746 -14.247
   75   HG23  VAL  10          2HG2      VAL  10  13.677 -14.601 -15.577
   76    H    TYR  11           H        TYR  11   8.354 -14.844 -14.367
   77    HA   TYR  11           HA       TYR  11   7.037 -16.645 -16.331
   78    HB2  TYR  11           2HB      TYR  11   6.278 -16.268 -13.435
   79    HB3  TYR  11           3HB      TYR  11   5.103 -16.806 -14.639
   80    HD1  TYR  11           HD1      TYR  11   5.421 -19.002 -15.832
   81    HD2  TYR  11           HD2      TYR  11   7.914 -17.803 -12.525
   82    HE1  TYR  11           HE1      TYR  11   6.090 -21.366 -15.495
   83    HE2  TYR  11           HE2      TYR  11   8.519 -20.187 -12.120
   84    HH   TYR  11           HH       TYR  11   7.280 -22.837 -14.213
   85    H    THR  12           H        THR  12   4.679 -15.796 -16.632
   86    HA   THR  12           HA       THR  12   4.785 -12.813 -16.748
   87    HB   THR  12           HB       THR  12   3.518 -14.672 -18.774
   88    HG1  THR  12           1HG      THR  12   5.404 -14.273 -20.013
   89   HG21  THR  12          1HG2      THR  12   4.447 -11.771 -18.981
   90   HG22  THR  12          2HG2      THR  12   3.715 -12.722 -20.291
   91   HG23  THR  12          3HG2      THR  12   2.759 -12.310 -18.858
   92    H    GLY  13           H        GLY  13   2.912 -11.675 -16.429
   93    HA2  GLY  13           2HA      GLY  13   0.462 -12.996 -15.521
   94    HA3  GLY  13           3HA      GLY  13   1.426 -12.214 -14.251
   95    H    LYS  14           H        LYS  14  -0.764 -10.970 -14.235
   96    HA   LYS  14           HA       LYS  14  -0.496  -8.585 -16.028
   97    HB2  LYS  14           2HB      LYS  14  -2.958 -10.218 -15.372
   98    HB3  LYS  14           3HB      LYS  14  -3.088  -8.490 -15.771
   99    HG2  LYS  14           2HG      LYS  14  -1.914  -8.879 -17.906
  100    HG3  LYS  14           3HG      LYS  14  -1.765 -10.607 -17.519
  101    HD2  LYS  14           2HD      LYS  14  -4.235 -10.815 -17.504
  102    HD3  LYS  14           3HD      LYS  14  -4.382  -9.081 -17.891
  103    HE2  LYS  14           2HE      LYS  14  -3.134  -9.439 -19.994
  104    HE3  LYS  14           3HE      LYS  14  -2.960 -11.163 -19.610
  105    HZ1  LYS  14           3HZ      LYS  14  -5.357 -11.364 -19.715
  106    HZ2  LYS  14           1HZ      LYS  14  -5.515  -9.757 -20.073
  107    HZ3  LYS  14           2HZ      LYS  14  -4.768 -10.774 -21.131
  108    H    VAL  15           H        VAL  15  -0.731  -6.657 -15.161
  109    HA   VAL  15           HA       VAL  15  -0.243  -6.455 -12.320
  110    HB   VAL  15           HB       VAL  15  -0.876  -4.204 -14.253
  111   HG11  VAL  15          1HG1      VAL  15   0.875  -4.375 -11.750
  112   HG12  VAL  15          2HG1      VAL  15   0.640  -2.925 -12.751
  113   HG13  VAL  15          3HG1      VAL  15  -0.723  -3.605 -11.845
  114   HG21  VAL  15          3HG2      VAL  15   1.833  -5.504 -13.828
  115   HG22  VAL  15          1HG2      VAL  15   0.871  -5.538 -15.320
  116   HG23  VAL  15          2HG2      VAL  15   1.516  -4.009 -14.736
  117    H    THR  16           H        THR  16  -1.654  -6.324 -10.760
  118    HA   THR  16           HA       THR  16  -4.529  -5.809 -11.353
  119    HB   THR  16           HB       THR  16  -4.690  -7.042  -9.048
  120    HG1  THR  16           1HG      THR  16  -2.943  -8.498  -8.767
  121   HG21  THR  16          1HG2      THR  16  -3.764  -8.514 -11.557
  122   HG22  THR  16          2HG2      THR  16  -4.659  -9.225 -10.192
  123   HG23  THR  16          3HG2      THR  16  -5.431  -8.002 -11.208
  124    H    GLY  17           H        GLY  17  -1.830  -4.292  -9.767
  125    HA2  GLY  17           2HA      GLY  17  -3.523  -2.028  -9.274
  126    HA3  GLY  17           3HA      GLY  17  -3.096  -2.829  -7.750
  127    H    LEU  18           H        LEU  18  -2.293  -0.256  -8.228
  128    HA   LEU  18           HA       LEU  18   0.665  -0.561  -8.212
  129    HB2  LEU  18           2HB      LEU  18  -0.928   1.738  -9.364
  130    HB3  LEU  18           3HB      LEU  18   0.822   1.760  -9.097
  131    HG   LEU  18           HG       LEU  18  -0.648  -0.044 -11.068
  132   HD11  LEU  18          1HD1      LEU  18   1.177   2.362 -11.510
  133   HD12  LEU  18          2HD1      LEU  18   0.490   1.341 -12.784
  134   HD13  LEU  18          3HD1      LEU  18  -0.579   2.331 -11.770
  135   HD21  LEU  18          3HD2      LEU  18   2.335   0.279 -10.618
  136   HD22  LEU  18          1HD2      LEU  18   1.354  -1.150 -10.218
  137   HD23  LEU  18          2HD2      LEU  18   1.558  -0.672 -11.910
  138    H    GLN  19           H        GLN  19   1.637   0.697  -6.642
  139    HA   GLN  19           HA       GLN  19   0.018   2.298  -4.747
  140    HB2  GLN  19           2HB      GLN  19   1.894   0.105  -3.828
  141    HB3  GLN  19           3HB      GLN  19   0.824   1.120  -2.852
  142    HG2  GLN  19           2HG      GLN  19  -0.375  -0.812  -2.806
  143    HG3  GLN  19           3HG      GLN  19  -1.087  -0.107  -4.263
  144   HE21  GLN  19          2HE2      GLN  19   1.486  -2.373  -3.148
  145   HE22  GLN  19          1HE2      GLN  19   1.394  -3.408  -4.565
  146    H    ALA  20           H        ALA  20   1.482   3.618  -3.383
  147    HA   ALA  20           HA       ALA  20   3.800   4.603  -4.646
  148    HB1  ALA  20           1HB      ALA  20   2.975   4.814  -1.716
  149    HB2  ALA  20           2HB      ALA  20   4.127   5.872  -2.559
  150    HB3  ALA  20           3HB      ALA  20   2.416   5.875  -3.035
  151    H    TYR  21           H        TYR  21   3.562   1.657  -3.012
  152    HA   TYR  21           HA       TYR  21   6.511   1.532  -2.539
  153    HB2  TYR  21           2HB      TYR  21   6.061  -0.052  -0.778
  154    HB3  TYR  21           3HB      TYR  21   5.202   1.464  -0.485
  155    HD1  TYR  21           HD1      TYR  21   4.802  -2.113  -1.452
  156    HD2  TYR  21           HD2      TYR  21   2.772   1.549  -0.415
  157    HE1  TYR  21           HE1      TYR  21   2.687  -3.382  -1.141
  158    HE2  TYR  21           HE2      TYR  21   0.646   0.290  -0.119
  159    HH   TYR  21           HH       TYR  21   0.438  -3.250  -0.588
  160    H    GLY  22           H        GLY  22   4.095   0.340  -4.678
  161    HA2  GLY  22           2HA      GLY  22   5.857  -1.215  -6.097
  162    HA3  GLY  22           3HA      GLY  22   5.194  -2.324  -4.884
  163    H    ALA  23           H        ALA  23   4.611  -3.281  -7.104
  164    HA   ALA  23           HA       ALA  23   1.865  -2.390  -7.961
  165    HB1  ALA  23           1HB      ALA  23   4.112  -3.608  -9.625
  166    HB2  ALA  23           2HB      ALA  23   2.463  -3.285 -10.189
  167    HB3  ALA  23           3HB      ALA  23   3.525  -1.937  -9.736
  168    H    PHE  24           H        PHE  24   0.343  -3.907  -7.638
  169    HA   PHE  24           HA       PHE  24   1.122  -6.634  -6.892
  170    HB2  PHE  24           2HB      PHE  24  -1.512  -5.199  -7.298
  171    HB3  PHE  24           3HB      PHE  24  -1.451  -6.929  -6.953
  172    HD1  PHE  24           HD1      PHE  24   0.510  -7.260  -4.848
  173    HD2  PHE  24           HD2      PHE  24  -2.352  -4.091  -5.456
  174    HE1  PHE  24           HE1      PHE  24   0.490  -6.810  -2.409
  175    HE2  PHE  24           HE2      PHE  24  -2.385  -3.654  -3.013
  176    HZ   PHE  24           HZ       PHE  24  -0.966  -5.010  -1.481
  177    H    VAL  25           H        VAL  25   1.073  -8.399  -8.217
  178    HA   VAL  25           HA       VAL  25  -0.024  -8.140 -10.987
  179    HB   VAL  25           HB       VAL  25   2.656  -9.365 -10.210
  180   HG11  VAL  25          1HG1      VAL  25   1.379  -8.948 -12.952
  181   HG12  VAL  25          2HG1      VAL  25   3.005  -9.588 -12.657
  182   HG13  VAL  25          3HG1      VAL  25   1.586 -10.511 -12.133
  183   HG21  VAL  25          3HG2      VAL  25   2.107  -6.811 -11.769
  184   HG22  VAL  25          1HG2      VAL  25   2.823  -6.920 -10.144
  185   HG23  VAL  25          2HG2      VAL  25   3.697  -7.570 -11.539
  186    H    ALA  26           H        ALA  26  -1.467  -9.703 -11.322
  187    HA   ALA  26           HA       ALA  26  -1.608 -12.146  -9.652
  188    HB1  ALA  26           1HB      ALA  26  -3.110 -11.230 -12.143
  189    HB2  ALA  26           2HB      ALA  26  -3.472 -12.686 -11.185
  190    HB3  ALA  26           3HB      ALA  26  -3.672 -11.083 -10.460
  191    H    LEU  27           H        LEU  27  -0.475 -13.918 -10.070
  192    HA   LEU  27           HA       LEU  27   0.928 -14.197 -12.690
  193    HB2  LEU  27           2HB      LEU  27   1.382 -15.093  -9.875
  194    HB3  LEU  27           3HB      LEU  27   1.862 -16.228 -11.144
  195    HG   LEU  27           HG       LEU  27   2.775 -13.318 -11.101
  196   HD11  LEU  27          1HD1      LEU  27   4.217 -15.804 -10.063
  197   HD12  LEU  27          2HD1      LEU  27   4.919 -14.178 -10.196
  198   HD13  LEU  27          3HD1      LEU  27   3.582 -14.478  -9.066
  199   HD21  LEU  27          3HD2      LEU  27   3.837 -15.777 -12.564
  200   HD22  LEU  27          1HD2      LEU  27   2.923 -14.450 -13.299
  201   HD23  LEU  27          2HD2      LEU  27   4.529 -14.141 -12.632
  202    H    ASP  28           H        ASP  28  -1.456 -15.696 -10.571
  203    HA   ASP  28           HA       ASP  28  -2.475 -17.450 -12.681
  204    HB2  ASP  28           2HB      ASP  28  -0.522 -18.736 -11.806
  205    HB3  ASP  28           3HB      ASP  28  -1.190 -18.590 -10.171
  206    H    GLU  29           H        GLU  29  -4.463 -18.543 -11.846
  207    HA   GLU  29           HA       GLU  29  -6.187 -17.055 -10.189
  208    HB2  GLU  29           2HB      GLU  29  -6.080 -20.010 -10.862
  209    HB3  GLU  29           3HB      GLU  29  -7.451 -19.221 -10.062
  210    HG2  GLU  29           2HG      GLU  29  -6.404 -18.539 -12.847
  211    HG3  GLU  29           3HG      GLU  29  -7.809 -19.546 -12.485
  212    H    GLU  30           H        GLU  30  -3.613 -19.206  -9.222
  213    HA   GLU  30           HA       GLU  30  -4.507 -19.056  -6.365
  214    HB2  GLU  30           2HB      GLU  30  -2.723 -21.114  -7.688
  215    HB3  GLU  30           3HB      GLU  30  -3.307 -21.124  -6.014
  216    HG2  GLU  30           2HG      GLU  30  -5.633 -21.408  -6.841
  217    HG3  GLU  30           3HG      GLU  30  -5.026 -21.485  -8.506
  218    H    THR  31           H        THR  31  -2.482 -17.314  -8.263
  219    HA   THR  31           HA       THR  31  -0.557 -16.958  -6.031
  220    HB   THR  31           HB       THR  31   0.444 -17.520  -8.847
  221    HG1  THR  31           1HG      THR  31   1.123 -19.533  -7.989
  222   HG21  THR  31          1HG2      THR  31   1.835 -17.412  -6.129
  223   HG22  THR  31          2HG2      THR  31   2.616 -17.771  -7.683
  224   HG23  THR  31          3HG2      THR  31   1.931 -16.167  -7.395
  225    H    GLN  32           H        GLN  32   0.119 -14.962  -5.787
  226    HA   GLN  32           HA       GLN  32  -0.325 -12.849  -7.825
  227    HB2  GLN  32           2HB      GLN  32  -2.459 -13.443  -6.548
  228    HB3  GLN  32           3HB      GLN  32  -1.638 -12.857  -5.094
  229    HG2  GLN  32           2HG      GLN  32  -2.245 -11.139  -7.557
  230    HG3  GLN  32           3HG      GLN  32  -3.238 -11.241  -6.095
  231   HE21  GLN  32          2HE2      GLN  32  -0.639  -9.654  -7.605
  232   HE22  GLN  32          1HE2      GLN  32  -0.042  -8.788  -6.210
  233    H    GLY  33           H        GLY  33   1.339 -11.299  -7.494
  234    HA2  GLY  33           2HA      GLY  33   2.835 -11.431  -4.920
  235    HA3  GLY  33           3HA      GLY  33   3.681 -11.604  -6.464
  236    H    LEU  34           H        LEU  34   4.754  -9.742  -5.198
  237    HA   LEU  34           HA       LEU  34   3.490  -7.099  -5.830
  238    HB2  LEU  34           2HB      LEU  34   3.106  -7.597  -3.513
  239    HB3  LEU  34           3HB      LEU  34   4.800  -8.067  -3.270
  240    HG   LEU  34           HG       LEU  34   5.510  -5.721  -3.699
  241   HD11  LEU  34          1HD1      LEU  34   2.519  -5.107  -3.739
  242   HD12  LEU  34          2HD1      LEU  34   3.833  -3.904  -3.729
  243   HD13  LEU  34          3HD1      LEU  34   3.624  -4.969  -5.123
  244   HD21  LEU  34          3HD2      LEU  34   3.387  -6.043  -1.536
  245   HD22  LEU  34          1HD2      LEU  34   5.105  -6.482  -1.403
  246   HD23  LEU  34          2HD2      LEU  34   4.645  -4.781  -1.577
  247    H    VAL  35           H        VAL  35   4.773  -6.475  -7.519
  248    HA   VAL  35           HA       VAL  35   7.665  -6.686  -7.449
  249    HB   VAL  35           HB       VAL  35   6.002  -4.622  -8.949
  250   HG11  VAL  35          1HG1      VAL  35   8.756  -5.841  -9.452
  251   HG12  VAL  35          2HG1      VAL  35   7.950  -4.642 -10.484
  252   HG13  VAL  35          3HG1      VAL  35   8.446  -4.206  -8.842
  253   HG21  VAL  35          3HG2      VAL  35   6.793  -7.381  -9.939
  254   HG22  VAL  35          1HG2      VAL  35   5.139  -6.834  -9.568
  255   HG23  VAL  35          2HG2      VAL  35   6.042  -6.092 -10.898
  256    H    HIS  36           H        HIS  36   8.838  -5.631  -5.856
  257    HA   HIS  36           HA       HIS  36   7.635  -3.480  -4.287
  258    HB2  HIS  36           2HB      HIS  36  10.427  -4.697  -4.416
  259    HB3  HIS  36           3HB      HIS  36   9.954  -3.433  -3.266
  260    HD1  HIS  36           HD1      HIS  36   7.919  -6.682  -4.069
  261    HD2  HIS  36           HD2      HIS  36  10.006  -4.723  -0.952
  262    HE1  HIS  36           HE1      HIS  36   7.524  -8.012  -2.009
  263    H    ILE  37           H        ILE  37   8.176  -1.227  -4.464
  264    HA   ILE  37           HA       ILE  37   8.684  -0.292  -7.115
  265    HB   ILE  37           HB       ILE  37   7.415   0.940  -5.351
  266   HG12  ILE  37          2HG1      ILE  37   9.637   2.546  -6.582
  267   HG13  ILE  37          3HG1      ILE  37   8.237   1.898  -7.463
  268   HG21  ILE  37          1HG2      ILE  37  10.187   1.605  -4.244
  269   HG22  ILE  37          2HG2      ILE  37   8.669   2.357  -3.731
  270   HG23  ILE  37          3HG2      ILE  37   8.941   0.640  -3.418
  271   HD11  ILE  37          3HD1      ILE  37   6.708   3.223  -6.031
  272   HD12  ILE  37          1HD1      ILE  37   8.102   3.886  -5.152
  273   HD13  ILE  37          2HD1      ILE  37   7.880   4.266  -6.866
  274    H    SER  38           H        SER  38  11.074  -0.760  -4.597
  275    HA   SER  38           HA       SER  38  13.280   0.332  -6.044
  276    HB2  SER  38           2HB      SER  38  13.366  -1.981  -4.090
  277    HB3  SER  38           3HB      SER  38  14.597  -0.731  -4.379
  278    HG   SER  38           HG       SER  38  13.365  -0.343  -2.461
  279    H    GLU  39           H        GLU  39  11.428  -2.281  -6.909
  280    HA   GLU  39           HA       GLU  39  13.579  -3.610  -8.500
  281    HB2  GLU  39           2HB      GLU  39  11.185  -4.736  -7.014
  282    HB3  GLU  39           3HB      GLU  39  12.079  -5.644  -8.232
  283    HG2  GLU  39           2HG      GLU  39  13.411  -4.409  -5.830
  284    HG3  GLU  39           3HG      GLU  39  12.720  -6.028  -5.742
  285    H    VAL  40           H        VAL  40  10.899  -1.583  -8.730
  286    HA   VAL  40           HA       VAL  40   9.726  -2.693 -11.156
  287    HB   VAL  40           HB       VAL  40   9.637   0.022  -9.806
  288   HG11  VAL  40          1HG1      VAL  40   8.028  -0.913 -12.216
  289   HG12  VAL  40          2HG1      VAL  40   7.764   0.599 -11.315
  290   HG13  VAL  40          3HG1      VAL  40   9.262   0.355 -12.228
  291   HG21  VAL  40          3HG2      VAL  40   7.570  -2.198 -10.093
  292   HG22  VAL  40          1HG2      VAL  40   8.458  -1.789  -8.622
  293   HG23  VAL  40          2HG2      VAL  40   7.301  -0.634  -9.293
  294    H    THR  41           H        THR  41  12.299  -0.323 -10.478
  295    HA   THR  41           HA       THR  41  13.434  -0.706 -13.169
  296    HB   THR  41           HB       THR  41  12.370   1.946 -12.152
  297    HG1  THR  41           1HG      THR  41  11.159   1.812 -14.120
  298   HG21  THR  41          1HG2      THR  41  13.900   1.411 -14.735
  299   HG22  THR  41          2HG2      THR  41  13.137   2.948 -14.273
  300   HG23  THR  41          3HG2      THR  41  14.511   2.342 -13.343
  301    H    HIS  42           H        HIS  42  15.625   0.314 -13.214
  302    HA   HIS  42           HA       HIS  42  17.080  -0.670 -10.991
  303    HB2  HIS  42           2HB      HIS  42  17.991   1.184 -13.232
  304    HB3  HIS  42           3HB      HIS  42  19.062   0.243 -12.181
  305    HD1  HIS  42           HD1      HIS  42  18.802  -2.534 -12.489
  306    HD2  HIS  42           HD2      HIS  42  17.127  -0.036 -15.461
  307    HE1  HIS  42           HE1      HIS  42  18.355  -3.987 -14.463
  308    H    GLY  43           H        GLY  43  15.925   2.601 -11.544
  309    HA2  GLY  43           2HA      GLY  43  16.277   3.400  -8.862
  310    HA3  GLY  43           3HA      GLY  43  17.645   4.025  -9.809
  311    H    PHE  44           H        PHE  44  16.222   5.920  -8.806
  312    HA   PHE  44           HA       PHE  44  14.823   7.721  -9.075
  313    HB2  PHE  44           2HB      PHE  44  16.668   8.056 -10.827
  314    HB3  PHE  44           3HB      PHE  44  15.498   7.479 -12.021
  315    HD1  PHE  44           HD1      PHE  44  15.706  10.012  -9.225
  316    HD2  PHE  44           HD2      PHE  44  14.333   9.089 -13.209
  317    HE1  PHE  44           HE1      PHE  44  14.831  12.326  -9.460
  318    HE2  PHE  44           HE2      PHE  44  13.483  11.410 -13.453
  319    HZ   PHE  44           HZ       PHE  44  13.722  13.032 -11.574
  320    H    VAL  45           H        VAL  45  13.438   5.396  -8.813
  321    HA   VAL  45           HA       VAL  45  11.214   5.394 -10.686
  322    HB   VAL  45           HB       VAL  45  11.198   4.017  -7.983
  323   HG11  VAL  45          1HG1      VAL  45  10.152   3.266 -10.759
  324   HG12  VAL  45          2HG1      VAL  45   9.931   2.314  -9.274
  325   HG13  VAL  45          3HG1      VAL  45   9.171   3.911  -9.423
  326   HG21  VAL  45          3HG2      VAL  45  12.647   2.988 -10.443
  327   HG22  VAL  45          1HG2      VAL  45  13.409   3.464  -8.921
  328   HG23  VAL  45          2HG2      VAL  45  12.332   2.069  -8.957
  329    H    LYS  46           H        LYS  46  11.235   7.827 -10.319
  330    HA   LYS  46           HA       LYS  46  10.390   9.046  -7.942
  331    HB2  LYS  46           2HB      LYS  46   9.823  10.991  -9.297
  332    HB3  LYS  46           3HB      LYS  46  11.380  10.285  -9.774
  333    HG2  LYS  46           2HG      LYS  46  10.356   9.264 -11.760
  334    HG3  LYS  46           3HG      LYS  46   8.751   9.844 -11.264
  335    HD2  LYS  46           2HD      LYS  46   9.519  12.185 -11.476
  336    HD3  LYS  46           3HD      LYS  46  11.132  11.613 -11.965
  337    HE2  LYS  46           2HE      LYS  46  10.158  10.495 -13.935
  338    HE3  LYS  46           3HE      LYS  46   8.531  11.006 -13.436
  339    HZ1  LYS  46           3HZ      LYS  46   9.225  13.287 -13.731
  340    HZ2  LYS  46           1HZ      LYS  46  10.737  12.815 -14.195
  341    HZ3  LYS  46           2HZ      LYS  46   9.434  12.442 -15.130
  342    H    ASP  47           H        ASP  47   8.255   7.686 -10.415
  343    HA   ASP  47           HA       ASP  47   6.265   7.325  -8.300
  344    HB2  ASP  47           2HB      ASP  47   5.608   9.527  -9.245
  345    HB3  ASP  47           3HB      ASP  47   5.575   8.807 -10.863
  346    H    ILE  48           H        ILE  48   5.103   5.433  -8.722
  347    HA   ILE  48           HA       ILE  48   6.373   3.577 -10.568
  348    HB   ILE  48           HB       ILE  48   5.457   3.100  -8.245
  349   HG12  ILE  48          2HG1      ILE  48   4.520   1.320 -10.479
  350   HG13  ILE  48          3HG1      ILE  48   6.164   1.411  -9.809
  351   HG21  ILE  48          1HG2      ILE  48   2.772   3.152  -9.704
  352   HG22  ILE  48          2HG2      ILE  48   3.035   2.564  -8.056
  353   HG23  ILE  48          3HG2      ILE  48   3.279   4.268  -8.419
  354   HD11  ILE  48          3HD1      ILE  48   5.314   0.701  -7.594
  355   HD12  ILE  48          1HD1      ILE  48   3.670   0.591  -8.263
  356   HD13  ILE  48          2HD1      ILE  48   4.930  -0.495  -8.849
  357    H    ASN  49           H        ASN  49   3.423   5.512 -10.955
  358    HA   ASN  49           HA       ASN  49   2.513   3.912 -13.168
  359    HB2  ASN  49           2HB      ASN  49   0.752   5.272 -13.187
  360    HB3  ASN  49           3HB      ASN  49   1.404   5.999 -11.709
  361   HD21  ASN  49          2HD2      ASN  49   2.958   7.887 -12.056
  362   HD22  ASN  49          1HD2      ASN  49   2.616   8.962 -13.422
  363    H    GLU  50           H        GLU  50   5.060   6.257 -12.979
  364    HA   GLU  50           HA       GLU  50   5.194   6.712 -15.856
  365    HB2  GLU  50           2HB      GLU  50   7.302   7.095 -13.707
  366    HB3  GLU  50           3HB      GLU  50   7.332   7.763 -15.343
  367    HG2  GLU  50           2HG      GLU  50   5.396   8.494 -13.110
  368    HG3  GLU  50           3HG      GLU  50   6.733   9.462 -13.738
  369    H    HIS  51           H        HIS  51   5.700   3.924 -14.129
  370    HA   HIS  51           HA       HIS  51   7.873   2.909 -15.923
  371    HB2  HIS  51           2HB      HIS  51   7.691   2.551 -12.889
  372    HB3  HIS  51           3HB      HIS  51   8.881   1.822 -13.981
  373    HD1  HIS  51           HD1      HIS  51   8.074   5.170 -12.293
  374    HD2  HIS  51           HD2      HIS  51  10.885   3.438 -14.938
  375    HE1  HIS  51           HE1      HIS  51   9.929   6.814 -12.542
  376    H    LEU  52           H        LEU  52   4.871   2.274 -14.270
  377    HA   LEU  52           HA       LEU  52   4.584  -0.279 -15.730
  378    HB2  LEU  52           2HB      LEU  52   4.489   0.098 -12.740
  379    HB3  LEU  52           3HB      LEU  52   3.394  -1.067 -13.498
  380    HG   LEU  52           HG       LEU  52   6.430  -1.162 -13.747
  381   HD11  LEU  52          1HD1      LEU  52   4.500  -2.815 -12.059
  382   HD12  LEU  52          2HD1      LEU  52   6.253  -3.093 -12.206
  383   HD13  LEU  52          3HD1      LEU  52   5.651  -1.611 -11.439
  384   HD21  LEU  52          3HD2      LEU  52   4.302  -3.194 -14.532
  385   HD22  LEU  52          1HD2      LEU  52   5.268  -2.220 -15.664
  386   HD23  LEU  52          2HD2      LEU  52   6.062  -3.419 -14.644
  387    H    SER  53           H        SER  53   2.247  -1.006 -15.536
  388    HA   SER  53           HA       SER  53   0.300   1.237 -15.306
  389    HB2  SER  53           2HB      SER  53   0.634  -0.628 -17.690
  390    HB3  SER  53           3HB      SER  53  -0.643   0.590 -17.480
  391    HG   SER  53           HG       SER  53   1.111   1.346 -18.783
  392    H    VAL  54           H        VAL  54  -1.450   0.453 -14.107
  393    HA   VAL  54           HA       VAL  54  -1.927  -2.372 -13.626
  394    HB   VAL  54           HB       VAL  54  -2.600  -0.555 -12.085
  395   HG11  VAL  54          1HG1      VAL  54  -4.717   0.120 -14.175
  396   HG12  VAL  54          2HG1      VAL  54  -4.655   0.762 -12.522
  397   HG13  VAL  54          3HG1      VAL  54  -3.375   1.171 -13.679
  398   HG21  VAL  54          3HG2      VAL  54  -4.867  -2.287 -13.056
  399   HG22  VAL  54          1HG2      VAL  54  -3.625  -2.692 -11.848
  400   HG23  VAL  54          2HG2      VAL  54  -4.810  -1.415 -11.512
  401    H    GLY  55           H        GLY  55  -3.420  -3.749 -14.380
  402    HA2  GLY  55           2HA      GLY  55  -4.770  -4.744 -15.921
  403    HA3  GLY  55           3HA      GLY  55  -5.222  -3.130 -16.513
  404    H    ASP  56           H        ASP  56  -1.869  -4.299 -16.418
  405    HA   ASP  56           HA       ASP  56  -1.888  -4.731 -19.381
  406    HB2  ASP  56           2HB      ASP  56  -0.876  -2.583 -18.738
  407    HB3  ASP  56           3HB      ASP  56   0.296  -3.428 -17.710
  408    H    GLU  57           H        GLU  57  -0.142  -6.219 -20.065
  409    HA   GLU  57           HA       GLU  57   0.276  -8.408 -18.091
  410    HB2  GLU  57           2HB      GLU  57  -0.802  -8.846 -20.287
  411    HB3  GLU  57           3HB      GLU  57   0.674  -8.276 -21.095
  412    HG2  GLU  57           2HG      GLU  57   1.957 -10.113 -20.018
  413    HG3  GLU  57           3HG      GLU  57   0.477 -10.665 -19.215
  414    H    VAL  58           H        VAL  58   2.282  -9.031 -17.458
  415    HA   VAL  58           HA       VAL  58   4.718  -7.620 -18.428
  416    HB   VAL  58           HB       VAL  58   5.309  -7.091 -16.059
  417   HG11  VAL  58          1HG1      VAL  58   2.764  -5.710 -17.030
  418   HG12  VAL  58          2HG1      VAL  58   3.887  -5.073 -15.820
  419   HG13  VAL  58          3HG1      VAL  58   4.420  -5.286 -17.499
  420   HG21  VAL  58          3HG2      VAL  58   2.422  -7.721 -15.394
  421   HG22  VAL  58          1HG2      VAL  58   3.866  -8.596 -14.834
  422   HG23  VAL  58          2HG2      VAL  58   3.600  -6.921 -14.327
  423    H    GLN  59           H        GLN  59   6.580  -8.760 -18.099
  424    HA   GLN  59           HA       GLN  59   6.295 -11.503 -16.975
  425    HB2  GLN  59           2HB      GLN  59   7.106 -11.193 -19.325
  426    HB3  GLN  59           3HB      GLN  59   8.502 -10.304 -18.682
  427    HG2  GLN  59           2HG      GLN  59   9.366 -12.235 -17.590
  428    HG3  GLN  59           3HG      GLN  59   7.846 -13.130 -17.763
  429   HE21  GLN  59          2HE2      GLN  59   7.188 -13.805 -19.931
  430   HE22  GLN  59          1HE2      GLN  59   8.433 -14.102 -21.153
  431    H    VAL  60           H        VAL  60   7.289 -11.993 -15.119
  432    HA   VAL  60           HA       VAL  60   8.812  -9.859 -13.656
  433    HB   VAL  60           HB       VAL  60   7.589 -10.804 -11.639
  434   HG11  VAL  60          1HG1      VAL  60   5.871  -9.406 -13.728
  435   HG12  VAL  60          2HG1      VAL  60   5.528  -9.479 -11.987
  436   HG13  VAL  60          3HG1      VAL  60   6.967  -8.630 -12.554
  437   HG21  VAL  60          3HG2      VAL  60   5.701 -11.997 -13.685
  438   HG22  VAL  60          1HG2      VAL  60   6.725 -12.884 -12.531
  439   HG23  VAL  60          2HG2      VAL  60   5.407 -11.857 -11.944
  440    H    LYS  61           H        LYS  61  10.457 -10.515 -12.330
  441    HA   LYS  61           HA       LYS  61  11.184 -13.412 -12.407
  442    HB2  LYS  61           2HB      LYS  61  12.908 -11.716 -12.992
  443    HB3  LYS  61           3HB      LYS  61  12.727 -10.999 -11.376
  444    HG2  LYS  61           2HG      LYS  61  13.492 -13.066 -10.322
  445    HG3  LYS  61           3HG      LYS  61  13.539 -13.891 -11.894
  446    HD2  LYS  61           2HD      LYS  61  15.310 -12.331 -12.659
  447    HD3  LYS  61           3HD      LYS  61  15.268 -11.517 -11.074
  448    HE2  LYS  61           2HE      LYS  61  15.897 -13.635  -9.968
  449    HE3  LYS  61           3HE      LYS  61  15.924 -14.460 -11.542
  450    HZ1  LYS  61           3HZ      LYS  61  17.718 -12.997 -12.207
  451    HZ2  LYS  61           1HZ      LYS  61  17.693 -12.232 -10.738
  452    HZ3  LYS  61           2HZ      LYS  61  18.130 -13.820 -10.841
  453    H    VAL  62           H        VAL  62  10.801 -14.681 -10.704
  454    HA   VAL  62           HA       VAL  62   9.584 -13.811  -8.231
  455    HB   VAL  62           HB       VAL  62  11.038 -16.401  -8.932
  456   HG11  VAL  62          1HG1      VAL  62   8.928 -15.799  -6.819
  457   HG12  VAL  62          2HG1      VAL  62   9.610 -17.391  -7.160
  458   HG13  VAL  62          3HG1      VAL  62  10.636 -16.109  -6.495
  459   HG21  VAL  62          3HG2      VAL  62   8.079 -15.741  -9.210
  460   HG22  VAL  62          1HG2      VAL  62   9.224 -16.014 -10.543
  461   HG23  VAL  62          2HG2      VAL  62   8.824 -17.340  -9.442
  462    H    LEU  63           H        LEU  63  10.657 -12.649  -6.691
  463    HA   LEU  63           HA       LEU  63  13.599 -12.974  -6.377
  464    HB2  LEU  63           2HB      LEU  63  11.583 -11.176  -5.018
  465    HB3  LEU  63           3HB      LEU  63  13.319 -11.173  -4.682
  466    HG   LEU  63           HG       LEU  63  12.018 -10.402  -7.339
  467   HD11  LEU  63          1HD1      LEU  63  13.414  -8.770  -5.170
  468   HD12  LEU  63          2HD1      LEU  63  12.798  -8.138  -6.706
  469   HD13  LEU  63          3HD1      LEU  63  11.666  -8.777  -5.508
  470   HD21  LEU  63          3HD2      LEU  63  14.942 -10.303  -6.522
  471   HD22  LEU  63          1HD2      LEU  63  14.228 -11.422  -7.708
  472   HD23  LEU  63          2HD2      LEU  63  14.253  -9.683  -8.032
  473    H    ALA  64           H        ALA  64  10.542 -13.529  -4.622
  474    HA   ALA  64           HA       ALA  64  11.773 -15.412  -2.724
  475    HB1  ALA  64           1HB      ALA  64  10.605 -12.777  -1.770
  476    HB2  ALA  64           2HB      ALA  64  11.032 -14.156  -0.743
  477    HB3  ALA  64           3HB      ALA  64  12.304 -13.281  -1.622
  478    H    VAL  65           H        VAL  65  10.133 -16.656  -1.688
  479    HA   VAL  65           HA       VAL  65   7.320 -16.188  -2.625
  480    HB   VAL  65           HB       VAL  65   8.846 -18.811  -2.360
  481   HG11  VAL  65          1HG1      VAL  65   6.004 -18.285  -3.351
  482   HG12  VAL  65          2HG1      VAL  65   6.839 -19.855  -3.372
  483   HG13  VAL  65          3HG1      VAL  65   6.439 -19.088  -1.826
  484   HG21  VAL  65          3HG2      VAL  65   7.864 -17.395  -4.864
  485   HG22  VAL  65          1HG2      VAL  65   9.555 -17.613  -4.372
  486   HG23  VAL  65          2HG2      VAL  65   8.577 -19.025  -4.803
  487    H    ASP  66           H        ASP  66   5.743 -16.548  -1.149
  488    HA   ASP  66           HA       ASP  66   6.524 -17.091   1.682
  489    HB2  ASP  66           2HB      ASP  66   6.311 -14.634   1.359
  490    HB3  ASP  66           3HB      ASP  66   4.709 -14.897   0.653
  491    H    GLU  67           H        GLU  67   5.868 -19.166   1.146
  492    HA   GLU  67           HA       GLU  67   3.391 -20.076   0.148
  493    HB2  GLU  67           2HB      GLU  67   5.476 -21.367   0.465
  494    HB3  GLU  67           3HB      GLU  67   5.234 -21.299   2.222
  495    HG2  GLU  67           2HG      GLU  67   3.151 -22.598   1.993
  496    HG3  GLU  67           3HG      GLU  67   3.363 -22.667   0.240
  497    H    GLU  68           H        GLU  68   4.121 -18.793   3.339
  498    HA   GLU  68           HA       GLU  68   1.955 -19.748   4.847
  499    HB2  GLU  68           2HB      GLU  68   3.198 -16.984   4.855
  500    HB3  GLU  68           3HB      GLU  68   2.167 -17.655   6.128
  501    HG2  GLU  68           2HG      GLU  68   4.883 -18.769   5.298
  502    HG3  GLU  68           3HG      GLU  68   4.579 -17.723   6.691
  503    H    LYS  69           H        LYS  69   2.009 -17.204   2.363
  504    HA   LYS  69           HA       LYS  69  -0.984 -16.982   2.562
  505    HB2  LYS  69           2HB      LYS  69   1.027 -14.759   2.053
  506    HB3  LYS  69           3HB      LYS  69  -0.743 -14.594   2.028
  507    HG2  LYS  69           2HG      LYS  69  -0.721 -15.408   4.449
  508    HG3  LYS  69           3HG      LYS  69   1.041 -15.207   4.413
  509    HD2  LYS  69           2HD      LYS  69  -1.060 -13.058   4.002
  510    HD3  LYS  69           3HD      LYS  69  -0.046 -13.277   5.437
  511    HE2  LYS  69           2HE      LYS  69   0.942 -12.519   2.656
  512    HE3  LYS  69           3HE      LYS  69   0.707 -11.392   4.014
  513    HZ1  LYS  69           3HZ      LYS  69   2.412 -12.603   5.216
  514    HZ2  LYS  69           1HZ      LYS  69   2.640 -13.644   3.947
  515    HZ3  LYS  69           2HZ      LYS  69   3.009 -12.064   3.781
  516    H    GLY  70           H        GLY  70   1.433 -18.112   0.616
  517    HA2  GLY  70           2HA      GLY  70   1.645 -18.492  -1.629
  518    HA3  GLY  70           3HA      GLY  70  -0.082 -18.105  -1.804
  519    H    LYS  71           H        LYS  71   2.125 -15.729  -0.404
  520    HA   LYS  71           HA       LYS  71   1.804 -13.991  -2.776
  521    HB2  LYS  71           2HB      LYS  71   2.994 -13.554  -0.019
  522    HB3  LYS  71           3HB      LYS  71   3.011 -12.336  -1.305
  523    HG2  LYS  71           2HG      LYS  71   0.563 -13.518   0.048
  524    HG3  LYS  71           3HG      LYS  71   1.218 -11.887   0.272
  525    HD2  LYS  71           2HD      LYS  71   0.768 -11.526  -2.250
  526    HD3  LYS  71           3HD      LYS  71  -0.182 -13.031  -2.179
  527    HE2  LYS  71           2HE      LYS  71  -1.462 -11.999  -0.237
  528    HE3  LYS  71           3HE      LYS  71  -0.631 -10.469  -0.600
  529    HZ1  LYS  71           3HZ      LYS  71  -1.619 -10.535  -2.804
  530    HZ2  LYS  71           1HZ      LYS  71  -2.385 -11.942  -2.455
  531    HZ3  LYS  71           2HZ      LYS  71  -2.793 -10.570  -1.636
  532    H    ILE  72           H        ILE  72   3.700 -12.862  -3.599
  533    HA   ILE  72           HA       ILE  72   6.312 -14.255  -3.379
  534    HB   ILE  72           HB       ILE  72   4.696 -13.851  -5.951
  535   HG12  ILE  72          2HG1      ILE  72   5.677 -16.298  -4.490
  536   HG13  ILE  72          3HG1      ILE  72   4.007 -15.837  -4.871
  537   HG21  ILE  72          1HG2      ILE  72   7.568 -14.784  -5.596
  538   HG22  ILE  72          2HG2      ILE  72   6.686 -14.738  -7.136
  539   HG23  ILE  72          3HG2      ILE  72   7.067 -13.243  -6.301
  540   HD11  ILE  72          3HD1      ILE  72   4.438 -16.240  -7.276
  541   HD12  ILE  72          1HD1      ILE  72   6.102 -16.734  -6.897
  542   HD13  ILE  72          2HD1      ILE  72   4.749 -17.695  -6.301
  543    H    SER  73           H        SER  73   7.943 -12.766  -3.349
  544    HA   SER  73           HA       SER  73   7.344  -9.936  -3.951
  545    HB2  SER  73           2HB      SER  73   9.952 -11.281  -3.150
  546    HB3  SER  73           3HB      SER  73   9.630  -9.536  -3.201
  547    HG   SER  73           HG       SER  73   9.395 -10.405  -1.076
  548    H    LEU  74           H        LEU  74   8.097  -8.929  -5.867
  549    HA   LEU  74           HA       LEU  74   9.193 -10.773  -7.961
  550    HB2  LEU  74           2HB      LEU  74   6.948  -8.768  -8.142
  551    HB3  LEU  74           3HB      LEU  74   7.617  -9.650  -9.522
  552    HG   LEU  74           HG       LEU  74   6.219 -10.986  -7.162
  553   HD11  LEU  74          1HD1      LEU  74   5.124 -10.311  -9.924
  554   HD12  LEU  74          2HD1      LEU  74   4.288 -11.265  -8.689
  555   HD13  LEU  74          3HD1      LEU  74   4.634  -9.547  -8.403
  556   HD21  LEU  74          3HD2      LEU  74   6.995 -12.056  -9.898
  557   HD22  LEU  74          1HD2      LEU  74   7.777 -12.455  -8.358
  558   HD23  LEU  74          2HD2      LEU  74   6.096 -12.934  -8.646
  559    H    SER  75           H        SER  75  10.130  -9.673  -9.789
  560    HA   SER  75           HA       SER  75  10.831  -6.798  -9.428
  561    HB2  SER  75           2HB      SER  75  12.759  -8.256  -8.814
  562    HB3  SER  75           3HB      SER  75  12.688  -8.981 -10.429
  563    HG   SER  75           HG       SER  75  14.229  -7.248 -10.207
  564    H    ILE  76           H        ILE  76  11.061  -5.662 -11.233
  565    HA   ILE  76           HA       ILE  76  10.384  -6.804 -13.925
  566    HB   ILE  76           HB       ILE  76   9.424  -4.306 -12.504
  567   HG12  ILE  76          2HG1      ILE  76   8.061  -6.272 -12.195
  568   HG13  ILE  76          3HG1      ILE  76   7.228  -4.973 -13.058
  569   HG21  ILE  76          1HG2      ILE  76   9.231  -4.853 -15.495
  570   HG22  ILE  76          2HG2      ILE  76   8.420  -3.527 -14.626
  571   HG23  ILE  76          3HG2      ILE  76  10.183  -3.573 -14.731
  572   HD11  ILE  76          3HD1      ILE  76   7.542  -6.184 -15.204
  573   HD12  ILE  76          1HD1      ILE  76   8.387  -7.480 -14.328
  574   HD13  ILE  76          2HD1      ILE  76   6.667  -7.157 -14.033
  575    H    ARG  77           H        ARG  77  12.382  -4.451 -12.042
  576    HA   ARG  77           HA       ARG  77  13.897  -3.653 -14.303
  577    HB2  ARG  77           2HB      ARG  77  15.619  -3.015 -12.825
  578    HB3  ARG  77           3HB      ARG  77  14.071  -2.663 -12.042
  579    HG2  ARG  77           2HG      ARG  77  14.332  -4.613 -10.571
  580    HG3  ARG  77           3HG      ARG  77  15.849  -5.049 -11.383
  581    HD2  ARG  77           2HD      ARG  77  16.897  -2.967 -10.642
  582    HD3  ARG  77           3HD      ARG  77  15.368  -2.420  -9.911
  583    HE   ARG  77           HE       ARG  77  15.835  -4.851  -8.720
  584   HH11  ARG  77          1HH1      ARG  77  17.753  -1.869  -8.971
  585   HH12  ARG  77          2HH1      ARG  77  18.519  -2.092  -7.432
  586   HH21  ARG  77          1HH2      ARG  77  16.816  -5.099  -6.696
  587   HH22  ARG  77          2HH2      ARG  77  18.001  -3.942  -6.134
  588    H    ALA  78           H        ALA  78  14.077  -6.672 -12.458
  589    HA   ALA  78           HA       ALA  78  16.364  -7.758 -13.724
  590    HB1  ALA  78           1HB      ALA  78  13.827  -9.163 -12.770
  591    HB2  ALA  78           2HB      ALA  78  15.393  -9.939 -13.093
  592    HB3  ALA  78           3HB      ALA  78  15.242  -8.769 -11.763
  593    H    THR  79           H        THR  79  12.899  -7.845 -14.808
  594    HA   THR  79           HA       THR  79  13.643  -9.569 -17.044
  595    HB   THR  79           HB       THR  79  11.160  -9.401 -17.511
  596    HG1  THR  79           1HG      THR  79   9.932  -8.452 -15.818
  597   HG21  THR  79          1HG2      THR  79  11.955 -10.154 -14.655
  598   HG22  THR  79          2HG2      THR  79  10.500 -10.699 -15.510
  599   HG23  THR  79          3HG2      THR  79  12.092 -11.209 -16.082
  600    H    GLN  80           H        GLN  80  12.709  -6.114 -16.648
  601    HA   GLN  80           HA       GLN  80  12.687  -5.523 -19.446
  602    HB2  GLN  80           2HB      GLN  80  13.274  -3.825 -16.992
  603    HB3  GLN  80           3HB      GLN  80  13.202  -3.166 -18.640
  604    HG2  GLN  80           2HG      GLN  80  10.863  -4.002 -18.857
  605    HG3  GLN  80           3HG      GLN  80  10.945  -4.610 -17.196
  606   HE21  GLN  80          2HE2      GLN  80   8.864  -2.945 -17.702
  607   HE22  GLN  80          1HE2      GLN  80   9.152  -1.353 -17.010
  608    H    ALA  81           H        ALA  81  15.396  -5.858 -17.174
  609    HA   ALA  81           HA       ALA  81  17.373  -4.860 -19.032
  610    HB1  ALA  81           1HB      ALA  81  17.653  -6.691 -16.610
  611    HB2  ALA  81           2HB      ALA  81  18.978  -5.839 -17.436
  612    HB3  ALA  81           3HB      ALA  81  17.722  -4.912 -16.586
  613    H    ALA  82           H        ALA  82  15.814  -8.012 -18.619
  614    HA   ALA  82           HA       ALA  82  17.921  -9.573 -19.803
  615    HB1  ALA  82           1HB      ALA  82  14.951 -10.161 -19.464
  616    HB2  ALA  82           2HB      ALA  82  16.201 -11.353 -19.864
  617    HB3  ALA  82           3HB      ALA  82  16.230 -10.536 -18.284
  618    HA   PRO  83           HA       PRO  83  16.863  -8.979 -24.136
  619    HB2  PRO  83           2HB      PRO  83  17.949 -11.259 -25.228
  620    HB3  PRO  83           3HB      PRO  83  18.949  -9.885 -24.684
  621    HG2  PRO  83           2HG      PRO  83  18.258 -12.493 -23.239
  622    HG3  PRO  83           3HG      PRO  83  19.853 -11.701 -23.356
  623    HD2  PRO  83           2HD      PRO  83  18.186 -11.399 -21.156
  624    HD3  PRO  83           3HD      PRO  83  19.295 -10.107 -21.692
  625    H    GLU  84           H        GLU  84  15.646 -10.232 -25.883
  626    HA   GLU  84           HA       GLU  84  14.169 -12.639 -25.017
  627    HB2  GLU  84           2HB      GLU  84  12.028 -11.758 -25.649
  628    HB3  GLU  84           3HB      GLU  84  12.732 -10.741 -24.382
  629    HG2  GLU  84           2HG      GLU  84  13.220  -8.977 -25.922
  630    HG3  GLU  84           3HG      GLU  84  12.906 -10.001 -27.333
  631    H    LYS  85           H        LYS  85  12.859 -13.501 -26.933
  632    HA   LYS  85           HA       LYS  85  14.454 -13.854 -29.257
  633    HB2  LYS  85           2HB      LYS  85  12.577 -15.342 -28.418
  634    HB3  LYS  85           3HB      LYS  85  11.433 -14.148 -29.071
  635    HG2  LYS  85           2HG      LYS  85  12.432 -14.455 -31.332
  636    HG3  LYS  85           3HG      LYS  85  13.552 -15.661 -30.667
  637    HD2  LYS  85           2HD      LYS  85  11.611 -17.071 -29.994
  638    HD3  LYS  85           3HD      LYS  85  10.507 -15.870 -30.711
  639    HE2  LYS  85           2HE      LYS  85  11.560 -16.209 -32.921
  640    HE3  LYS  85           3HE      LYS  85  12.686 -17.385 -32.212
  641    HZ1  LYS  85           3HZ      LYS  85  10.795 -18.780 -31.683
  642    HZ2  LYS  85           1HZ      LYS  85   9.752 -17.684 -32.343
  643    HZ3  LYS  85           2HZ      LYS  85  10.835 -18.459 -33.299
  644    H    LYS  86           H        LYS  86  14.921 -12.492 -30.798
  645    HA   LYS  86           HA       LYS  86  13.459  -9.977 -31.193
  646    HB2  LYS  86           2HB      LYS  86  16.019 -11.181 -32.296
  647    HB3  LYS  86           3HB      LYS  86  15.355  -9.648 -32.894
  648    HG2  LYS  86           2HG      LYS  86  15.713  -8.525 -30.898
  649    HG3  LYS  86           3HG      LYS  86  15.657  -9.996 -29.917
  650    HD2  LYS  86           2HD      LYS  86  17.926  -9.372 -31.829
  651    HD3  LYS  86           3HD      LYS  86  17.932  -8.860 -30.134
  652    HE2  LYS  86           2HE      LYS  86  17.651 -11.751 -31.051
  653    HE3  LYS  86           3HE      LYS  86  19.195 -10.999 -30.609
  654    HZ1  LYS  86           3HZ      LYS  86  18.313 -10.630 -28.400
  655    HZ2  LYS  86           1HZ      LYS  86  16.871 -11.325 -28.794
  656    HZ3  LYS  86           2HZ      LYS  86  18.246 -12.228 -28.772
  657    H    GLU  87           H        GLU  87  11.589 -11.491 -31.608
  658    HA   GLU  87           HA       GLU  87  11.116 -11.572 -34.548
  659    HB2  GLU  87           2HB      GLU  87  11.727 -13.829 -33.750
  660    HB3  GLU  87           3HB      GLU  87  10.448 -13.735 -32.528
  661    HG2  GLU  87           2HG      GLU  87   9.796 -15.129 -34.444
  662    HG3  GLU  87           3HG      GLU  87   8.730 -13.733 -34.259
  663    H    SER  88           H        SER  88   8.854 -11.342 -35.042
  664    HA   SER  88           HA       SER  88   7.491  -9.365 -33.537
  665    HB2  SER  88           2HB      SER  88   6.371 -11.322 -35.579
  666    HB3  SER  88           3HB      SER  88   5.672  -9.754 -35.112
  667    HG   SER  88           HG       SER  88   6.938  -9.643 -37.051
  668    H    LYS  89           H        LYS  89   5.697  -9.355 -32.309
  669    HA   LYS  89           HA       LYS  89   4.433 -11.850 -31.345
  670    HB2  LYS  89           2HB      LYS  89   5.656  -9.698 -29.575
  671    HB3  LYS  89           3HB      LYS  89   4.496 -10.906 -29.002
  672    HG2  LYS  89           2HG      LYS  89   6.069 -12.721 -29.643
  673    HG3  LYS  89           3HG      LYS  89   7.246 -11.499 -30.172
  674    HD2  LYS  89           2HD      LYS  89   7.334 -10.578 -27.875
  675    HD3  LYS  89           3HD      LYS  89   6.161 -11.802 -27.338
  676    HE2  LYS  89           2HE      LYS  89   7.691 -13.597 -27.772
  677    HE3  LYS  89           3HE      LYS  89   8.804 -12.525 -28.655
  678    HZ1  LYS  89           3HZ      LYS  89   9.258 -11.372 -26.594
  679    HZ2  LYS  89           1HZ      LYS  89   8.220 -12.361 -25.763
  680    HZ3  LYS  89           2HZ      LYS  89   9.592 -12.970 -26.437
  681    HA   PRO  90           HA       PRO  90   0.750  -9.874 -32.151
  682    HB2  PRO  90           2HB      PRO  90  -0.094  -9.910 -29.248
  683    HB3  PRO  90           3HB      PRO  90  -1.031 -10.369 -30.699
  684    HG2  PRO  90           2HG      PRO  90   0.147 -12.346 -29.291
  685    HG3  PRO  90           3HG      PRO  90   0.169 -12.356 -31.075
  686    HD2  PRO  90           2HD      PRO  90   2.392 -11.579 -29.169
  687    HD3  PRO  90           3HD      PRO  90   2.501 -12.418 -30.741
  688    H    ARG  91           H        ARG  91   2.280  -8.203 -29.373
  689    HA   ARG  91           HA       ARG  91   0.894  -5.669 -30.185
  690    HB2  ARG  91           2HB      ARG  91   2.197  -6.422 -27.561
  691    HB3  ARG  91           3HB      ARG  91   1.400  -4.883 -27.922
  692    HG2  ARG  91           2HG      ARG  91   0.010  -7.588 -27.853
  693    HG3  ARG  91           3HG      ARG  91   0.058  -6.444 -26.507
  694    HD2  ARG  91           2HD      ARG  91  -2.078  -6.155 -27.525
  695    HD3  ARG  91           3HD      ARG  91  -1.105  -4.755 -28.031
  696    HE   ARG  91           HE       ARG  91  -0.803  -6.786 -29.960
  697   HH11  ARG  91          1HH1      ARG  91  -3.462  -4.732 -28.821
  698   HH12  ARG  91          2HH1      ARG  91  -4.250  -4.688 -30.370
  699   HH21  ARG  91          1HH2      ARG  91  -1.766  -6.677 -31.950
  700   HH22  ARG  91          2HH2      ARG  91  -3.264  -5.813 -32.190
  701    H    LYS  92           H        LYS  92   4.009  -7.089 -30.501
  702    HA   LYS  92           HA       LYS  92   5.510  -4.682 -30.453
  703    HB2  LYS  92           2HB      LYS  92   5.806  -7.178 -32.168
  704    HB3  LYS  92           3HB      LYS  92   6.949  -5.821 -32.214
  705    HG2  LYS  92           2HG      LYS  92   7.298  -6.063 -29.753
  706    HG3  LYS  92           3HG      LYS  92   6.223  -7.475 -29.762
  707    HD2  LYS  92           2HD      LYS  92   7.786  -8.645 -31.309
  708    HD3  LYS  92           3HD      LYS  92   8.866  -7.232 -31.277
  709    HE2  LYS  92           2HE      LYS  92   9.137  -7.477 -28.840
  710    HE3  LYS  92           3HE      LYS  92   8.018  -8.851 -28.841
  711    HZ1  LYS  92           3HZ      LYS  92   9.594 -10.053 -30.222
  712    HZ2  LYS  92           1HZ      LYS  92  10.627  -8.779 -30.202
  713    HZ3  LYS  92           2HZ      LYS  92  10.293  -9.571 -28.793
  714    HA   PRO  93           HA       PRO  93   3.885  -3.575 -34.841
  715    HB2  PRO  93           2HB      PRO  93   1.016  -4.337 -34.304
  716    HB3  PRO  93           3HB      PRO  93   1.876  -4.191 -35.862
  717    HG2  PRO  93           2HG      PRO  93   1.525  -6.659 -34.805
  718    HG3  PRO  93           3HG      PRO  93   3.084  -6.210 -35.554
  719    HD2  PRO  93           2HD      PRO  93   2.365  -6.281 -32.602
  720    HD3  PRO  93           3HD      PRO  93   3.874  -6.807 -33.395
  721    H    LYS  94           H        LYS  94   2.597  -3.220 -31.649
  722    HA   LYS  94           HA       LYS  94   1.617  -1.520 -30.462
  723    HB2  LYS  94           2HB      LYS  94   4.007  -0.710 -31.116
  724    HB3  LYS  94           3HB      LYS  94   3.160   0.393 -32.211
  725    HG2  LYS  94           2HG      LYS  94   3.566   1.638 -30.232
  726    HG3  LYS  94           3HG      LYS  94   1.846   1.213 -30.182
  727    HD2  LYS  94           2HD      LYS  94   2.310  -0.605 -28.584
  728    HD3  LYS  94           3HD      LYS  94   4.055  -0.271 -28.684
  729    HE2  LYS  94           2HE      LYS  94   3.656   2.019 -27.814
  730    HE3  LYS  94           3HE      LYS  94   1.918   1.670 -27.701
  731    HZ1  LYS  94           3HZ      LYS  94   2.436  -0.050 -26.094
  732    HZ2  LYS  94           1HZ      LYS  94   4.045   0.273 -26.197
  733    HZ3  LYS  94           2HZ      LYS  94   3.017   1.395 -25.581
  734    H    ALA  95           H        ALA  95  -0.143  -2.503 -32.039
  735    HA   ALA  95           HA       ALA  95  -1.351  -0.899 -33.970
  736    HB1  ALA  95           1HB      ALA  95  -2.688  -2.854 -32.047
  737    HB2  ALA  95           2HB      ALA  95  -3.346  -2.302 -33.604
  738    HB3  ALA  95           3HB      ALA  95  -1.866  -3.287 -33.570
  739    H    ALA  96           H        ALA  96  -1.419  -0.355 -30.529
  740    HA   ALA  96           HA       ALA  96  -3.747   1.256 -30.339
  741    HB1  ALA  96           1HB      ALA  96  -1.133   1.419 -28.777
  742    HB2  ALA  96           2HB      ALA  96  -2.693   2.112 -28.281
  743    HB3  ALA  96           3HB      ALA  96  -2.508   0.349 -28.397
  744    H    GLN  97           H        GLN  97  -0.733   1.978 -31.962
  745    HA   GLN  97           HA       GLN  97  -0.686   4.814 -31.768
  746    HB2  GLN  97           2HB      GLN  97   0.149   2.870 -33.944
  747    HB3  GLN  97           3HB      GLN  97   0.426   4.619 -34.061
  748    HG2  GLN  97           2HG      GLN  97   1.815   4.596 -32.063
  749    HG3  GLN  97           3HG      GLN  97   1.451   2.889 -31.779
  750   HE21  GLN  97          2HE2      GLN  97   4.108   3.802 -31.908
  751   HE22  GLN  97          1HE2      GLN  97   4.842   3.154 -33.366
  752    H    VAL  98           H        VAL  98  -1.510   6.429 -33.039
  753    HA   VAL  98           HA       VAL  98  -3.672   5.839 -35.028
  754    HB   VAL  98           HB       VAL  98  -4.943   7.744 -34.039
  755   HG11  VAL  98          1HG1      VAL  98  -4.404   5.475 -32.068
  756   HG12  VAL  98          2HG1      VAL  98  -5.813   6.550 -32.050
  757   HG13  VAL  98          3HG1      VAL  98  -5.564   5.436 -33.410
  758   HG21  VAL  98          3HG2      VAL  98  -2.960   7.611 -31.746
  759   HG22  VAL  98          1HG2      VAL  98  -3.172   8.953 -32.901
  760   HG23  VAL  98          2HG2      VAL  98  -4.477   8.535 -31.774
  761    H    SER  99           H        SER  99  -0.701   6.926 -34.869
  762    HA   SER  99           HA       SER  99  -1.050   8.905 -37.038
  763    HB2  SER  99           2HB      SER  99   0.635   9.422 -34.556
  764    HB3  SER  99           3HB      SER  99   0.452  10.490 -35.964
  765    HG   SER  99           HG       SER  99  -0.889  11.124 -34.193
  766    H    GLU 100           H        GLU 100   0.998   9.175 -38.232
  767    HA   GLU 100           HA       GLU 100   2.663   6.879 -38.507
  768    HB2  GLU 100           2HB      GLU 100   2.254   8.619 -40.228
  769    HB3  GLU 100           3HB      GLU 100   3.167   9.788 -39.252
  770    HG2  GLU 100           2HG      GLU 100   5.215   8.547 -39.545
  771    HG3  GLU 100           3HG      GLU 100   4.361   7.185 -40.290
  772    H    GLU 101           H        GLU 101   4.686   6.422 -37.799
  773    HA   GLU 101           HA       GLU 101   5.339   7.191 -35.099
  774    HB2  GLU 101           2HB      GLU 101   6.976   5.581 -37.085
  775    HB3  GLU 101           3HB      GLU 101   7.114   5.570 -35.318
  776    HG2  GLU 101           2HG      GLU 101   5.867   3.693 -35.470
  777    HG3  GLU 101           3HG      GLU 101   4.517   4.831 -35.554
  778    H    ALA 102           H        ALA 102   5.778   9.164 -37.548
  779    HA   ALA 102           HA       ALA 102   8.503   9.843 -37.714
  780    HB1  ALA 102           1HB      ALA 102   6.045  11.636 -37.893
  781    HB2  ALA 102           2HB      ALA 102   7.665  12.035 -38.495
  782    HB3  ALA 102           3HB      ALA 102   6.749  10.699 -39.232
  783    H    SER 103           H        SER 103   9.878  10.966 -36.518
  784    HA   SER 103           HA       SER 103   9.332  11.707 -33.775
  785    HB2  SER 103           2HB      SER 103  11.701  12.460 -35.522
  786    HB3  SER 103           3HB      SER 103  11.647  12.370 -33.750
  787    HG   SER 103           HG       SER 103  12.612  10.502 -34.709
  788    H    THR 104           H        THR 104   8.851  13.382 -36.759
  789    HA   THR 104           HA       THR 104   8.559  15.995 -35.401
  790    HB   THR 104           HB       THR 104   9.845  16.892 -37.529
  791    HG1  THR 104           1HG      THR 104  11.548  15.487 -38.111
  792   HG21  THR 104          1HG2      THR 104  11.362  15.582 -35.227
  793   HG22  THR 104          2HG2      THR 104  11.996  16.840 -36.310
  794   HG23  THR 104          3HG2      THR 104  10.658  17.213 -35.210
  795    HA   PRO 105           HA       PRO 105   5.325  16.253 -38.470
  796    HB2  PRO 105           2HB      PRO 105   4.810  18.941 -38.592
  797    HB3  PRO 105           3HB      PRO 105   4.386  17.948 -37.174
  798    HG2  PRO 105           2HG      PRO 105   6.808  19.757 -37.594
  799    HG3  PRO 105           3HG      PRO 105   5.795  19.596 -36.135
  800    HD2  PRO 105           2HD      PRO 105   8.224  18.260 -36.464
  801    HD3  PRO 105           3HD      PRO 105   6.891  17.618 -35.466
  802    H    GLN 106           H        GLN 106   8.278  18.145 -38.930
  803    HA   GLN 106           HA       GLN 106   7.687  19.001 -41.656
  804    HB2  GLN 106           2HB      GLN 106  10.140  19.126 -39.856
  805    HB3  GLN 106           3HB      GLN 106  10.131  19.754 -41.516
  806    HG2  GLN 106           2HG      GLN 106   8.417  21.350 -41.015
  807    HG3  GLN 106           3HG      GLN 106   8.093  20.624 -39.432
  808   HE21  GLN 106          2HE2      GLN 106   9.915  23.038 -41.110
  809   HE22  GLN 106          1HE2      GLN 106  10.900  23.532 -39.740
  810    H    GLY 107           H        GLY 107   8.738  16.026 -40.437
  811    HA2  GLY 107           2HA      GLY 107   9.051  14.702 -42.874
  812    HA3  GLY 107           3HA      GLY 107  10.680  15.202 -42.371
  813    H    PHE 108           H        PHE 108  10.260  12.494 -42.439
  814    HA   PHE 108           HA       PHE 108   8.980  11.388 -40.171
  815    HB2  PHE 108           2HB      PHE 108   9.692  10.117 -42.287
  816    HB3  PHE 108           3HB      PHE 108  11.334  10.141 -41.625
  817    HD1  PHE 108           HD2      PHE 108   7.831   8.998 -40.953
  818    HD2  PHE 108           HD1      PHE 108  12.019   8.568 -39.986
  819    HE1  PHE 108           HE2      PHE 108   7.310   7.003 -39.567
  820    HE2  PHE 108           HE1      PHE 108  11.490   6.570 -38.601
  821    HZ   PHE 108           HZ       PHE 108   9.134   5.791 -38.387
  822    H    ASN 109           H        ASN 109  12.354  12.479 -40.493
  823    HA   ASN 109           HA       ASN 109  12.340  12.938 -37.605
  824    HB2  ASN 109           2HB      ASN 109  13.301  10.682 -37.666
  825    HB3  ASN 109           3HB      ASN 109  14.464  11.186 -38.911
  826   HD21  ASN 109          2HD2      ASN 109  16.229  10.576 -37.486
  827   HD22  ASN 109          1HD2      ASN 109  16.672  11.610 -36.142
  828    H    THR 110           H        THR 110  13.056  14.959 -37.409
  829    HA   THR 110           HA       THR 110  14.939  16.142 -39.390
  830    HB   THR 110           HB       THR 110  12.440  17.667 -38.727
  831    HG1  THR 110           1HG      THR 110  11.346  16.694 -40.482
  832   HG21  THR 110          1HG2      THR 110  14.043  17.317 -41.304
  833   HG22  THR 110          2HG2      THR 110  12.688  18.449 -41.066
  834   HG23  THR 110          3HG2      THR 110  14.201  18.670 -40.162
  835    H    LEU 111           H        LEU 111  15.091  15.403 -36.443
  836    HA   LEU 111           HA       LEU 111  14.988  17.719 -34.871
  837    HB2  LEU 111           2HB      LEU 111  16.221  16.648 -33.298
  838    HB3  LEU 111           3HB      LEU 111  15.479  15.305 -34.175
  839    HG   LEU 111           HG       LEU 111  18.383  16.229 -34.517
  840   HD11  LEU 111          1HD1      LEU 111  17.211  13.829 -33.038
  841   HD12  LEU 111          2HD1      LEU 111  18.943  14.156 -33.278
  842   HD13  LEU 111          3HD1      LEU 111  17.964  15.253 -32.285
  843   HD21  LEU 111          3HD2      LEU 111  17.006  13.728 -35.556
  844   HD22  LEU 111          1HD2      LEU 111  17.529  15.113 -36.540
  845   HD23  LEU 111          2HD2      LEU 111  18.735  14.123 -35.705
  846    H    LYS 112           H        LYS 112  16.190  19.420 -34.387
  847    HA   LYS 112           HA       LYS 112  18.698  20.127 -35.624
  848    HB2  LYS 112           2HB      LYS 112  17.794  21.817 -37.179
  849    HB3  LYS 112           3HB      LYS 112  17.380  20.164 -37.652
  850    HG2  LYS 112           2HG      LYS 112  15.110  20.591 -36.450
  851    HG3  LYS 112           3HG      LYS 112  15.567  22.303 -36.477
  852    HD2  LYS 112           2HD      LYS 112  15.465  22.425 -38.820
  853    HD3  LYS 112           3HD      LYS 112  15.676  20.676 -39.022
  854    HE2  LYS 112           2HE      LYS 112  13.380  21.379 -39.572
  855    HE3  LYS 112           3HE      LYS 112  13.430  20.244 -38.203
  856    HZ1  LYS 112           3HZ      LYS 112  13.148  22.105 -36.714
  857    HZ2  LYS 112           1HZ      LYS 112  13.131  23.171 -37.979
  858    HZ3  LYS 112           2HZ      LYS 112  11.917  22.063 -37.792
  859    H    ASP 113           H        ASP 113  18.994  22.581 -35.375
  860    HA   ASP 113           HA       ASP 113  17.343  23.784 -33.197
  861    HB2  ASP 113           2HB      ASP 113  19.258  22.753 -32.065
  862    HB3  ASP 113           3HB      ASP 113  20.366  23.538 -33.204
  863    H    LYS 114           H        LYS 114  19.980  24.301 -35.583
  864    HA   LYS 114           HA       LYS 114  19.833  27.141 -35.616
  865    HB2  LYS 114           2HB      LYS 114  20.706  25.188 -37.784
  866    HB3  LYS 114           3HB      LYS 114  20.979  26.942 -37.830
  867    HG2  LYS 114           2HG      LYS 114  22.308  26.774 -35.722
  868    HG3  LYS 114           3HG      LYS 114  22.082  25.009 -35.738
  869    HD2  LYS 114           2HD      LYS 114  23.203  24.912 -37.960
  870    HD3  LYS 114           3HD      LYS 114  23.481  26.662 -37.885
  871    HE2  LYS 114           2HE      LYS 114  24.534  24.650 -35.852
  872    HE3  LYS 114           3HE      LYS 114  25.466  25.244 -37.243
  873    HZ1  LYS 114           3HZ      LYS 114  25.291  27.464 -36.335
  874    HZ2  LYS 114           1HZ      LYS 114  24.419  26.914 -35.044
  875    HZ3  LYS 114           2HZ      LYS 114  25.993  26.457 -35.240
  876    H    LEU 115           H        LEU 115  17.717  24.842 -37.159
  877    HA   LEU 115           HA       LEU 115  16.030  27.123 -38.035
  878    HB2  LEU 115           2HB      LEU 115  17.342  26.133 -39.955
  879    HB3  LEU 115           3HB      LEU 115  16.471  24.611 -39.687
  880    HG   LEU 115           HG       LEU 115  14.310  25.814 -40.136
  881   HD11  LEU 115          1HD1      LEU 115  16.109  28.138 -40.955
  882   HD12  LEU 115          2HD1      LEU 115  14.351  28.037 -41.208
  883   HD13  LEU 115          3HD1      LEU 115  15.000  28.131 -39.568
  884   HD21  LEU 115          3HD2      LEU 115  16.398  26.021 -42.334
  885   HD22  LEU 115          1HD2      LEU 115  15.439  24.579 -41.923
  886   HD23  LEU 115          2HD2      LEU 115  14.635  26.026 -42.572
  887    H    GLU 116           H        GLU 116  15.916  25.672 -35.554
  888    HA   GLU 116           HA       GLU 116  13.537  24.036 -35.804
  889    HB2  GLU 116           2HB      GLU 116  15.280  23.904 -33.953
  890    HB3  GLU 116           3HB      GLU 116  14.550  25.383 -33.303
  891    HG2  GLU 116           2HG      GLU 116  13.497  23.602 -32.113
  892    HG3  GLU 116           3HG      GLU 116  12.339  24.157 -33.326
  893    H    GLU 117           H        GLU 117  12.683  25.476 -37.331
  894    HA   GLU 117           HA       GLU 117  10.578  27.218 -36.197
  895    HB2  GLU 117           2HB      GLU 117  12.531  28.641 -36.731
  896    HB3  GLU 117           3HB      GLU 117  12.540  27.997 -38.381
  897    HG2  GLU 117           2HG      GLU 117  11.564  30.267 -38.233
  898    HG3  GLU 117           3HG      GLU 117  10.428  29.083 -38.879
  899    H    TRP 118           H        TRP 118   8.961  27.582 -37.871
  900    HA   TRP 118           HA       TRP 118   7.339  26.840 -39.283
  901    HB2  TRP 118           2HB      TRP 118   9.440  25.293 -40.823
  902    HB3  TRP 118           3HB      TRP 118   7.870  25.855 -41.398
  903    HD1  TRP 118           HD1      TRP 118  11.385  26.794 -41.005
  904    HE1  TRP 118           HE1      TRP 118  11.869  29.137 -42.090
  905    HE3  TRP 118           HE3      TRP 118   6.568  28.278 -41.870
  906    HZ2  TRP 118           HZ2      TRP 118  10.318  31.295 -43.154
  907    HZ3  TRP 118           HZ3      TRP 118   6.076  30.419 -42.897
  908    HH2  TRP 118           HH2      TRP 118   7.904  31.977 -43.560
  909    H    ILE 119           H        ILE 119   6.325  24.767 -40.253
  910    HA   ILE 119           HA       ILE 119   6.593  22.393 -38.466
  911    HB   ILE 119           HB       ILE 119   5.204  23.985 -37.200
  912   HG12  ILE 119          2HG1      ILE 119   3.528  21.762 -38.332
  913   HG13  ILE 119          3HG1      ILE 119   4.828  21.573 -37.138
  914   HG21  ILE 119          1HG2      ILE 119   3.341  24.005 -39.628
  915   HG22  ILE 119          2HG2      ILE 119   2.984  24.728 -38.054
  916   HG23  ILE 119          3HG2      ILE 119   4.292  25.385 -39.032
  917   HD11  ILE 119          3HD1      ILE 119   3.594  23.021 -35.548
  918   HD12  ILE 119          1HD1      ILE 119   2.283  23.208 -36.734
  919   HD13  ILE 119          2HD1      ILE 119   2.618  21.618 -36.036
  920    H    GLU 120           H        GLU 120   5.208  23.811 -41.365
  921    HA   GLU 120           HA       GLU 120   5.067  21.033 -42.474
  922    HB2  GLU 120           2HB      GLU 120   3.042  23.282 -42.760
  923    HB3  GLU 120           3HB      GLU 120   3.040  21.790 -43.724
  924    HG2  GLU 120           2HG      GLU 120   2.812  20.465 -41.628
  925    HG3  GLU 120           3HG      GLU 120   2.685  21.968 -40.702
  926    H    MET 121           H        MET 121   7.011  23.358 -42.544
  927    HA   MET 121           HA       MET 121   7.568  23.271 -45.447
  928    HB2  MET 121           2HB      MET 121   7.516  25.816 -43.778
  929    HB3  MET 121           3HB      MET 121   8.183  25.677 -45.416
  930    HG2  MET 121           2HG      MET 121   5.936  25.029 -46.252
  931    HG3  MET 121           3HG      MET 121   5.284  25.258 -44.619
  932    HE1  MET 121           3HE      MET 121   4.028  26.619 -47.196
  933    HE2  MET 121           1HE      MET 121   3.400  26.852 -45.547
  934    HE3  MET 121           2HE      MET 121   3.712  28.261 -46.588
  935    H    SER 122           H        SER 122   9.842  23.770 -45.815
  936    HA   SER 122           HA       SER 122  11.701  23.983 -43.533
  937    HB2  SER 122           2HB      SER 122  11.870  21.772 -45.622
  938    HB3  SER 122           3HB      SER 122  13.058  22.106 -44.343
  939    HG   SER 122           HG       SER 122  11.602  20.395 -43.796
  940    H    ASN 123           H        ASN 123  13.907  24.623 -44.382
  941    HA   ASN 123           HA       ASN 123  13.875  26.332 -46.681
  942    HB2  ASN 123           2HB      ASN 123  15.515  26.519 -44.797
  943    HB3  ASN 123           3HB      ASN 123  16.254  24.996 -45.337
  944   HD21  ASN 123          2HD2      ASN 123  18.304  26.010 -45.768
  945   HD22  ASN 123          1HD2      ASN 123  18.507  27.081 -47.137
  946    H    ARG 124           H        ARG 124  14.685  26.044 -48.766
  947    HA   ARG 124           HA       ARG 124  14.509  23.418 -49.962
  948    HB2  ARG 124           2HB      ARG 124  15.772  25.968 -51.025
  949    HB3  ARG 124           3HB      ARG 124  15.325  24.544 -51.981
  950    HG2  ARG 124           2HG      ARG 124  13.413  26.424 -50.539
  951    HG3  ARG 124           3HG      ARG 124  13.707  26.359 -52.284
  952    HD2  ARG 124           2HD      ARG 124  12.827  24.005 -52.308
  953    HD3  ARG 124           3HD      ARG 124  12.452  24.159 -50.583
  954    HE   ARG 124           HE       ARG 124  10.675  25.548 -51.047
  955   HH11  ARG 124          1HH1      ARG 124  12.404  24.878 -54.063
  956   HH12  ARG 124          2HH1      ARG 124  11.143  25.505 -55.086
  957   HH21  ARG 124          1HH2      ARG 124   9.027  26.373 -52.407
  958   HH22  ARG 124          2HH2      ARG 124   9.218  26.357 -54.127
  959    H    LYS 125           H        LYS 125  16.278  22.350 -51.149
  960    HA   LYS 125           HA       LYS 125  18.734  21.970 -49.777
  961    HB2  LYS 125           2HB      LYS 125  17.705  20.473 -51.506
  962    HB3  LYS 125           3HB      LYS 125  18.142  21.666 -52.750
  963    HG2  LYS 125           2HG      LYS 125  20.532  21.361 -52.202
  964    HG3  LYS 125           3HG      LYS 125  20.105  20.192 -50.938
  965    HD2  LYS 125           2HD      LYS 125  19.501  19.850 -53.906
  966    HD3  LYS 125           3HD      LYS 125  20.912  19.156 -53.078
  967    HE2  LYS 125           2HE      LYS 125  19.377  17.905 -51.557
  968    HE3  LYS 125           3HE      LYS 125  17.987  18.555 -52.454
  969    HZ1  LYS 125           3HZ      LYS 125  18.808  17.424 -54.415
  970    HZ2  LYS 125           1HZ      LYS 125  20.096  16.825 -53.582
  971    HZ3  LYS 125           2HZ      LYS 125  18.568  16.345 -53.196
  972    H    ASP 126           H        ASP 126  20.823  22.857 -50.128
  973    HA   ASP 126           HA       ASP 126  21.051  25.628 -50.513
  974    HB2  ASP 126           2HB      ASP 126  22.661  24.277 -49.326
  975    HB3  ASP 126           3HB      ASP 126  23.161  23.452 -50.812
  976    H    LEU 127           H        LEU 127  21.206  23.128 -52.935
  977    HA   LEU 127           HA       LEU 127  22.166  24.498 -55.189
  978    HB2  LEU 127           2HB      LEU 127  21.665  22.090 -54.933
  979    HB3  LEU 127           3HB      LEU 127  19.928  22.454 -54.994
  980    HG   LEU 127           HG       LEU 127  20.131  23.210 -57.319
  981   HD11  LEU 127          1HD1      LEU 127  23.084  22.449 -57.108
  982   HD12  LEU 127          2HD1      LEU 127  22.238  22.933 -58.594
  983   HD13  LEU 127          3HD1      LEU 127  22.456  24.100 -57.283
  984   HD21  LEU 127          3HD2      LEU 127  21.456  20.513 -56.838
  985   HD22  LEU 127          1HD2      LEU 127  19.706  20.834 -56.901
  986   HD23  LEU 127          2HD2      LEU 127  20.699  21.033 -58.358
  987    H    ILE 128           H        ILE 128  19.184  25.243 -53.522
  988    HA   ILE 128           HA       ILE 128  17.863  26.660 -55.614
  989    HB   ILE 128           HB       ILE 128  16.997  26.127 -53.285
  990   HG12  ILE 128          2HG1      ILE 128  15.722  28.181 -52.949
  991   HG13  ILE 128          3HG1      ILE 128  16.733  28.999 -54.154
  992   HG21  ILE 128          1HG2      ILE 128  18.667  28.560 -52.481
  993   HG22  ILE 128          2HG2      ILE 128  17.464  27.758 -51.463
  994   HG23  ILE 128          3HG2      ILE 128  18.936  26.897 -51.937
  995   HD11  ILE 128          3HD1      ILE 128  15.942  27.396 -55.890
  996   HD12  ILE 128          1HD1      ILE 128  14.941  26.576 -54.671
  997   HD13  ILE 128          2HD1      ILE 128  14.588  28.254 -55.141
  998    H    LYS 129           H        LYS 129  20.730  27.613 -53.744
  999    HA   LYS 129           HA       LYS 129  20.789  30.316 -54.771
 1000    HB2  LYS 129           2HB      LYS 129  21.957  29.479 -52.716
 1001    HB3  LYS 129           3HB      LYS 129  23.048  28.542 -53.760
 1002    HG2  LYS 129           2HG      LYS 129  23.862  30.621 -54.808
 1003    HG3  LYS 129           3HG      LYS 129  22.723  31.578 -53.836
 1004    HD2  LYS 129           2HD      LYS 129  23.854  30.815 -51.762
 1005    HD3  LYS 129           3HD      LYS 129  24.991  29.853 -52.736
 1006    HE2  LYS 129           2HE      LYS 129  25.764  31.916 -53.868
 1007    HE3  LYS 129           3HE      LYS 129  24.629  32.877 -52.896
 1008    HZ1  LYS 129           3HZ      LYS 129  25.825  32.178 -50.926
 1009    HZ2  LYS 129           1HZ      LYS 129  26.874  31.288 -51.832
 1010    HZ3  LYS 129           2HZ      LYS 129  26.849  32.931 -51.980
 1011    H    LYS 130           H        LYS 130  21.656  31.105 -56.640
 1012    HA   LYS 130           HA       LYS 130  22.872  29.183 -58.570
 1013    HB2  LYS 130           2HB      LYS 130  21.145  31.575 -59.241
 1014    HB3  LYS 130           3HB      LYS 130  21.800  30.367 -60.357
 1015    HG2  LYS 130           2HG      LYS 130  19.622  29.942 -58.279
 1016    HG3  LYS 130           3HG      LYS 130  19.398  30.047 -60.031
 1017    HD2  LYS 130           2HD      LYS 130  20.657  27.947 -60.346
 1018    HD3  LYS 130           3HD      LYS 130  20.954  27.848 -58.597
 1019    HE2  LYS 130           2HE      LYS 130  18.440  27.881 -58.264
 1020    HE3  LYS 130           3HE      LYS 130  18.276  27.702 -60.027
 1021    HZ1  LYS 130           3HZ      LYS 130  19.507  25.638 -59.855
 1022    HZ2  LYS 130           1HZ      LYS 130  19.648  25.815 -58.215
 1023    HZ3  LYS 130           2HZ      LYS 130  18.165  25.581 -58.896
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1  -1.003 -24.288   1.093
    2    H2   MET   1           H2       MET   1  -2.050 -25.539   0.877
    3    H3   MET   1           H3       MET   1  -2.606 -23.953   0.985
    4    HA   MET   1           HA       MET   1  -1.937 -25.409  -1.251
    5    HB2  MET   1           2HB      MET   1  -2.713 -22.500  -0.821
    6    HB3  MET   1           3HB      MET   1  -2.547 -23.267  -2.414
    7    HG2  MET   1           2HG      MET   1  -4.305 -24.904  -1.797
    8    HG3  MET   1           3HG      MET   1  -4.499 -24.089  -0.234
    9    HE1  MET   1           3HE      MET   1  -6.922 -24.723  -2.214
   10    HE2  MET   1           1HE      MET   1  -7.116 -23.904  -0.644
   11    HE3  MET   1           2HE      MET   1  -7.839 -23.203  -2.110
   12    H    ALA   2           H        ALA   2  -0.054 -25.606  -2.344
   13    HA   ALA   2           HA       ALA   2   2.339 -24.219  -1.626
   14    HB1  ALA   2           1HB      ALA   2   1.591 -25.695  -4.194
   15    HB2  ALA   2           2HB      ALA   2   3.234 -25.245  -3.685
   16    HB3  ALA   2           3HB      ALA   2   2.314 -26.428  -2.737
   17    H    ALA   3           H        ALA   3   3.472 -22.575  -2.651
   18    HA   ALA   3           HA       ALA   3   1.875 -20.483  -3.825
   19    HB1  ALA   3           1HB      ALA   3   4.899 -20.750  -3.569
   20    HB2  ALA   3           2HB      ALA   3   4.005 -19.252  -3.911
   21    HB3  ALA   3           3HB      ALA   3   3.802 -20.056  -2.351
   22    H    LYS   4           H        LYS   4   3.483 -23.131  -5.276
   23    HA   LYS   4           HA       LYS   4   3.904 -23.803  -7.409
   24    HB2  LYS   4           2HB      LYS   4   2.208 -23.597  -9.002
   25    HB3  LYS   4           3HB      LYS   4   1.398 -23.605  -7.429
   26    HG2  LYS   4           2HG      LYS   4   1.027 -21.198  -7.551
   27    HG3  LYS   4           3HG      LYS   4   1.991 -21.090  -9.034
   28    HD2  LYS   4           2HD      LYS   4  -0.243 -20.990  -9.772
   29    HD3  LYS   4           3HD      LYS   4   0.251 -22.660 -10.096
   30    HE2  LYS   4           2HE      LYS   4  -0.893 -23.452  -8.101
   31    HE3  LYS   4           3HE      LYS   4  -1.229 -21.789  -7.573
   32    HZ1  LYS   4           3HZ      LYS   4  -2.656 -21.512  -9.489
   33    HZ2  LYS   4           1HZ      LYS   4  -2.357 -23.050  -9.993
   34    HZ3  LYS   4           2HZ      LYS   4  -3.166 -22.780  -8.577
   35    H    PHE   5           H        PHE   5   5.206 -21.276  -6.496
   36    HA   PHE   5           HA       PHE   5   6.713 -20.968  -9.017
   37    HB2  PHE   5           2HB      PHE   5   5.648 -18.673  -7.306
   38    HB3  PHE   5           3HB      PHE   5   6.990 -18.506  -8.436
   39    HD1  PHE   5           HD1      PHE   5   6.623 -18.581 -10.888
   40    HD2  PHE   5           HD2      PHE   5   3.375 -18.798  -8.076
   41    HE1  PHE   5           HE1      PHE   5   4.989 -18.298 -12.734
   42    HE2  PHE   5           HE2      PHE   5   1.741 -18.525  -9.929
   43    HZ   PHE   5           HZ       PHE   5   2.549 -18.340 -12.275
   44    H    GLU   6           H        GLU   6   8.923 -20.157  -8.512
   45    HA   GLU   6           HA       GLU   6   9.849 -20.547  -5.726
   46    HB2  GLU   6           2HB      GLU   6  10.867 -22.025  -8.179
   47    HB3  GLU   6           3HB      GLU   6  11.735 -21.931  -6.633
   48    HG2  GLU   6           2HG      GLU   6   9.775 -23.035  -5.514
   49    HG3  GLU   6           3HG      GLU   6   9.009 -23.195  -7.102
   50    H    VAL   7           H        VAL   7  11.747 -19.376  -5.324
   51    HA   VAL   7           HA       VAL   7  12.113 -16.953  -6.718
   52    HB   VAL   7           HB       VAL   7  14.064 -16.637  -5.250
   53   HG11  VAL   7          1HG1      VAL   7  11.696 -17.979  -3.847
   54   HG12  VAL   7          2HG1      VAL   7  12.878 -16.903  -3.083
   55   HG13  VAL   7          3HG1      VAL   7  11.796 -16.285  -4.354
   56   HG21  VAL   7          3HG2      VAL   7  13.698 -19.524  -4.370
   57   HG22  VAL   7          1HG2      VAL   7  15.075 -18.861  -5.279
   58   HG23  VAL   7          2HG2      VAL   7  14.767 -18.313  -3.623
   59    H    GLY   8           H        GLY   8  13.439 -16.116  -8.090
   60    HA2  GLY   8           2HA      GLY   8  15.209 -15.957  -9.570
   61    HA3  GLY   8           3HA      GLY   8  15.647 -17.649  -9.258
   62    H    SER   9           H        SER   9  12.602 -18.318  -9.811
   63    HA   SER   9           HA       SER   9  12.784 -18.822 -12.619
   64    HB2  SER   9           2HB      SER   9  10.216 -18.608 -11.025
   65    HB3  SER   9           3HB      SER   9  10.575 -19.631 -12.435
   66    HG   SER   9           HG       SER   9  10.619 -20.801 -10.432
   67    H    VAL  10           H        VAL  10  11.197 -17.947 -14.262
   68    HA   VAL  10           HA       VAL  10  10.209 -15.191 -13.823
   69    HB   VAL  10           HB       VAL  10  12.518 -14.851 -14.488
   70   HG11  VAL  10          1HG1      VAL  10  11.922 -16.521 -16.971
   71   HG12  VAL  10          2HG1      VAL  10  13.393 -15.571 -16.693
   72   HG13  VAL  10          3HG1      VAL  10  13.036 -16.962 -15.659
   73   HG21  VAL  10          3HG2      VAL  10  10.602 -14.228 -16.736
   74   HG22  VAL  10          1HG2      VAL  10  10.949 -13.243 -15.293
   75   HG23  VAL  10          2HG2      VAL  10  12.212 -13.507 -16.506
   76    H    TYR  11           H        TYR  11   8.379 -14.871 -14.667
   77    HA   TYR  11           HA       TYR  11   7.330 -16.597 -16.854
   78    HB2  TYR  11           2HB      TYR  11   6.186 -16.251 -14.070
   79    HB3  TYR  11           3HB      TYR  11   5.230 -16.857 -15.422
   80    HD1  TYR  11           HD1      TYR  11   5.817 -19.033 -16.527
   81    HD2  TYR  11           HD2      TYR  11   7.761 -17.693 -12.920
   82    HE1  TYR  11           HE1      TYR  11   6.552 -21.359 -16.072
   83    HE2  TYR  11           HE2      TYR  11   8.420 -20.042 -12.408
   84    HH   TYR  11           HH       TYR  11   7.644 -22.771 -14.577
   85    H    THR  12           H        THR  12   4.805 -15.673 -17.017
   86    HA   THR  12           HA       THR  12   5.040 -12.703 -17.194
   87    HB   THR  12           HB       THR  12   3.374 -14.472 -18.999
   88    HG1  THR  12           1HG      THR  12   5.104 -14.225 -20.497
   89   HG21  THR  12          1HG2      THR  12   4.512 -11.661 -19.359
   90   HG22  THR  12          2HG2      THR  12   3.521 -12.539 -20.546
   91   HG23  THR  12          3HG2      THR  12   2.819 -12.051 -18.996
   92    H    GLY  13           H        GLY  13   3.153 -11.494 -16.755
   93    HA2  GLY  13           2HA      GLY  13   0.832 -12.801 -15.538
   94    HA3  GLY  13           3HA      GLY  13   1.876 -11.893 -14.429
   95    H    LYS  14           H        LYS  14  -0.440 -10.839 -14.410
   96    HA   LYS  14           HA       LYS  14  -0.515  -8.587 -16.388
   97    HB2  LYS  14           2HB      LYS  14  -2.115 -10.605 -16.719
   98    HB3  LYS  14           3HB      LYS  14  -2.965  -9.989 -15.301
   99    HG2  LYS  14           2HG      LYS  14  -2.412  -8.396 -17.834
  100    HG3  LYS  14           3HG      LYS  14  -3.887  -9.332 -17.563
  101    HD2  LYS  14           2HD      LYS  14  -2.984  -6.892 -15.986
  102    HD3  LYS  14           3HD      LYS  14  -4.295  -6.959 -17.167
  103    HE2  LYS  14           2HE      LYS  14  -5.492  -8.611 -15.722
  104    HE3  LYS  14           3HE      LYS  14  -4.193  -8.457 -14.515
  105    HZ1  LYS  14           3HZ      LYS  14  -4.743  -6.139 -14.291
  106    HZ2  LYS  14           1HZ      LYS  14  -5.954  -6.265 -15.403
  107    HZ3  LYS  14           2HZ      LYS  14  -6.068  -7.070 -13.968
  108    H    VAL  15           H        VAL  15  -0.484  -6.667 -15.402
  109    HA   VAL  15           HA       VAL  15  -0.192  -6.507 -12.562
  110    HB   VAL  15           HB       VAL  15  -0.713  -4.209 -14.465
  111   HG11  VAL  15          1HG1      VAL  15   0.950  -4.445 -11.907
  112   HG12  VAL  15          2HG1      VAL  15   0.774  -2.979 -12.891
  113   HG13  VAL  15          3HG1      VAL  15  -0.630  -3.643 -12.038
  114   HG21  VAL  15          3HG2      VAL  15   1.958  -5.568 -13.957
  115   HG22  VAL  15          1HG2      VAL  15   1.063  -5.552 -15.488
  116   HG23  VAL  15          2HG2      VAL  15   1.709  -4.051 -14.846
  117    H    THR  16           H        THR  16  -1.604  -6.245 -11.014
  118    HA   THR  16           HA       THR  16  -4.488  -5.888 -11.691
  119    HB   THR  16           HB       THR  16  -4.593  -7.187  -9.374
  120    HG1  THR  16           1HG      THR  16  -2.845  -8.672  -9.251
  121   HG21  THR  16          1HG2      THR  16  -3.817  -8.543 -11.997
  122   HG22  THR  16          2HG2      THR  16  -4.646  -9.309 -10.622
  123   HG23  THR  16          3HG2      THR  16  -5.461  -8.036 -11.530
  124    H    GLY  17           H        GLY  17  -1.913  -4.308  -9.980
  125    HA2  GLY  17           2HA      GLY  17  -3.648  -2.098  -9.568
  126    HA3  GLY  17           3HA      GLY  17  -3.419  -2.932  -8.020
  127    H    LEU  18           H        LEU  18  -2.555  -0.360  -8.304
  128    HA   LEU  18           HA       LEU  18   0.412  -0.644  -8.126
  129    HB2  LEU  18           2HB      LEU  18  -1.176   1.774  -9.019
  130    HB3  LEU  18           3HB      LEU  18   0.569   1.742  -8.743
  131    HG   LEU  18           HG       LEU  18  -0.937   0.296 -10.961
  132   HD11  LEU  18          1HD1      LEU  18   1.065   2.596 -11.028
  133   HD12  LEU  18          2HD1      LEU  18   0.343   1.816 -12.446
  134   HD13  LEU  18          3HD1      LEU  18  -0.679   2.729 -11.319
  135   HD21  LEU  18          3HD2      LEU  18   2.046   0.324 -10.415
  136   HD22  LEU  18          1HD2      LEU  18   0.951  -1.067 -10.250
  137   HD23  LEU  18          2HD2      LEU  18   1.246  -0.370 -11.846
  138    H    GLN  19           H        GLN  19   1.307   0.485  -6.397
  139    HA   GLN  19           HA       GLN  19  -0.400   1.971  -4.490
  140    HB2  GLN  19           2HB      GLN  19   1.468  -0.277  -3.658
  141    HB3  GLN  19           3HB      GLN  19   0.471   0.738  -2.607
  142    HG2  GLN  19           2HG      GLN  19  -1.579  -0.261  -3.673
  143    HG3  GLN  19           3HG      GLN  19  -0.533  -1.402  -4.542
  144   HE21  GLN  19          2HE2      GLN  19   1.020  -2.720  -3.096
  145   HE22  GLN  19          1HE2      GLN  19   0.384  -3.231  -1.550
  146    H    ALA  20           H        ALA  20   1.030   3.213  -2.991
  147    HA   ALA  20           HA       ALA  20   3.198   4.456  -4.287
  148    HB1  ALA  20           1HB      ALA  20   2.492   4.441  -1.321
  149    HB2  ALA  20           2HB      ALA  20   3.505   5.640  -2.151
  150    HB3  ALA  20           3HB      ALA  20   1.781   5.513  -2.556
  151    H    TYR  21           H        TYR  21   3.315   1.401  -2.853
  152    HA   TYR  21           HA       TYR  21   6.286   1.522  -2.662
  153    HB2  TYR  21           2HB      TYR  21   6.290   0.231  -0.710
  154    HB3  TYR  21           3HB      TYR  21   5.174   1.564  -0.421
  155    HD1  TYR  21           HD1      TYR  21   2.652   1.113  -0.480
  156    HD2  TYR  21           HD2      TYR  21   5.590  -2.044  -0.532
  157    HE1  TYR  21           HE1      TYR  21   0.901  -0.519   0.178
  158    HE2  TYR  21           HE2      TYR  21   3.854  -3.676   0.174
  159    HH   TYR  21           HH       TYR  21   0.419  -2.705   0.657
  160    H    GLY  22           H        GLY  22   3.912   0.237  -4.572
  161    HA2  GLY  22           2HA      GLY  22   5.635  -1.365  -5.976
  162    HA3  GLY  22           3HA      GLY  22   4.970  -2.460  -4.755
  163    H    ALA  23           H        ALA  23   4.417  -3.313  -7.113
  164    HA   ALA  23           HA       ALA  23   1.593  -2.517  -7.729
  165    HB1  ALA  23           1HB      ALA  23   3.791  -3.301  -9.682
  166    HB2  ALA  23           2HB      ALA  23   2.091  -3.036 -10.089
  167    HB3  ALA  23           3HB      ALA  23   3.088  -1.683  -9.503
  168    H    PHE  24           H        PHE  24   0.187  -4.164  -7.845
  169    HA   PHE  24           HA       PHE  24   1.134  -6.868  -7.197
  170    HB2  PHE  24           2HB      PHE  24  -1.612  -5.667  -7.709
  171    HB3  PHE  24           3HB      PHE  24  -1.352  -7.368  -7.315
  172    HD1  PHE  24           HD1      PHE  24   0.337  -7.628  -5.131
  173    HD2  PHE  24           HD2      PHE  24  -2.397  -4.389  -5.946
  174    HE1  PHE  24           HE1      PHE  24   0.179  -7.147  -2.703
  175    HE2  PHE  24           HE2      PHE  24  -2.559  -3.918  -3.511
  176    HZ   PHE  24           HZ       PHE  24  -1.278  -5.293  -1.887
  177    H    VAL  25           H        VAL  25   1.231  -8.555  -8.632
  178    HA   VAL  25           HA       VAL  25   0.111  -8.210 -11.365
  179    HB   VAL  25           HB       VAL  25   2.857  -9.401 -10.804
  180   HG11  VAL  25          1HG1      VAL  25   1.417  -8.578 -13.365
  181   HG12  VAL  25          2HG1      VAL  25   3.051  -9.253 -13.277
  182   HG13  VAL  25          3HG1      VAL  25   1.666 -10.245 -12.801
  183   HG21  VAL  25          3HG2      VAL  25   2.266  -6.646 -11.941
  184   HG22  VAL  25          1HG2      VAL  25   3.021  -6.989 -10.371
  185   HG23  VAL  25          2HG2      VAL  25   3.857  -7.436 -11.859
  186    H    ALA  26           H        ALA  26  -1.420  -9.677 -11.457
  187    HA   ALA  26           HA       ALA  26  -1.393 -12.193 -10.000
  188    HB1  ALA  26           1HB      ALA  26  -3.040 -11.235 -12.374
  189    HB2  ALA  26           2HB      ALA  26  -3.354 -12.698 -11.407
  190    HB3  ALA  26           3HB      ALA  26  -3.485 -11.103 -10.652
  191    H    LEU  27           H        LEU  27  -1.011 -14.232 -10.811
  192    HA   LEU  27           HA       LEU  27   0.956 -14.308 -13.087
  193    HB2  LEU  27           2HB      LEU  27   0.919 -15.826 -10.466
  194    HB3  LEU  27           3HB      LEU  27   2.103 -16.042 -11.761
  195    HG   LEU  27           HG       LEU  27   1.767 -13.474 -10.158
  196   HD11  LEU  27          1HD1      LEU  27   3.855 -15.684  -9.919
  197   HD12  LEU  27          2HD1      LEU  27   3.863 -14.140  -9.036
  198   HD13  LEU  27          3HD1      LEU  27   2.580 -15.322  -8.736
  199   HD21  LEU  27          3HD2      LEU  27   3.953 -14.330 -12.089
  200   HD22  LEU  27          1HD2      LEU  27   2.717 -13.086 -12.391
  201   HD23  LEU  27          2HD2      LEU  27   3.922 -12.840 -11.117
  202    H    ASP  28           H        ASP  28  -1.706 -15.789 -11.382
  203    HA   ASP  28           HA       ASP  28  -2.384 -17.697 -13.470
  204    HB2  ASP  28           2HB      ASP  28  -0.933 -19.219 -12.609
  205    HB3  ASP  28           3HB      ASP  28  -0.880 -18.473 -11.017
  206    H    GLU  29           H        GLU  29  -4.429 -18.811 -12.746
  207    HA   GLU  29           HA       GLU  29  -6.360 -16.860 -12.122
  208    HB2  GLU  29           2HB      GLU  29  -6.442 -19.893 -12.159
  209    HB3  GLU  29           3HB      GLU  29  -7.886 -18.870 -11.997
  210    HG2  GLU  29           2HG      GLU  29  -7.320 -17.784 -14.186
  211    HG3  GLU  29           3HG      GLU  29  -5.944 -18.885 -14.342
  212    H    GLU  30           H        GLU  30  -4.515 -18.726  -9.833
  213    HA   GLU  30           HA       GLU  30  -6.090 -17.455  -7.647
  214    HB2  GLU  30           2HB      GLU  30  -5.959 -19.532  -6.356
  215    HB3  GLU  30           3HB      GLU  30  -6.881 -19.753  -7.855
  216    HG2  GLU  30           2HG      GLU  30  -4.929 -20.801  -8.923
  217    HG3  GLU  30           3HG      GLU  30  -3.968 -20.508  -7.466
  218    H    THR  31           H        THR  31  -3.339 -16.991  -9.059
  219    HA   THR  31           HA       THR  31  -1.783 -16.779  -6.522
  220    HB   THR  31           HB       THR  31  -0.533 -17.781  -9.085
  221    HG1  THR  31           1HG      THR  31  -0.684 -19.867  -8.209
  222   HG21  THR  31          1HG2      THR  31   0.256 -18.039  -6.152
  223   HG22  THR  31          2HG2      THR  31   1.174 -18.671  -7.531
  224   HG23  THR  31          3HG2      THR  31   0.984 -16.922  -7.329
  225    H    GLN  32           H        GLN  32  -0.388 -15.080  -6.398
  226    HA   GLN  32           HA       GLN  32  -0.153 -13.077  -8.537
  227    HB2  GLN  32           2HB      GLN  32  -2.429 -12.816  -7.643
  228    HB3  GLN  32           3HB      GLN  32  -1.787 -12.721  -5.998
  229    HG2  GLN  32           2HG      GLN  32  -0.680 -10.666  -7.820
  230    HG3  GLN  32           3HG      GLN  32  -2.428 -10.578  -7.645
  231   HE21  GLN  32          2HE2      GLN  32  -2.964  -9.054  -6.146
  232   HE22  GLN  32          1HE2      GLN  32  -2.118  -8.789  -4.643
  233    H    GLY  33           H        GLY  33   1.405 -11.444  -7.926
  234    HA2  GLY  33           2HA      GLY  33   2.657 -11.677  -5.253
  235    HA3  GLY  33           3HA      GLY  33   3.694 -11.862  -6.681
  236    H    LEU  34           H        LEU  34   4.530  -9.919  -5.274
  237    HA   LEU  34           HA       LEU  34   3.297  -7.336  -6.166
  238    HB2  LEU  34           2HB      LEU  34   2.617  -7.771  -3.930
  239    HB3  LEU  34           3HB      LEU  34   4.251  -8.255  -3.443
  240    HG   LEU  34           HG       LEU  34   5.047  -5.944  -3.682
  241   HD11  LEU  34          1HD1      LEU  34   2.153  -5.218  -4.327
  242   HD12  LEU  34          2HD1      LEU  34   3.481  -4.073  -4.028
  243   HD13  LEU  34          3HD1      LEU  34   3.531  -5.121  -5.442
  244   HD21  LEU  34          3HD2      LEU  34   2.520  -6.188  -2.000
  245   HD22  LEU  34          1HD2      LEU  34   4.162  -6.671  -1.517
  246   HD23  LEU  34          2HD2      LEU  34   3.790  -4.962  -1.790
  247    H    VAL  35           H        VAL  35   4.823  -6.733  -7.740
  248    HA   VAL  35           HA       VAL  35   7.665  -6.748  -7.046
  249    HB   VAL  35           HB       VAL  35   7.154  -6.798  -9.371
  250   HG11  VAL  35          1HG1      VAL  35   5.735  -4.125  -9.087
  251   HG12  VAL  35          2HG1      VAL  35   6.106  -4.942 -10.616
  252   HG13  VAL  35          3HG1      VAL  35   4.959  -5.676  -9.486
  253   HG21  VAL  35          3HG2      VAL  35   8.288  -4.101  -8.589
  254   HG22  VAL  35          1HG2      VAL  35   9.164  -5.624  -8.755
  255   HG23  VAL  35          2HG2      VAL  35   8.448  -4.856 -10.182
  256    H    HIS  36           H        HIS  36   8.495  -5.655  -5.473
  257    HA   HIS  36           HA       HIS  36   7.112  -3.427  -4.235
  258    HB2  HIS  36           2HB      HIS  36   9.917  -4.582  -3.941
  259    HB3  HIS  36           3HB      HIS  36   9.270  -3.281  -2.926
  260    HD1  HIS  36           HD1      HIS  36   7.502  -6.669  -3.840
  261    HD2  HIS  36           HD2      HIS  36   8.945  -4.410  -0.564
  262    HE1  HIS  36           HE1      HIS  36   6.853  -7.908  -1.779
  263    H    ILE  37           H        ILE  37   7.817  -1.194  -4.288
  264    HA   ILE  37           HA       ILE  37   8.312  -0.271  -6.924
  265    HB   ILE  37           HB       ILE  37   7.126   0.981  -5.128
  266   HG12  ILE  37          2HG1      ILE  37   9.342   2.533  -6.450
  267   HG13  ILE  37          3HG1      ILE  37   7.897   1.909  -7.275
  268   HG21  ILE  37          1HG2      ILE  37   9.943   1.609  -4.116
  269   HG22  ILE  37          2HG2      ILE  37   8.456   2.385  -3.560
  270   HG23  ILE  37          3HG2      ILE  37   8.709   0.668  -3.246
  271   HD11  ILE  37          3HD1      ILE  37   6.448   3.275  -5.802
  272   HD12  ILE  37          1HD1      ILE  37   7.885   3.917  -4.978
  273   HD13  ILE  37          2HD1      ILE  37   7.612   4.286  -6.686
  274    H    SER  38           H        SER  38  10.723  -0.774  -4.422
  275    HA   SER  38           HA       SER  38  12.932   0.312  -5.854
  276    HB2  SER  38           2HB      SER  38  13.003  -1.968  -3.860
  277    HB3  SER  38           3HB      SER  38  14.230  -0.717  -4.149
  278    HG   SER  38           HG       SER  38  12.973  -0.299  -2.256
  279    H    GLU  39           H        GLU  39  11.091  -2.307  -6.741
  280    HA   GLU  39           HA       GLU  39  13.314  -3.737  -8.123
  281    HB2  GLU  39           2HB      GLU  39  10.683  -4.800  -7.038
  282    HB3  GLU  39           3HB      GLU  39  11.898  -5.738  -7.898
  283    HG2  GLU  39           2HG      GLU  39  12.345  -4.340  -5.237
  284    HG3  GLU  39           3HG      GLU  39  11.930  -6.038  -5.400
  285    H    VAL  40           H        VAL  40  10.752  -1.623  -8.660
  286    HA   VAL  40           HA       VAL  40   9.618  -2.802 -11.035
  287    HB   VAL  40           HB       VAL  40   9.707   0.057 -10.008
  288   HG11  VAL  40          1HG1      VAL  40   7.962  -1.122 -12.221
  289   HG12  VAL  40          2HG1      VAL  40   7.814   0.516 -11.538
  290   HG13  VAL  40          3HG1      VAL  40   9.262   0.060 -12.447
  291   HG21  VAL  40          3HG2      VAL  40   7.502  -2.059  -9.940
  292   HG22  VAL  40          1HG2      VAL  40   8.456  -1.508  -8.558
  293   HG23  VAL  40          2HG2      VAL  40   7.353  -0.387  -9.363
  294    H    THR  41           H        THR  41  12.336  -0.511 -10.495
  295    HA   THR  41           HA       THR  41  13.346  -1.104 -13.227
  296    HB   THR  41           HB       THR  41  12.624   1.637 -12.140
  297    HG1  THR  41           1HG      THR  41  11.363   1.658 -14.084
  298   HG21  THR  41          1HG2      THR  41  14.037   0.976 -14.764
  299   HG22  THR  41          2HG2      THR  41  13.444   2.580 -14.271
  300   HG23  THR  41          3HG2      THR  41  14.762   1.819 -13.374
  301    H    HIS  42           H        HIS  42  15.517  -0.905 -13.388
  302    HA   HIS  42           HA       HIS  42  17.140  -0.941 -10.965
  303    HB2  HIS  42           2HB      HIS  42  18.973  -1.202 -12.826
  304    HB3  HIS  42           3HB      HIS  42  17.880  -2.543 -12.517
  305    HD1  HIS  42           HD1      HIS  42  16.671  -3.499 -14.628
  306    HD2  HIS  42           HD2      HIS  42  18.127   0.455 -15.104
  307    HE1  HIS  42           HE1      HIS  42  16.202  -2.851 -16.978
  308    H    GLY  43           H        GLY  43  16.067   1.365 -10.724
  309    HA2  GLY  43           2HA      GLY  43  18.129   3.305 -10.663
  310    HA3  GLY  43           3HA      GLY  43  17.094   3.624 -12.071
  311    H    PHE  44           H        PHE  44  16.851   5.630 -10.491
  312    HA   PHE  44           HA       PHE  44  15.021   5.485  -8.324
  313    HB2  PHE  44           2HB      PHE  44  15.420   7.716 -10.368
  314    HB3  PHE  44           3HB      PHE  44  14.613   7.881  -8.805
  315    HD1  PHE  44           HD1      PHE  44  16.006   7.329  -6.675
  316    HD2  PHE  44           HD2      PHE  44  17.728   8.148 -10.549
  317    HE1  PHE  44           HE1      PHE  44  18.173   7.889  -5.598
  318    HE2  PHE  44           HE2      PHE  44  19.891   8.705  -9.465
  319    HZ   PHE  44           HZ       PHE  44  20.119   8.578  -6.990
  320    H    VAL  45           H        VAL  45  12.789   5.891  -8.213
  321    HA   VAL  45           HA       VAL  45  11.189   5.552 -10.711
  322    HB   VAL  45           HB       VAL  45  10.748   4.243  -7.993
  323   HG11  VAL  45          1HG1      VAL  45   9.070   4.062 -10.537
  324   HG12  VAL  45          2HG1      VAL  45   8.809   3.128  -9.057
  325   HG13  VAL  45          3HG1      VAL  45   8.590   4.885  -9.037
  326   HG21  VAL  45          3HG2      VAL  45  11.356   3.018 -10.717
  327   HG22  VAL  45          1HG2      VAL  45  12.464   3.080  -9.330
  328   HG23  VAL  45          2HG2      VAL  45  10.987   2.115  -9.231
  329    H    LYS  46           H        LYS  46  10.762   7.670 -10.960
  330    HA   LYS  46           HA       LYS  46  10.419   9.646  -8.979
  331    HB2  LYS  46           2HB      LYS  46   8.947   9.566 -11.634
  332    HB3  LYS  46           3HB      LYS  46   9.348  10.992 -10.675
  333    HG2  LYS  46           2HG      LYS  46  11.272   9.193 -12.192
  334    HG3  LYS  46           3HG      LYS  46  10.783  10.830 -12.637
  335    HD2  LYS  46           2HD      LYS  46  12.422  10.066 -10.181
  336    HD3  LYS  46           3HD      LYS  46  13.061  10.769 -11.679
  337    HE2  LYS  46           2HE      LYS  46  11.641  12.789 -11.314
  338    HE3  LYS  46           3HE      LYS  46  11.073  12.092  -9.783
  339    HZ1  LYS  46           3HZ      LYS  46  13.345  12.148  -8.987
  340    HZ2  LYS  46           1HZ      LYS  46  13.873  12.798 -10.407
  341    HZ3  LYS  46           2HZ      LYS  46  12.861  13.653  -9.434
  342    H    ASP  47           H        ASP  47   7.909   7.773 -10.641
  343    HA   ASP  47           HA       ASP  47   6.388   7.424  -8.190
  344    HB2  ASP  47           2HB      ASP  47   5.373   9.492  -8.945
  345    HB3  ASP  47           3HB      ASP  47   5.200   8.871 -10.594
  346    H    ILE  48           H        ILE  48   5.147   5.458  -8.459
  347    HA   ILE  48           HA       ILE  48   6.307   3.608 -10.325
  348    HB   ILE  48           HB       ILE  48   5.458   3.074  -8.031
  349   HG12  ILE  48          2HG1      ILE  48   4.249   1.368 -10.202
  350   HG13  ILE  48          3HG1      ILE  48   5.972   1.418  -9.780
  351   HG21  ILE  48          1HG2      ILE  48   2.700   3.261  -9.334
  352   HG22  ILE  48          2HG2      ILE  48   3.030   2.614  -7.723
  353   HG23  ILE  48          3HG2      ILE  48   3.318   4.318  -8.050
  354   HD11  ILE  48          3HD1      ILE  48   5.446   0.673  -7.475
  355   HD12  ILE  48          1HD1      ILE  48   3.721   0.605  -7.893
  356   HD13  ILE  48          2HD1      ILE  48   4.862  -0.489  -8.683
  357    H    ASN  49           H        ASN  49   3.292   5.485 -10.677
  358    HA   ASN  49           HA       ASN  49   2.458   3.911 -12.934
  359    HB2  ASN  49           2HB      ASN  49   0.656   5.223 -12.948
  360    HB3  ASN  49           3HB      ASN  49   1.269   5.912 -11.438
  361   HD21  ASN  49          2HD2      ASN  49   2.788   7.851 -11.699
  362   HD22  ASN  49          1HD2      ASN  49   2.434   8.958 -13.043
  363    H    GLU  50           H        GLU  50   4.985   6.261 -12.687
  364    HA   GLU  50           HA       GLU  50   5.083   6.722 -15.586
  365    HB2  GLU  50           2HB      GLU  50   7.142   7.329 -13.444
  366    HB3  GLU  50           3HB      GLU  50   7.113   7.960 -15.088
  367    HG2  GLU  50           2HG      GLU  50   5.152   8.584 -12.847
  368    HG3  GLU  50           3HG      GLU  50   6.402   9.633 -13.512
  369    H    HIS  51           H        HIS  51   5.782   4.031 -13.753
  370    HA   HIS  51           HA       HIS  51   8.006   3.114 -15.531
  371    HB2  HIS  51           2HB      HIS  51   7.958   2.837 -12.475
  372    HB3  HIS  51           3HB      HIS  51   9.131   2.165 -13.617
  373    HD1  HIS  51           HD1      HIS  51   7.980   5.627 -12.304
  374    HD2  HIS  51           HD2      HIS  51  11.138   3.753 -14.410
  375    HE1  HIS  51           HE1      HIS  51   9.677   7.400 -12.793
  376    H    LEU  52           H        LEU  52   5.049   2.321 -13.904
  377    HA   LEU  52           HA       LEU  52   4.896  -0.115 -15.535
  378    HB2  LEU  52           2HB      LEU  52   5.657  -0.531 -12.990
  379    HB3  LEU  52           3HB      LEU  52   3.921  -0.364 -12.699
  380    HG   LEU  52           HG       LEU  52   3.647  -2.126 -14.619
  381   HD11  LEU  52          1HD1      LEU  52   6.554  -2.609 -13.856
  382   HD12  LEU  52          2HD1      LEU  52   5.559  -3.668 -14.876
  383   HD13  LEU  52          3HD1      LEU  52   5.990  -2.041 -15.435
  384   HD21  LEU  52          3HD2      LEU  52   4.865  -2.926 -11.958
  385   HD22  LEU  52          1HD2      LEU  52   3.147  -2.596 -12.283
  386   HD23  LEU  52          2HD2      LEU  52   3.935  -3.988 -13.046
  387    H    SER  53           H        SER  53   2.469  -0.974 -15.153
  388    HA   SER  53           HA       SER  53   0.553   1.273 -14.948
  389    HB2  SER  53           2HB      SER  53   0.945  -0.399 -17.465
  390    HB3  SER  53           3HB      SER  53  -0.307   0.832 -17.197
  391    HG   SER  53           HG       SER  53   1.501   1.635 -18.388
  392    H    VAL  54           H        VAL  54  -1.251   0.395 -13.898
  393    HA   VAL  54           HA       VAL  54  -1.776  -2.451 -13.732
  394    HB   VAL  54           HB       VAL  54  -2.545  -0.886 -12.031
  395   HG11  VAL  54          1HG1      VAL  54  -4.414   0.258 -14.153
  396   HG12  VAL  54          2HG1      VAL  54  -4.466   0.633 -12.420
  397   HG13  VAL  54          3HG1      VAL  54  -3.064   1.117 -13.386
  398   HG21  VAL  54          3HG2      VAL  54  -4.826  -2.268 -13.442
  399   HG22  VAL  54          1HG2      VAL  54  -3.728  -2.950 -12.216
  400   HG23  VAL  54          2HG2      VAL  54  -4.853  -1.649 -11.784
  401    H    GLY  55           H        GLY  55  -3.232  -3.729 -14.752
  402    HA2  GLY  55           2HA      GLY  55  -4.540  -4.468 -16.491
  403    HA3  GLY  55           3HA      GLY  55  -4.815  -2.780 -16.970
  404    H    ASP  56           H        ASP  56  -1.564  -4.179 -16.649
  405    HA   ASP  56           HA       ASP  56  -1.327  -4.431 -19.621
  406    HB2  ASP  56           2HB      ASP  56  -0.244  -2.394 -18.721
  407    HB3  ASP  56           3HB      ASP  56   0.775  -3.400 -17.679
  408    H    GLU  57           H        GLU  57   0.501  -5.919 -20.200
  409    HA   GLU  57           HA       GLU  57   0.572  -8.264 -18.337
  410    HB2  GLU  57           2HB      GLU  57  -0.716  -8.593 -20.426
  411    HB3  GLU  57           3HB      GLU  57   0.717  -8.131 -21.365
  412    HG2  GLU  57           2HG      GLU  57   1.886 -10.091 -20.048
  413    HG3  GLU  57           3HG      GLU  57   0.234 -10.623 -19.712
  414    H    VAL  58           H        VAL  58   2.571  -8.768 -17.598
  415    HA   VAL  58           HA       VAL  58   5.003  -7.622 -18.900
  416    HB   VAL  58           HB       VAL  58   5.728  -6.852 -16.635
  417   HG11  VAL  58          1HG1      VAL  58   3.132  -5.570 -17.626
  418   HG12  VAL  58          2HG1      VAL  58   4.320  -4.807 -16.558
  419   HG13  VAL  58          3HG1      VAL  58   4.760  -5.219 -18.223
  420   HG21  VAL  58          3HG2      VAL  58   2.858  -7.360 -15.779
  421   HG22  VAL  58          1HG2      VAL  58   4.301  -8.207 -15.191
  422   HG23  VAL  58          2HG2      VAL  58   4.089  -6.482 -14.850
  423    H    GLN  59           H        GLN  59   6.860  -8.752 -18.595
  424    HA   GLN  59           HA       GLN  59   6.632 -11.453 -17.475
  425    HB2  GLN  59           2HB      GLN  59   8.986  -9.978 -18.707
  426    HB3  GLN  59           3HB      GLN  59   8.983 -11.670 -18.184
  427    HG2  GLN  59           2HG      GLN  59   8.647 -11.740 -20.553
  428    HG3  GLN  59           3HG      GLN  59   7.079 -12.084 -19.808
  429   HE21  GLN  59          2HE2      GLN  59   8.928  -9.095 -20.749
  430   HE22  GLN  59          1HE2      GLN  59   7.592  -8.329 -21.590
  431    H    VAL  60           H        VAL  60   7.554 -12.059 -15.540
  432    HA   VAL  60           HA       VAL  60   8.637  -9.947 -13.724
  433    HB   VAL  60           HB       VAL  60   7.097 -11.214 -12.008
  434   HG11  VAL  60          1HG1      VAL  60   5.940  -9.249 -14.018
  435   HG12  VAL  60          2HG1      VAL  60   5.278  -9.587 -12.407
  436   HG13  VAL  60          3HG1      VAL  60   6.875  -8.842 -12.554
  437   HG21  VAL  60          3HG2      VAL  60   5.487 -11.717 -14.538
  438   HG22  VAL  60          1HG2      VAL  60   6.207 -12.953 -13.479
  439   HG23  VAL  60          2HG2      VAL  60   4.921 -11.895 -12.878
  440    H    LYS  61           H        LYS  61  10.379 -10.625 -12.654
  441    HA   LYS  61           HA       LYS  61  11.046 -13.519 -12.628
  442    HB2  LYS  61           2HB      LYS  61  12.769 -11.844 -13.197
  443    HB3  LYS  61           3HB      LYS  61  12.532 -11.067 -11.622
  444    HG2  LYS  61           2HG      LYS  61  13.279 -13.115 -10.474
  445    HG3  LYS  61           3HG      LYS  61  13.448 -13.945 -12.037
  446    HD2  LYS  61           2HD      LYS  61  15.201 -12.333 -12.709
  447    HD3  LYS  61           3HD      LYS  61  15.028 -11.492 -11.148
  448    HE2  LYS  61           2HE      LYS  61  15.667 -13.567  -9.959
  449    HE3  LYS  61           3HE      LYS  61  15.823 -14.415 -11.510
  450    HZ1  LYS  61           3HZ      LYS  61  17.600 -12.895 -12.094
  451    HZ2  LYS  61           1HZ      LYS  61  17.461 -12.106 -10.650
  452    HZ3  LYS  61           2HZ      LYS  61  17.953 -13.672 -10.682
  453    H    VAL  62           H        VAL  62  10.634 -14.785 -10.858
  454    HA   VAL  62           HA       VAL  62   9.282 -13.754  -8.529
  455    HB   VAL  62           HB       VAL  62  10.734 -16.411  -8.832
  456   HG11  VAL  62          1HG1      VAL  62   8.382 -15.501  -7.101
  457   HG12  VAL  62          2HG1      VAL  62   9.059 -17.141  -7.141
  458   HG13  VAL  62          3HG1      VAL  62  10.033 -15.795  -6.525
  459   HG21  VAL  62          3HG2      VAL  62   7.848 -15.765  -9.568
  460   HG22  VAL  62          1HG2      VAL  62   9.150 -16.180 -10.709
  461   HG23  VAL  62          2HG2      VAL  62   8.597 -17.379  -9.539
  462    H    LEU  63           H        LEU  63  10.204 -12.550  -7.007
  463    HA   LEU  63           HA       LEU  63  13.155 -12.564  -6.700
  464    HB2  LEU  63           2HB      LEU  63  11.983 -10.456  -7.132
  465    HB3  LEU  63           3HB      LEU  63  10.978 -10.702  -5.693
  466    HG   LEU  63           HG       LEU  63  13.015 -10.590  -4.263
  467   HD11  LEU  63          1HD1      LEU  63  14.440  -9.778  -6.843
  468   HD12  LEU  63          2HD1      LEU  63  15.128  -9.713  -5.206
  469   HD13  LEU  63          3HD1      LEU  63  14.732 -11.279  -5.923
  470   HD21  LEU  63          3HD2      LEU  63  12.574  -8.225  -6.124
  471   HD22  LEU  63          1HD2      LEU  63  11.635  -8.600  -4.662
  472   HD23  LEU  63          2HD2      LEU  63  13.348  -8.148  -4.527
  473    H    ALA  64           H        ALA  64  10.164 -13.130  -4.809
  474    HA   ALA  64           HA       ALA  64  11.672 -14.775  -2.897
  475    HB1  ALA  64           1HB      ALA  64  10.152 -12.313  -1.969
  476    HB2  ALA  64           2HB      ALA  64  10.809 -13.572  -0.924
  477    HB3  ALA  64           3HB      ALA  64  11.909 -12.550  -1.872
  478    H    VAL  65           H        VAL  65  10.217 -16.058  -1.597
  479    HA   VAL  65           HA       VAL  65   7.310 -15.937  -2.160
  480    HB   VAL  65           HB       VAL  65   9.047 -18.436  -2.409
  481   HG11  VAL  65          1HG1      VAL  65   6.026 -18.097  -2.722
  482   HG12  VAL  65          2HG1      VAL  65   6.941 -19.592  -3.029
  483   HG13  VAL  65          3HG1      VAL  65   6.843 -18.936  -1.389
  484   HG21  VAL  65          3HG2      VAL  65   7.445 -17.013  -4.562
  485   HG22  VAL  65          1HG2      VAL  65   9.215 -17.102  -4.452
  486   HG23  VAL  65          2HG2      VAL  65   8.274 -18.575  -4.738
  487    H    ASP  66           H        ASP  66   6.175 -16.350  -0.274
  488    HA   ASP  66           HA       ASP  66   7.530 -17.816   1.927
  489    HB2  ASP  66           2HB      ASP  66   7.729 -15.367   2.416
  490    HB3  ASP  66           3HB      ASP  66   5.968 -15.247   2.354
  491    H    GLU  67           H        GLU  67   6.318 -19.607   1.922
  492    HA   GLU  67           HA       GLU  67   3.577 -19.566   0.940
  493    HB2  GLU  67           2HB      GLU  67   5.198 -21.851   2.113
  494    HB3  GLU  67           3HB      GLU  67   3.701 -21.976   1.165
  495    HG2  GLU  67           2HG      GLU  67   4.999 -20.808  -0.729
  496    HG3  GLU  67           3HG      GLU  67   6.454 -21.108   0.222
  497    H    GLU  68           H        GLU  68   4.973 -19.183   4.098
  498    HA   GLU  68           HA       GLU  68   2.656 -20.258   5.523
  499    HB2  GLU  68           2HB      GLU  68   4.814 -18.362   6.527
  500    HB3  GLU  68           3HB      GLU  68   3.683 -19.318   7.500
  501    HG2  GLU  68           2HG      GLU  68   4.744 -21.408   6.498
  502    HG3  GLU  68           3HG      GLU  68   5.951 -20.345   5.758
  503    H    LYS  69           H        LYS  69   3.985 -17.043   4.679
  504    HA   LYS  69           HA       LYS  69   1.608 -15.534   5.371
  505    HB2  LYS  69           2HB      LYS  69   3.918 -15.030   3.451
  506    HB3  LYS  69           3HB      LYS  69   2.657 -13.835   3.817
  507    HG2  LYS  69           2HG      LYS  69   3.292 -13.887   6.213
  508    HG3  LYS  69           3HG      LYS  69   4.563 -15.073   5.852
  509    HD2  LYS  69           2HD      LYS  69   5.662 -13.429   4.340
  510    HD3  LYS  69           3HD      LYS  69   4.402 -12.234   4.744
  511    HE2  LYS  69           2HE      LYS  69   5.049 -12.372   7.133
  512    HE3  LYS  69           3HE      LYS  69   6.305 -13.563   6.721
  513    HZ1  LYS  69           3HZ      LYS  69   7.386 -11.877   5.394
  514    HZ2  LYS  69           1HZ      LYS  69   6.217 -10.771   5.763
  515    HZ3  LYS  69           2HZ      LYS  69   7.212 -11.354   6.939
  516    H    GLY  70           H        GLY  70   2.466 -17.536   2.612
  517    HA2  GLY  70           2HA      GLY  70   1.333 -18.046   0.667
  518    HA3  GLY  70           3HA      GLY  70  -0.112 -17.253   1.339
  519    H    LYS  71           H        LYS  71   3.196 -16.079   0.533
  520    HA   LYS  71           HA       LYS  71   2.030 -13.936  -1.196
  521    HB2  LYS  71           2HB      LYS  71   3.932 -13.668   1.157
  522    HB3  LYS  71           3HB      LYS  71   3.760 -12.415  -0.081
  523    HG2  LYS  71           2HG      LYS  71   1.480 -13.420   1.670
  524    HG3  LYS  71           3HG      LYS  71   2.456 -11.982   2.015
  525    HD2  LYS  71           2HD      LYS  71   1.711 -10.970  -0.136
  526    HD3  LYS  71           3HD      LYS  71   0.713 -12.401  -0.445
  527    HE2  LYS  71           2HE      LYS  71  -0.741 -10.709   0.398
  528    HE3  LYS  71           3HE      LYS  71  -0.553 -11.944   1.657
  529    HZ1  LYS  71           3HZ      LYS  71   1.025 -10.486   2.741
  530    HZ2  LYS  71           1HZ      LYS  71   0.846  -9.337   1.570
  531    HZ3  LYS  71           2HZ      LYS  71  -0.418  -9.720   2.559
  532    H    ILE  72           H        ILE  72   3.537 -12.962  -2.600
  533    HA   ILE  72           HA       ILE  72   6.127 -14.310  -3.121
  534    HB   ILE  72           HB       ILE  72   3.888 -13.880  -5.162
  535   HG12  ILE  72          2HG1      ILE  72   5.135 -16.438  -4.138
  536   HG13  ILE  72          3HG1      ILE  72   3.492 -15.856  -3.819
  537   HG21  ILE  72          1HG2      ILE  72   6.729 -14.929  -5.552
  538   HG22  ILE  72          2HG2      ILE  72   5.484 -14.845  -6.815
  539   HG23  ILE  72          3HG2      ILE  72   6.117 -13.367  -6.122
  540   HD11  ILE  72          3HD1      ILE  72   2.923 -16.069  -6.211
  541   HD12  ILE  72          1HD1      ILE  72   4.553 -16.690  -6.547
  542   HD13  ILE  72          2HD1      ILE  72   3.461 -17.616  -5.527
  543    H    SER  73           H        SER  73   7.642 -12.809  -3.617
  544    HA   SER  73           HA       SER  73   6.740 -10.044  -4.313
  545    HB2  SER  73           2HB      SER  73   9.442 -10.927  -3.271
  546    HB3  SER  73           3HB      SER  73   8.881  -9.270  -3.513
  547    HG   SER  73           HG       SER  73   8.704  -9.941  -1.307
  548    H    LEU  74           H        LEU  74   7.860  -9.039  -6.075
  549    HA   LEU  74           HA       LEU  74   9.005 -10.961  -8.066
  550    HB2  LEU  74           2HB      LEU  74   6.834  -8.897  -8.475
  551    HB3  LEU  74           3HB      LEU  74   7.553  -9.872  -9.762
  552    HG   LEU  74           HG       LEU  74   5.915 -10.984  -7.431
  553   HD11  LEU  74          1HD1      LEU  74   5.156 -10.564 -10.349
  554   HD12  LEU  74          2HD1      LEU  74   4.156 -11.365  -9.126
  555   HD13  LEU  74          3HD1      LEU  74   4.531  -9.641  -8.965
  556   HD21  LEU  74          3HD2      LEU  74   6.948 -12.363  -9.935
  557   HD22  LEU  74          1HD2      LEU  74   7.530 -12.611  -8.273
  558   HD23  LEU  74          2HD2      LEU  74   5.884 -13.072  -8.702
  559    H    SER  75           H        SER  75  10.132  -9.807  -9.840
  560    HA   SER  75           HA       SER  75  10.619  -6.916  -9.386
  561    HB2  SER  75           2HB      SER  75  13.002  -7.346 -10.112
  562    HB3  SER  75           3HB      SER  75  12.566  -7.834  -8.466
  563    HG   SER  75           HG       SER  75  13.793  -9.432  -9.537
  564    H    ILE  76           H        ILE  76  10.798  -5.695 -11.086
  565    HA   ILE  76           HA       ILE  76  10.407  -6.831 -13.837
  566    HB   ILE  76           HB       ILE  76   9.438  -4.263 -12.533
  567   HG12  ILE  76          2HG1      ILE  76   8.026  -6.193 -12.076
  568   HG13  ILE  76          3HG1      ILE  76   7.231  -4.901 -12.980
  569   HG21  ILE  76          1HG2      ILE  76   9.247  -5.057 -15.472
  570   HG22  ILE  76          2HG2      ILE  76   8.444  -3.654 -14.723
  571   HG23  ILE  76          3HG2      ILE  76  10.202  -3.733 -14.796
  572   HD11  ILE  76          3HD1      ILE  76   7.464  -6.210 -15.078
  573   HD12  ILE  76          1HD1      ILE  76   8.282  -7.496 -14.158
  574   HD13  ILE  76          2HD1      ILE  76   6.577  -7.093 -13.850
  575    H    ARG  77           H        ARG  77  12.382  -4.702 -11.754
  576    HA   ARG  77           HA       ARG  77  13.978  -3.671 -13.841
  577    HB2  ARG  77           2HB      ARG  77  15.674  -3.320 -12.254
  578    HB3  ARG  77           3HB      ARG  77  14.105  -2.975 -11.509
  579    HG2  ARG  77           2HG      ARG  77  14.240  -4.975 -10.130
  580    HG3  ARG  77           3HG      ARG  77  15.704  -5.522 -10.978
  581    HD2  ARG  77           2HD      ARG  77  16.979  -3.640 -10.182
  582    HD3  ARG  77           3HD      ARG  77  15.526  -2.848  -9.527
  583    HE   ARG  77           HE       ARG  77  15.507  -5.139  -8.118
  584   HH11  ARG  77          1HH1      ARG  77  18.345  -3.118  -8.814
  585   HH12  ARG  77          2HH1      ARG  77  19.027  -3.334  -7.235
  586   HH21  ARG  77          1HH2      ARG  77  16.313  -5.255  -6.026
  587   HH22  ARG  77          2HH2      ARG  77  17.865  -4.572  -5.637
  588    H    ALA  78           H        ALA  78  13.858  -6.922 -12.666
  589    HA   ALA  78           HA       ALA  78  16.261  -7.848 -13.967
  590    HB1  ALA  78           1HB      ALA  78  13.723  -9.326 -13.135
  591    HB2  ALA  78           2HB      ALA  78  15.278 -10.075 -13.558
  592    HB3  ALA  78           3HB      ALA  78  15.151  -9.053 -12.107
  593    H    THR  79           H        THR  79  12.980  -7.191 -15.168
  594    HA   THR  79           HA       THR  79  13.530  -8.801 -17.613
  595    HB   THR  79           HB       THR  79  11.057  -8.841 -17.827
  596    HG1  THR  79           1HG      THR  79   9.840  -8.124 -16.026
  597   HG21  THR  79          1HG2      THR  79  12.034  -9.730 -15.066
  598   HG22  THR  79          2HG2      THR  79  10.582 -10.316 -15.887
  599   HG23  THR  79          3HG2      THR  79  12.175 -10.672 -16.567
  600    H    GLN  80           H        GLN  80  12.931  -5.518 -16.546
  601    HA   GLN  80           HA       GLN  80  12.569  -4.341 -19.142
  602    HB2  GLN  80           2HB      GLN  80  13.629  -3.342 -16.475
  603    HB3  GLN  80           3HB      GLN  80  13.585  -2.299 -17.908
  604    HG2  GLN  80           2HG      GLN  80  11.141  -2.655 -18.108
  605    HG3  GLN  80           3HG      GLN  80  11.191  -3.705 -16.694
  606   HE21  GLN  80          2HE2      GLN  80   9.419  -1.585 -16.652
  607   HE22  GLN  80          1HE2      GLN  80  10.005  -0.352 -15.550
  608    H    ALA  81           H        ALA  81  14.150  -2.914 -20.116
  609    HA   ALA  81           HA       ALA  81  15.918  -2.667 -21.458
  610    HB1  ALA  81           1HB      ALA  81  17.530  -3.290 -18.958
  611    HB2  ALA  81           2HB      ALA  81  18.115  -2.431 -20.395
  612    HB3  ALA  81           3HB      ALA  81  16.849  -1.702 -19.386
  613    H    ALA  82           H        ALA  82  14.743  -5.117 -21.749
  614    HA   ALA  82           HA       ALA  82  16.925  -6.637 -23.041
  615    HB1  ALA  82           1HB      ALA  82  14.882  -7.834 -21.116
  616    HB2  ALA  82           2HB      ALA  82  15.997  -8.764 -22.140
  617    HB3  ALA  82           3HB      ALA  82  16.638  -7.731 -20.847
  618    HA   PRO  83           HA       PRO  83  13.935  -7.017 -26.324
  619    HB2  PRO  83           2HB      PRO  83  14.458  -9.981 -26.297
  620    HB3  PRO  83           3HB      PRO  83  14.434  -8.849 -27.680
  621    HG2  PRO  83           2HG      PRO  83  16.811  -9.681 -26.636
  622    HG3  PRO  83           3HG      PRO  83  16.589  -7.982 -27.134
  623    HD2  PRO  83           2HD      PRO  83  16.445  -9.155 -24.336
  624    HD3  PRO  83           3HD      PRO  83  17.193  -7.626 -24.874
  625    H    GLU  84           H        GLU  84  11.819  -7.739 -26.814
  626    HA   GLU  84           HA       GLU  84  10.485  -9.673 -24.986
  627    HB2  GLU  84           2HB      GLU  84   9.583  -6.873 -25.698
  628    HB3  GLU  84           3HB      GLU  84   8.414  -8.149 -25.309
  629    HG2  GLU  84           2HG      GLU  84   9.543  -8.477 -23.107
  630    HG3  GLU  84           3HG      GLU  84  10.647  -7.160 -23.504
  631    H    LYS  85           H        LYS  85  10.170 -11.317 -26.422
  632    HA   LYS  85           HA       LYS  85  10.166 -11.079 -29.245
  633    HB2  LYS  85           2HB      LYS  85  10.617 -13.119 -27.839
  634    HB3  LYS  85           3HB      LYS  85   8.869 -13.255 -27.560
  635    HG2  LYS  85           2HG      LYS  85   8.479 -13.584 -29.964
  636    HG3  LYS  85           3HG      LYS  85  10.205 -13.318 -30.306
  637    HD2  LYS  85           2HD      LYS  85  10.791 -15.327 -29.007
  638    HD3  LYS  85           3HD      LYS  85   9.088 -15.563 -28.577
  639    HE2  LYS  85           2HE      LYS  85   9.596 -17.098 -30.344
  640    HE3  LYS  85           3HE      LYS  85   8.544 -15.831 -31.005
  641    HZ1  LYS  85           3HZ      LYS  85  10.501 -14.791 -31.952
  642    HZ2  LYS  85           1HZ      LYS  85  11.477 -15.973 -31.339
  643    HZ3  LYS  85           2HZ      LYS  85  10.360 -16.340 -32.488
  644    H    LYS  86           H        LYS  86   7.440 -10.762 -27.028
  645    HA   LYS  86           HA       LYS  86   5.398 -10.989 -29.025
  646    HB2  LYS  86           2HB      LYS  86   3.902 -10.312 -27.330
  647    HB3  LYS  86           3HB      LYS  86   5.125 -11.336 -26.566
  648    HG2  LYS  86           2HG      LYS  86   6.291  -9.190 -25.796
  649    HG3  LYS  86           3HG      LYS  86   4.866  -8.301 -26.379
  650    HD2  LYS  86           2HD      LYS  86   3.452  -9.822 -24.898
  651    HD3  LYS  86           3HD      LYS  86   4.973 -10.436 -24.210
  652    HE2  LYS  86           2HE      LYS  86   5.553  -8.057 -23.559
  653    HE3  LYS  86           3HE      LYS  86   3.936  -7.568 -24.113
  654    HZ1  LYS  86           3HZ      LYS  86   2.991  -9.087 -22.496
  655    HZ2  LYS  86           1HZ      LYS  86   4.489  -9.517 -21.972
  656    HZ3  LYS  86           2HZ      LYS  86   3.962  -7.970 -21.750
  657    H    GLU  87           H        GLU  87   7.612  -8.404 -28.614
  658    HA   GLU  87           HA       GLU  87   5.886  -6.245 -29.377
  659    HB2  GLU  87           2HB      GLU  87   8.867  -6.719 -29.686
  660    HB3  GLU  87           3HB      GLU  87   8.073  -5.194 -30.101
  661    HG2  GLU  87           2HG      GLU  87   7.750  -6.385 -27.327
  662    HG3  GLU  87           3HG      GLU  87   9.195  -5.474 -27.771
  663    H    SER  88           H        SER  88   5.748  -5.183 -31.369
  664    HA   SER  88           HA       SER  88   6.318  -6.721 -33.859
  665    HB2  SER  88           2HB      SER  88   3.637  -5.463 -33.173
  666    HB3  SER  88           3HB      SER  88   4.048  -6.376 -34.640
  667    HG   SER  88           HG       SER  88   2.918  -7.658 -33.081
  668    H    LYS  89           H        LYS  89   7.343  -4.177 -32.462
  669    HA   LYS  89           HA       LYS  89   7.187  -2.336 -34.787
  670    HB2  LYS  89           2HB      LYS  89   6.558  -1.626 -31.893
  671    HB3  LYS  89           3HB      LYS  89   6.902  -0.430 -33.154
  672    HG2  LYS  89           2HG      LYS  89   4.961  -1.346 -34.474
  673    HG3  LYS  89           3HG      LYS  89   4.560  -2.372 -33.084
  674    HD2  LYS  89           2HD      LYS  89   4.674   0.671 -33.048
  675    HD3  LYS  89           3HD      LYS  89   3.191  -0.295 -33.201
  676    HE2  LYS  89           2HE      LYS  89   3.670  -1.347 -30.988
  677    HE3  LYS  89           3HE      LYS  89   5.113  -0.325 -30.831
  678    HZ1  LYS  89           3HZ      LYS  89   3.678   1.605 -30.877
  679    HZ2  LYS  89           1HZ      LYS  89   2.335   0.658 -31.022
  680    HZ3  LYS  89           2HZ      LYS  89   3.249   0.596 -29.652
  681    HA   PRO  90           HA       PRO  90  11.540  -1.687 -33.882
  682    HB2  PRO  90           2HB      PRO  90  10.911   1.261 -33.805
  683    HB3  PRO  90           3HB      PRO  90  12.251   0.412 -34.628
  684    HG2  PRO  90           2HG      PRO  90  10.068   1.223 -36.049
  685    HG3  PRO  90           3HG      PRO  90  10.800  -0.376 -36.368
  686    HD2  PRO  90           2HD      PRO  90   8.333   0.271 -34.717
  687    HD3  PRO  90           3HD      PRO  90   8.600  -1.085 -35.849
  688    H    ARG  91           H        ARG  91  12.968  -1.053 -32.179
  689    HA   ARG  91           HA       ARG  91  11.870  -0.098 -29.608
  690    HB2  ARG  91           2HB      ARG  91  11.165  -2.464 -29.866
  691    HB3  ARG  91           3HB      ARG  91  12.862  -2.933 -30.062
  692    HG2  ARG  91           2HG      ARG  91  13.361  -2.401 -27.761
  693    HG3  ARG  91           3HG      ARG  91  11.801  -1.571 -27.541
  694    HD2  ARG  91           2HD      ARG  91  10.569  -3.629 -27.798
  695    HD3  ARG  91           3HD      ARG  91  12.023  -4.507 -28.305
  696    HE   ARG  91           HE       ARG  91  12.914  -4.267 -26.078
  697   HH11  ARG  91          1HH1      ARG  91   9.373  -3.557 -26.246
  698   HH12  ARG  91          2HH1      ARG  91   9.157  -4.067 -24.577
  699   HH21  ARG  91          1HH2      ARG  91  12.441  -5.026 -23.958
  700   HH22  ARG  91          2HH2      ARG  91  10.798  -4.855 -23.362
  701    H    LYS  92           H        LYS  92  13.590   0.541 -28.219
  702    HA   LYS  92           HA       LYS  92  15.937   1.403 -29.589
  703    HB2  LYS  92           2HB      LYS  92  15.408   1.207 -26.602
  704    HB3  LYS  92           3HB      LYS  92  16.714   2.133 -27.358
  705    HG2  LYS  92           2HG      LYS  92  13.731   2.666 -27.668
  706    HG3  LYS  92           3HG      LYS  92  14.851   3.577 -26.645
  707    HD2  LYS  92           2HD      LYS  92  16.136   4.240 -28.703
  708    HD3  LYS  92           3HD      LYS  92  14.903   3.416 -29.693
  709    HE2  LYS  92           2HE      LYS  92  13.154   4.883 -28.739
  710    HE3  LYS  92           3HE      LYS  92  14.377   5.703 -27.748
  711    HZ1  LYS  92           3HZ      LYS  92  15.436   6.444 -29.783
  712    HZ2  LYS  92           1HZ      LYS  92  14.302   5.679 -30.700
  713    HZ3  LYS  92           2HZ      LYS  92  13.873   6.945 -29.741
  714    HA   PRO  93           HA       PRO  93  18.672  -2.086 -29.346
  715    HB2  PRO  93           2HB      PRO  93  20.767  -0.087 -28.509
  716    HB3  PRO  93           3HB      PRO  93  20.863  -1.392 -29.726
  717    HG2  PRO  93           2HG      PRO  93  20.445   1.175 -30.534
  718    HG3  PRO  93           3HG      PRO  93  19.572  -0.176 -31.309
  719    HD2  PRO  93           2HD      PRO  93  18.557   1.759 -29.204
  720    HD3  PRO  93           3HD      PRO  93  17.702   1.073 -30.616
  721    H    LYS  94           H        LYS  94  18.825   0.259 -26.659
  722    HA   LYS  94           HA       LYS  94  19.987  -1.423 -24.674
  723    HB2  LYS  94           2HB      LYS  94  18.070   0.930 -24.421
  724    HB3  LYS  94           3HB      LYS  94  18.944   0.187 -23.068
  725    HG2  LYS  94           2HG      LYS  94  21.112   0.751 -24.175
  726    HG3  LYS  94           3HG      LYS  94  20.215   1.559 -25.481
  727    HD2  LYS  94           2HD      LYS  94  19.261   3.160 -23.888
  728    HD3  LYS  94           3HD      LYS  94  20.036   2.312 -22.539
  729    HE2  LYS  94           2HE      LYS  94  21.353   4.258 -23.000
  730    HE3  LYS  94           3HE      LYS  94  22.273   2.838 -23.534
  731    HZ1  LYS  94           3HZ      LYS  94  21.589   3.326 -25.789
  732    HZ2  LYS  94           1HZ      LYS  94  20.732   4.647 -25.289
  733    HZ3  LYS  94           2HZ      LYS  94  22.370   4.622 -25.142
  734    H    ALA  95           H        ALA  95  16.877  -1.752 -26.066
  735    HA   ALA  95           HA       ALA  95  16.328  -3.902 -24.090
  736    HB1  ALA  95           1HB      ALA  95  14.305  -1.902 -25.195
  737    HB2  ALA  95           2HB      ALA  95  13.929  -3.301 -24.164
  738    HB3  ALA  95           3HB      ALA  95  14.897  -1.964 -23.517
  739    H    ALA  96           H        ALA  96  17.538  -3.721 -26.869
  740    HA   ALA  96           HA       ALA  96  15.925  -5.871 -28.103
  741    HB1  ALA  96           1HB      ALA  96  16.740  -3.316 -29.555
  742    HB2  ALA  96           2HB      ALA  96  15.985  -4.740 -30.301
  743    HB3  ALA  96           3HB      ALA  96  15.082  -3.779 -29.114
  744    H    GLN  97           H        GLN  97  18.412  -5.773 -26.619
  745    HA   GLN  97           HA       GLN  97  20.738  -5.885 -28.220
  746    HB2  GLN  97           2HB      GLN  97  20.066  -7.486 -25.719
  747    HB3  GLN  97           3HB      GLN  97  21.682  -7.204 -26.385
  748    HG2  GLN  97           2HG      GLN  97  21.746  -5.553 -24.819
  749    HG3  GLN  97           3HG      GLN  97  20.924  -4.635 -26.079
  750   HE21  GLN  97          2HE2      GLN  97  20.882  -4.778 -22.908
  751   HE22  GLN  97          1HE2      GLN  97  19.163  -4.710 -22.554
  752    H    VAL  98           H        VAL  98  21.954  -7.672 -28.988
  753    HA   VAL  98           HA       VAL  98  20.466 -10.219 -29.531
  754    HB   VAL  98           HB       VAL  98  21.596 -10.242 -31.745
  755   HG11  VAL  98          1HG1      VAL  98  19.892  -7.750 -31.267
  756   HG12  VAL  98          2HG1      VAL  98  20.195  -8.513 -32.839
  757   HG13  VAL  98          3HG1      VAL  98  19.284  -9.384 -31.588
  758   HG21  VAL  98          3HG2      VAL  98  22.462  -7.396 -31.112
  759   HG22  VAL  98          1HG2      VAL  98  23.520  -8.818 -31.303
  760   HG23  VAL  98          2HG2      VAL  98  22.590  -8.212 -32.684
  761    H    SER  99           H        SER  99  23.132  -8.937 -27.957
  762    HA   SER  99           HA       SER  99  25.049 -11.004 -28.282
  763    HB2  SER  99           2HB      SER  99  24.429  -9.466 -25.738
  764    HB3  SER  99           3HB      SER  99  25.986 -10.148 -26.250
  765    HG   SER  99           HG       SER  99  25.845  -7.870 -26.626
  766    H    GLU 100           H        GLU 100  25.448 -12.890 -27.085
  767    HA   GLU 100           HA       GLU 100  23.635 -13.784 -24.979
  768    HB2  GLU 100           2HB      GLU 100  23.045 -15.858 -26.066
  769    HB3  GLU 100           3HB      GLU 100  22.453 -14.488 -27.015
  770    HG2  GLU 100           2HG      GLU 100  24.374 -14.770 -28.590
  771    HG3  GLU 100           3HG      GLU 100  24.935 -16.144 -27.629
  772    H    GLU 101           H        GLU 101  24.445 -15.854 -24.059
  773    HA   GLU 101           HA       GLU 101  27.143 -16.759 -24.755
  774    HB2  GLU 101           2HB      GLU 101  27.479 -14.900 -23.122
  775    HB3  GLU 101           3HB      GLU 101  26.427 -15.750 -21.973
  776    HG2  GLU 101           2HG      GLU 101  27.993 -17.612 -21.849
  777    HG3  GLU 101           3HG      GLU 101  29.015 -16.902 -23.107
  778    H    ALA 102           H        ALA 102  27.396 -18.942 -24.046
  779    HA   ALA 102           HA       ALA 102  25.340 -20.309 -22.455
  780    HB1  ALA 102           1HB      ALA 102  25.801 -20.943 -25.408
  781    HB2  ALA 102           2HB      ALA 102  24.838 -21.924 -24.279
  782    HB3  ALA 102           3HB      ALA 102  24.307 -20.285 -24.705
  783    H    SER 103           H        SER 103  25.948 -22.609 -22.208
  784    HA   SER 103           HA       SER 103  28.771 -23.027 -21.733
  785    HB2  SER 103           2HB      SER 103  26.504 -25.048 -21.675
  786    HB3  SER 103           3HB      SER 103  28.041 -25.111 -20.786
  787    HG   SER 103           HG       SER 103  26.288 -24.382 -19.472
  788    H    THR 104           H        THR 104  27.742 -22.740 -24.648
  789    HA   THR 104           HA       THR 104  28.080 -25.149 -26.050
  790    HB   THR 104           HB       THR 104  28.726 -23.392 -27.925
  791    HG1  THR 104           1HG      THR 104  27.953 -21.294 -27.342
  792   HG21  THR 104          1HG2      THR 104  26.044 -23.289 -26.469
  793   HG22  THR 104          2HG2      THR 104  26.337 -22.769 -28.145
  794   HG23  THR 104          3HG2      THR 104  26.507 -24.480 -27.704
  795    HA   PRO 105           HA       PRO 105  32.254 -26.107 -25.860
  796    HB2  PRO 105           2HB      PRO 105  32.876 -27.173 -28.335
  797    HB3  PRO 105           3HB      PRO 105  31.877 -27.999 -27.107
  798    HG2  PRO 105           2HG      PRO 105  30.966 -26.398 -29.526
  799    HG3  PRO 105           3HG      PRO 105  30.336 -27.958 -28.927
  800    HD2  PRO 105           2HD      PRO 105  29.096 -25.569 -28.342
  801    HD3  PRO 105           3HD      PRO 105  29.133 -26.912 -27.165
  802    H    GLN 106           H        GLN 106  31.518 -24.179 -28.793
  803    HA   GLN 106           HA       GLN 106  32.680 -22.545 -29.923
  804    HB2  GLN 106           2HB      GLN 106  32.304 -21.700 -27.452
  805    HB3  GLN 106           3HB      GLN 106  34.064 -21.852 -27.339
  806    HG2  GLN 106           2HG      GLN 106  34.325 -20.266 -29.224
  807    HG3  GLN 106           3HG      GLN 106  32.568 -20.169 -29.406
  808   HE21  GLN 106          2HE2      GLN 106  31.468 -18.622 -28.190
  809   HE22  GLN 106          1HE2      GLN 106  32.215 -17.698 -26.895
  810    H    GLY 107           H        GLY 107  34.036 -25.250 -29.593
  811    HA2  GLY 107           2HA      GLY 107  35.973 -26.259 -30.232
  812    HA3  GLY 107           3HA      GLY 107  36.403 -24.748 -31.057
  813    H    PHE 108           H        PHE 108  35.882 -24.633 -27.568
  814    HA   PHE 108           HA       PHE 108  38.732 -24.939 -26.884
  815    HB2  PHE 108           2HB      PHE 108  38.654 -22.650 -27.807
  816    HB3  PHE 108           3HB      PHE 108  37.318 -22.233 -26.730
  817    HD1  PHE 108           HD1      PHE 108  40.913 -23.227 -26.820
  818    HD2  PHE 108           HD2      PHE 108  37.716 -21.493 -24.502
  819    HE1  PHE 108           HE1      PHE 108  42.551 -22.521 -25.085
  820    HE2  PHE 108           HE2      PHE 108  39.354 -20.789 -22.770
  821    HZ   PHE 108           HZ       PHE 108  41.772 -21.302 -23.060
  822    H    ASN 109           H        ASN 109  35.574 -23.647 -25.767
  823    HA   ASN 109           HA       ASN 109  35.911 -24.485 -23.003
  824    HB2  ASN 109           2HB      ASN 109  34.464 -22.583 -23.752
  825    HB3  ASN 109           3HB      ASN 109  33.436 -23.742 -24.603
  826   HD21  ASN 109          2HD2      ASN 109  31.548 -23.998 -23.499
  827   HD22  ASN 109          1HD2      ASN 109  31.435 -24.154 -21.753
  828    H    THR 110           H        THR 110  35.379 -26.264 -25.789
  829    HA   THR 110           HA       THR 110  33.552 -28.252 -25.395
  830    HB   THR 110           HB       THR 110  36.379 -28.879 -26.266
  831    HG1  THR 110           1HG      THR 110  35.855 -27.906 -28.263
  832   HG21  THR 110          1HG2      THR 110  33.635 -29.598 -27.404
  833   HG22  THR 110          2HG2      THR 110  35.201 -30.152 -28.038
  834   HG23  THR 110          3HG2      THR 110  34.663 -30.665 -26.427
  835    H    LEU 111           H        LEU 111  33.052 -29.647 -23.885
  836    HA   LEU 111           HA       LEU 111  34.677 -29.969 -21.527
  837    HB2  LEU 111           2HB      LEU 111  32.227 -31.480 -22.486
  838    HB3  LEU 111           3HB      LEU 111  32.908 -31.592 -20.858
  839    HG   LEU 111           HG       LEU 111  31.656 -29.097 -22.103
  840   HD11  LEU 111          1HD1      LEU 111  30.718 -30.940 -19.856
  841   HD12  LEU 111          2HD1      LEU 111  29.900 -29.453 -20.389
  842   HD13  LEU 111          3HD1      LEU 111  30.018 -30.846 -21.483
  843   HD21  LEU 111          3HD2      LEU 111  32.745 -29.490 -19.286
  844   HD22  LEU 111          1HD2      LEU 111  33.449 -28.454 -20.557
  845   HD23  LEU 111          2HD2      LEU 111  31.864 -28.064 -19.894
  846    H    LYS 112           H        LYS 112  35.673 -31.839 -20.736
  847    HA   LYS 112           HA       LYS 112  36.864 -33.691 -22.574
  848    HB2  LYS 112           2HB      LYS 112  37.647 -34.851 -20.588
  849    HB3  LYS 112           3HB      LYS 112  37.869 -33.104 -20.427
  850    HG2  LYS 112           2HG      LYS 112  35.853 -32.992 -18.958
  851    HG3  LYS 112           3HG      LYS 112  35.650 -34.751 -19.119
  852    HD2  LYS 112           2HD      LYS 112  37.847 -35.125 -18.075
  853    HD3  LYS 112           3HD      LYS 112  38.114 -33.374 -17.981
  854    HE2  LYS 112           2HE      LYS 112  37.451 -34.092 -15.801
  855    HE3  LYS 112           3HE      LYS 112  36.094 -33.186 -16.500
  856    HZ1  LYS 112           3HZ      LYS 112  35.042 -35.300 -17.019
  857    HZ2  LYS 112           1HZ      LYS 112  36.308 -36.131 -16.356
  858    HZ3  LYS 112           2HZ      LYS 112  35.359 -35.194 -15.403
  859    H    ASP 113           H        ASP 113  33.729 -33.688 -21.190
  860    HA   ASP 113           HA       ASP 113  33.125 -36.374 -20.755
  861    HB2  ASP 113           2HB      ASP 113  31.604 -34.580 -20.133
  862    HB3  ASP 113           3HB      ASP 113  31.381 -34.143 -21.834
  863    H    LYS 114           H        LYS 114  33.308 -38.035 -21.945
  864    HA   LYS 114           HA       LYS 114  33.788 -39.363 -23.741
  865    HB2  LYS 114           2HB      LYS 114  31.204 -39.258 -23.434
  866    HB3  LYS 114           3HB      LYS 114  31.220 -38.356 -24.960
  867    HG2  LYS 114           2HG      LYS 114  32.311 -40.230 -26.099
  868    HG3  LYS 114           3HG      LYS 114  32.500 -41.100 -24.566
  869    HD2  LYS 114           2HD      LYS 114  30.035 -41.274 -24.354
  870    HD3  LYS 114           3HD      LYS 114  29.843 -40.390 -25.889
  871    HE2  LYS 114           2HE      LYS 114  31.098 -42.166 -27.070
  872    HE3  LYS 114           3HE      LYS 114  31.309 -43.042 -25.535
  873    HZ1  LYS 114           3HZ      LYS 114  28.920 -43.305 -25.406
  874    HZ2  LYS 114           1HZ      LYS 114  28.719 -42.481 -26.827
  875    HZ3  LYS 114           2HZ      LYS 114  29.488 -43.940 -26.808
  876    H    LEU 115           H        LEU 115  35.221 -37.046 -23.885
  877    HA   LEU 115           HA       LEU 115  35.817 -37.170 -26.800
  878    HB2  LEU 115           2HB      LEU 115  34.739 -35.028 -26.322
  879    HB3  LEU 115           3HB      LEU 115  35.888 -34.711 -25.011
  880    HG   LEU 115           HG       LEU 115  37.752 -34.639 -26.640
  881   HD11  LEU 115          1HD1      LEU 115  35.580 -34.924 -28.773
  882   HD12  LEU 115          2HD1      LEU 115  37.297 -34.562 -29.073
  883   HD13  LEU 115          3HD1      LEU 115  36.833 -36.130 -28.405
  884   HD21  LEU 115          3HD2      LEU 115  35.410 -32.829 -27.350
  885   HD22  LEU 115          1HD2      LEU 115  36.589 -32.564 -26.047
  886   HD23  LEU 115          2HD2      LEU 115  37.117 -32.510 -27.743
  887    H    GLU 116           H        GLU 116  37.057 -36.484 -23.499
  888    HA   GLU 116           HA       GLU 116  39.831 -37.046 -24.208
  889    HB2  GLU 116           2HB      GLU 116  38.940 -35.658 -22.288
  890    HB3  GLU 116           3HB      GLU 116  38.420 -37.170 -21.524
  891    HG2  GLU 116           2HG      GLU 116  40.518 -36.507 -20.532
  892    HG3  GLU 116           3HG      GLU 116  40.796 -37.937 -21.523
  893    H    GLU 117           H        GLU 117  37.049 -38.956 -23.497
  894    HA   GLU 117           HA       GLU 117  38.527 -41.475 -23.960
  895    HB2  GLU 117           2HB      GLU 117  36.579 -40.962 -21.684
  896    HB3  GLU 117           3HB      GLU 117  37.110 -42.563 -22.203
  897    HG2  GLU 117           2HG      GLU 117  38.890 -40.392 -21.011
  898    HG3  GLU 117           3HG      GLU 117  38.263 -41.829 -20.209
  899    H    TRP 118           H        TRP 118  36.684 -43.216 -24.347
  900    HA   TRP 118           HA       TRP 118  34.413 -42.005 -25.864
  901    HB2  TRP 118           2HB      TRP 118  36.403 -44.034 -26.981
  902    HB3  TRP 118           3HB      TRP 118  34.965 -43.383 -27.781
  903    HD1  TRP 118           HD1      TRP 118  35.050 -41.013 -28.692
  904    HE1  TRP 118           HE1      TRP 118  36.957 -39.330 -29.260
  905    HE3  TRP 118           HE3      TRP 118  38.888 -43.284 -26.179
  906    HZ2  TRP 118           HZ2      TRP 118  39.745 -39.037 -28.636
  907    HZ3  TRP 118           HZ3      TRP 118  41.113 -42.314 -26.151
  908    HH2  TRP 118           HH2      TRP 118  41.600 -40.187 -27.352
  909    H    ILE 119           H        ILE 119  34.135 -43.017 -23.399
  910    HA   ILE 119           HA       ILE 119  32.489 -45.487 -23.803
  911    HB   ILE 119           HB       ILE 119  33.234 -46.234 -21.547
  912   HG12  ILE 119          2HG1      ILE 119  35.394 -44.129 -21.687
  913   HG13  ILE 119          3HG1      ILE 119  33.909 -43.976 -20.730
  914   HG21  ILE 119          1HG2      ILE 119  35.514 -45.875 -23.550
  915   HG22  ILE 119          2HG2      ILE 119  35.483 -47.058 -22.239
  916   HG23  ILE 119          3HG2      ILE 119  34.314 -47.183 -23.553
  917   HD11  ILE 119          3HD1      ILE 119  34.515 -45.998 -19.435
  918   HD12  ILE 119          1HD1      ILE 119  36.016 -46.153 -20.373
  919   HD13  ILE 119          2HD1      ILE 119  35.776 -44.753 -19.324
  920    H    GLU 120           H        GLU 120  31.025 -45.797 -21.891
  921    HA   GLU 120           HA       GLU 120  29.430 -43.370 -21.503
  922    HB2  GLU 120           2HB      GLU 120  29.134 -46.210 -20.447
  923    HB3  GLU 120           3HB      GLU 120  27.908 -44.937 -20.355
  924    HG2  GLU 120           2HG      GLU 120  28.973 -46.204 -22.912
  925    HG3  GLU 120           3HG      GLU 120  27.419 -46.534 -22.148
  926    H    MET 121           H        MET 121  28.474 -43.726 -18.886
  927    HA   MET 121           HA       MET 121  30.446 -42.688 -17.124
  928    HB2  MET 121           2HB      MET 121  27.894 -44.237 -16.529
  929    HB3  MET 121           3HB      MET 121  28.845 -43.341 -15.327
  930    HG2  MET 121           2HG      MET 121  28.480 -41.253 -16.607
  931    HG3  MET 121           3HG      MET 121  27.494 -42.148 -17.775
  932    HE1  MET 121           3HE      MET 121  26.534 -39.477 -16.321
  933    HE2  MET 121           1HE      MET 121  25.545 -40.376 -17.497
  934    HE3  MET 121           2HE      MET 121  24.852 -39.902 -15.928
  935    H    SER 122           H        SER 122  30.080 -45.892 -18.244
  936    HA   SER 122           HA       SER 122  32.310 -46.802 -16.517
  937    HB2  SER 122           2HB      SER 122  29.857 -48.465 -17.203
  938    HB3  SER 122           3HB      SER 122  31.260 -48.986 -16.247
  939    HG   SER 122           HG       SER 122  29.474 -48.354 -14.923
  940    H    ASN 123           H        ASN 123  33.400 -48.692 -17.591
  941    HA   ASN 123           HA       ASN 123  33.760 -48.333 -20.446
  942    HB2  ASN 123           2HB      ASN 123  35.621 -48.911 -18.901
  943    HB3  ASN 123           3HB      ASN 123  34.836 -50.467 -18.569
  944   HD21  ASN 123          2HD2      ASN 123  36.650 -51.666 -19.401
  945   HD22  ASN 123          1HD2      ASN 123  36.980 -51.716 -21.117
  946    H    ARG 124           H        ARG 124  31.246 -48.718 -20.535
  947    HA   ARG 124           HA       ARG 124  30.222 -51.365 -20.774
  948    HB2  ARG 124           2HB      ARG 124  28.961 -49.157 -20.738
  949    HB3  ARG 124           3HB      ARG 124  29.467 -48.913 -22.423
  950    HG2  ARG 124           2HG      ARG 124  28.297 -50.992 -23.076
  951    HG3  ARG 124           3HG      ARG 124  27.819 -51.266 -21.391
  952    HD2  ARG 124           2HD      ARG 124  27.002 -48.867 -23.088
  953    HD3  ARG 124           3HD      ARG 124  25.992 -50.287 -22.800
  954    HE   ARG 124           HE       ARG 124  26.542 -48.069 -20.997
  955   HH11  ARG 124          1HH2      ARG 124  25.362 -51.414 -21.167
  956   HH12  ARG 124          2HH2      ARG 124  24.494 -51.326 -19.670
  957   HH21  ARG 124          1HH1      ARG 124  25.388 -47.976 -19.011
  958   HH22  ARG 124          2HH1      ARG 124  24.516 -49.359 -18.437
  959    H    LYS 125           H        LYS 125  30.190 -52.840 -22.447
  960    HA   LYS 125           HA       LYS 125  32.270 -52.866 -24.389
  961    HB2  LYS 125           2HB      LYS 125  29.617 -54.367 -24.291
  962    HB3  LYS 125           3HB      LYS 125  30.933 -54.725 -25.424
  963    HG2  LYS 125           2HG      LYS 125  32.447 -55.202 -23.494
  964    HG3  LYS 125           3HG      LYS 125  31.089 -54.918 -22.381
  965    HD2  LYS 125           2HD      LYS 125  29.822 -56.746 -23.502
  966    HD3  LYS 125           3HD      LYS 125  31.218 -57.061 -24.549
  967    HE2  LYS 125           2HE      LYS 125  31.252 -57.231 -21.505
  968    HE3  LYS 125           3HE      LYS 125  30.989 -58.621 -22.577
  969    HZ1  LYS 125           3HZ      LYS 125  33.175 -58.243 -23.509
  970    HZ2  LYS 125           1HZ      LYS 125  33.422 -56.953 -22.513
  971    HZ3  LYS 125           2HZ      LYS 125  33.281 -58.468 -21.880
  972    H    ASP 126           H        ASP 126  32.078 -52.849 -26.707
  973    HA   ASP 126           HA       ASP 126  29.741 -51.428 -27.882
  974    HB2  ASP 126           2HB      ASP 126  31.430 -49.686 -27.548
  975    HB3  ASP 126           3HB      ASP 126  32.658 -50.706 -28.311
  976    H    LEU 127           H        LEU 127  32.848 -53.147 -28.587
  977    HA   LEU 127           HA       LEU 127  31.876 -54.360 -31.004
  978    HB2  LEU 127           2HB      LEU 127  34.248 -54.178 -30.511
  979    HB3  LEU 127           3HB      LEU 127  34.065 -55.173 -29.053
  980    HG   LEU 127           HG       LEU 127  33.414 -57.117 -30.462
  981   HD11  LEU 127          1HD1      LEU 127  34.109 -55.308 -32.824
  982   HD12  LEU 127          2HD1      LEU 127  33.759 -57.047 -32.913
  983   HD13  LEU 127          3HD1      LEU 127  32.487 -55.917 -32.434
  984   HD21  LEU 127          3HD2      LEU 127  36.049 -55.812 -31.251
  985   HD22  LEU 127          1HD2      LEU 127  35.758 -56.816 -29.814
  986   HD23  LEU 127          2HD2      LEU 127  35.653 -57.536 -31.433
  987    H    ILE 128           H        ILE 128  30.383 -55.932 -31.172
  988    HA   ILE 128           HA       ILE 128  30.128 -58.148 -29.271
  989    HB   ILE 128           HB       ILE 128  28.748 -56.342 -28.234
  990   HG12  ILE 128          2HG1      ILE 128  26.627 -57.450 -28.013
  991   HG13  ILE 128          3HG1      ILE 128  27.000 -58.509 -29.381
  992   HG21  ILE 128          1HG2      ILE 128  27.168 -56.377 -30.849
  993   HG22  ILE 128          2HG2      ILE 128  26.694 -55.525 -29.367
  994   HG23  ILE 128          3HG2      ILE 128  28.149 -55.030 -30.240
  995   HD11  ILE 128          3HD1      ILE 128  28.921 -59.459 -28.101
  996   HD12  ILE 128          1HD1      ILE 128  28.539 -58.381 -26.740
  997   HD13  ILE 128          2HD1      ILE 128  27.399 -59.656 -27.225
  998    H    LYS 129           H        LYS 129  28.875 -59.871 -30.146
  999    HA   LYS 129           HA       LYS 129  27.868 -59.623 -32.902
 1000    HB2  LYS 129           2HB      LYS 129  30.302 -60.339 -32.975
 1001    HB3  LYS 129           3HB      LYS 129  29.833 -61.791 -32.065
 1002    HG2  LYS 129           2HG      LYS 129  28.327 -62.470 -33.896
 1003    HG3  LYS 129           3HG      LYS 129  28.712 -60.982 -34.788
 1004    HD2  LYS 129           2HD      LYS 129  31.086 -61.685 -34.940
 1005    HD3  LYS 129           3HD      LYS 129  30.701 -63.173 -34.039
 1006    HE2  LYS 129           2HE      LYS 129  29.109 -63.836 -35.817
 1007    HE3  LYS 129           3HE      LYS 129  29.493 -62.353 -36.717
 1008    HZ1  LYS 129           3HZ      LYS 129  31.761 -63.137 -36.918
 1009    HZ2  LYS 129           1HZ      LYS 129  31.404 -64.514 -36.084
 1010    HZ3  LYS 129           2HZ      LYS 129  30.723 -64.242 -37.559
 1011    H    LYS 130           H        LYS 130  26.153 -61.104 -33.237
 1012    HA   LYS 130           HA       LYS 130  24.747 -62.074 -30.950
 1013    HB2  LYS 130           2HB      LYS 130  24.508 -62.520 -33.936
 1014    HB3  LYS 130           3HB      LYS 130  23.546 -63.472 -32.800
 1015    HG2  LYS 130           2HG      LYS 130  22.207 -61.641 -33.588
 1016    HG3  LYS 130           3HG      LYS 130  22.559 -61.411 -31.866
 1017    HD2  LYS 130           2HD      LYS 130  24.266 -59.732 -32.416
 1018    HD3  LYS 130           3HD      LYS 130  24.007 -59.996 -34.151
 1019    HE2  LYS 130           2HE      LYS 130  21.880 -59.007 -32.204
 1020    HE3  LYS 130           3HE      LYS 130  22.900 -57.937 -33.185
 1021    HZ1  LYS 130           3HZ      LYS 130  21.962 -58.947 -35.158
 1022    HZ2  LYS 130           1HZ      LYS 130  21.017 -59.942 -34.250
 1023    HZ3  LYS 130           2HZ      LYS 130  20.762 -58.313 -34.223
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1  11.052 -29.858  -7.090
    2    H2   MET   1           H2       MET   1  11.966 -28.582  -7.580
    3    H3   MET   1           H3       MET   1  11.061 -29.538  -8.701
    4    HA   MET   1           HA       MET   1  10.373 -27.210  -7.416
    5    HB2  MET   1           2HB      MET   1   8.423 -27.311  -8.772
    6    HB3  MET   1           3HB      MET   1   9.809 -27.861  -9.738
    7    HG2  MET   1           2HG      MET   1   9.102 -30.202  -9.428
    8    HG3  MET   1           3HG      MET   1   7.721 -29.658  -8.449
    9    HE1  MET   1           3HE      MET   1   7.427 -31.666 -10.902
   10    HE2  MET   1           1HE      MET   1   6.056 -31.090  -9.925
   11    HE3  MET   1           2HE      MET   1   5.978 -31.011 -11.701
   12    H    ALA   2           H        ALA   2   8.631 -26.647  -6.193
   13    HA   ALA   2           HA       ALA   2   7.272 -28.782  -4.610
   14    HB1  ALA   2           1HB      ALA   2   8.562 -26.260  -3.483
   15    HB2  ALA   2           2HB      ALA   2   7.612 -27.449  -2.561
   16    HB3  ALA   2           3HB      ALA   2   9.171 -27.921  -3.277
   17    H    ALA   3           H        ALA   3   7.077 -25.870  -6.390
   18    HA   ALA   3           HA       ALA   3   4.113 -25.778  -6.029
   19    HB1  ALA   3           1HB      ALA   3   5.996 -23.383  -5.872
   20    HB2  ALA   3           2HB      ALA   3   4.219 -23.306  -5.929
   21    HB3  ALA   3           3HB      ALA   3   5.032 -24.037  -4.527
   22    H    LYS   4           H        LYS   4   3.457 -23.900  -7.807
   23    HA   LYS   4           HA       LYS   4   3.939 -25.034 -10.372
   24    HB2  LYS   4           2HB      LYS   4   3.089 -22.211  -9.638
   25    HB3  LYS   4           3HB      LYS   4   2.958 -22.946 -11.252
   26    HG2  LYS   4           2HG      LYS   4   1.370 -24.612 -10.402
   27    HG3  LYS   4           3HG      LYS   4   1.549 -23.975  -8.751
   28    HD2  LYS   4           2HD      LYS   4   0.666 -21.759  -9.564
   29    HD3  LYS   4           3HD      LYS   4   0.366 -22.505 -11.153
   30    HE2  LYS   4           2HE      LYS   4  -1.171 -24.101 -10.191
   31    HE3  LYS   4           3HE      LYS   4  -0.753 -23.584  -8.541
   32    HZ1  LYS   4           3HZ      LYS   4  -1.740 -21.453  -9.031
   33    HZ2  LYS   4           1HZ      LYS   4  -2.126 -21.929 -10.567
   34    HZ3  LYS   4           2HZ      LYS   4  -2.838 -22.650  -9.263
   35    H    PHE   5           H        PHE   5   5.699 -22.635  -8.592
   36    HA   PHE   5           HA       PHE   5   7.957 -22.525 -10.419
   37    HB2  PHE   5           2HB      PHE   5   7.786 -20.226 -11.055
   38    HB3  PHE   5           3HB      PHE   5   6.266 -21.042 -11.467
   39    HD1  PHE   5           HD2      PHE   5   4.855 -20.760  -8.692
   40    HD2  PHE   5           HD1      PHE   5   7.074 -18.049 -11.198
   41    HE1  PHE   5           HE2      PHE   5   3.625 -18.841  -7.704
   42    HE2  PHE   5           HE1      PHE   5   5.860 -16.125 -10.192
   43    HZ   PHE   5           HZ       PHE   5   4.144 -16.519  -8.425
   44    H    GLU   6           H        GLU   6   9.623 -20.992  -9.487
   45    HA   GLU   6           HA       GLU   6   9.439 -20.645  -6.546
   46    HB2  GLU   6           2HB      GLU   6  11.436 -22.373  -8.028
   47    HB3  GLU   6           3HB      GLU   6  11.715 -21.740  -6.392
   48    HG2  GLU   6           2HG      GLU   6  10.919 -23.866  -5.876
   49    HG3  GLU   6           3HG      GLU   6   9.475 -22.834  -5.842
   50    H    VAL   7           H        VAL   7  11.468 -19.552  -5.745
   51    HA   VAL   7           HA       VAL   7  12.073 -17.116  -7.005
   52    HB   VAL   7           HB       VAL   7  14.001 -17.002  -5.456
   53   HG11  VAL   7          1HG1      VAL   7  11.513 -18.257  -4.198
   54   HG12  VAL   7          2HG1      VAL   7  12.737 -17.297  -3.338
   55   HG13  VAL   7          3HG1      VAL   7  11.726 -16.535  -4.588
   56   HG21  VAL   7          3HG2      VAL   7  13.426 -19.883  -4.738
   57   HG22  VAL   7          1HG2      VAL   7  14.871 -19.266  -5.571
   58   HG23  VAL   7          2HG2      VAL   7  14.539 -18.782  -3.894
   59    H    GLY   8           H        GLY   8  13.328 -16.289  -8.380
   60    HA2  GLY   8           2HA      GLY   8  15.109 -16.109  -9.862
   61    HA3  GLY   8           3HA      GLY   8  15.538 -17.807  -9.558
   62    H    SER   9           H        SER   9  12.424 -18.358 -10.168
   63    HA   SER   9           HA       SER   9  12.675 -18.891 -12.971
   64    HB2  SER   9           2HB      SER   9  10.086 -18.482 -11.450
   65    HB3  SER   9           3HB      SER   9  10.362 -19.462 -12.908
   66    HG   SER   9           HG       SER   9  10.252 -20.737 -10.987
   67    H    VAL  10           H        VAL  10  11.479 -17.907 -14.728
   68    HA   VAL  10           HA       VAL  10  10.562 -15.096 -14.281
   69    HB   VAL  10           HB       VAL  10  12.061 -16.149 -16.714
   70   HG11  VAL  10          1HG1      VAL  10  11.162 -13.326 -15.957
   71   HG12  VAL  10          2HG1      VAL  10  12.116 -13.759 -17.394
   72   HG13  VAL  10          3HG1      VAL  10  10.442 -14.335 -17.233
   73   HG21  VAL  10          3HG2      VAL  10  13.037 -14.257 -14.541
   74   HG22  VAL  10          1HG2      VAL  10  13.611 -15.917 -14.822
   75   HG23  VAL  10          2HG2      VAL  10  13.905 -14.659 -16.041
   76    H    TYR  11           H        TYR  11   8.591 -14.782 -14.859
   77    HA   TYR  11           HA       TYR  11   7.113 -16.645 -16.673
   78    HB2  TYR  11           2HB      TYR  11   6.698 -16.092 -13.771
   79    HB3  TYR  11           3HB      TYR  11   5.244 -16.242 -14.776
   80    HD1  TYR  11           HD1      TYR  11   8.253 -18.043 -13.505
   81    HD2  TYR  11           HD2      TYR  11   4.541 -18.370 -15.681
   82    HE1  TYR  11           HE1      TYR  11   8.463 -20.525 -13.482
   83    HE2  TYR  11           HE2      TYR  11   4.725 -20.854 -15.637
   84    HH   TYR  11           HH       TYR  11   7.540 -22.514 -14.108
   85    H    THR  12           H        THR  12   4.770 -15.648 -16.914
   86    HA   THR  12           HA       THR  12   4.983 -12.678 -17.256
   87    HB   THR  12           HB       THR  12   3.706 -14.621 -19.204
   88    HG1  THR  12           1HG      THR  12   5.561 -14.200 -20.496
   89   HG21  THR  12          1HG2      THR  12   4.523 -11.692 -19.481
   90   HG22  THR  12          2HG2      THR  12   3.802 -12.693 -20.762
   91   HG23  THR  12          3HG2      THR  12   2.860 -12.290 -19.311
   92    H    GLY  13           H        GLY  13   3.141 -11.533 -16.879
   93    HA2  GLY  13           2HA      GLY  13   0.690 -12.861 -15.964
   94    HA3  GLY  13           3HA      GLY  13   1.656 -12.073 -14.697
   95    H    LYS  14           H        LYS  14  -0.570 -10.936 -14.694
   96    HA   LYS  14           HA       LYS  14  -0.563  -8.575 -16.555
   97    HB2  LYS  14           2HB      LYS  14  -2.183 -10.564 -16.980
   98    HB3  LYS  14           3HB      LYS  14  -3.038  -9.956 -15.548
   99    HG2  LYS  14           2HG      LYS  14  -2.425  -8.297 -18.003
  100    HG3  LYS  14           3HG      LYS  14  -3.924  -9.227 -17.801
  101    HD2  LYS  14           2HD      LYS  14  -3.013  -6.866 -16.112
  102    HD3  LYS  14           3HD      LYS  14  -4.319  -6.861 -17.315
  103    HE2  LYS  14           2HE      LYS  14  -5.544  -8.555 -15.952
  104    HE3  LYS  14           3HE      LYS  14  -4.256  -8.467 -14.726
  105    HZ1  LYS  14           3HZ      LYS  14  -4.795  -6.149 -14.412
  106    HZ2  LYS  14           1HZ      LYS  14  -5.992  -6.228 -15.547
  107    HZ3  LYS  14           2HZ      LYS  14  -6.130  -7.085 -14.145
  108    H    VAL  15           H        VAL  15  -0.528  -6.709 -15.532
  109    HA   VAL  15           HA       VAL  15  -0.254  -6.613 -12.667
  110    HB   VAL  15           HB       VAL  15  -0.738  -4.260 -14.525
  111   HG11  VAL  15          1HG1      VAL  15   0.911  -4.586 -11.970
  112   HG12  VAL  15          2HG1      VAL  15   0.753  -3.089 -12.916
  113   HG13  VAL  15          3HG1      VAL  15  -0.664  -3.768 -12.087
  114   HG21  VAL  15          3HG2      VAL  15   1.911  -5.658 -14.044
  115   HG22  VAL  15          1HG2      VAL  15   1.012  -5.607 -15.575
  116   HG23  VAL  15          2HG2      VAL  15   1.681  -4.114 -14.896
  117    H    THR  16           H        THR  16  -1.639  -6.345 -11.136
  118    HA   THR  16           HA       THR  16  -4.535  -5.927 -11.800
  119    HB   THR  16           HB       THR  16  -4.680  -7.316  -9.547
  120    HG1  THR  16           1HG      THR  16  -2.961  -8.842  -9.457
  121   HG21  THR  16          1HG2      THR  16  -3.898  -8.587 -12.210
  122   HG22  THR  16          2HG2      THR  16  -4.753  -9.400 -10.878
  123   HG23  THR  16          3HG2      THR  16  -5.537  -8.068 -11.747
  124    H    GLY  17           H        GLY  17  -1.929  -4.505  -9.998
  125    HA2  GLY  17           2HA      GLY  17  -3.629  -2.270  -9.490
  126    HA3  GLY  17           3HA      GLY  17  -3.387  -3.182  -7.982
  127    H    LEU  18           H        LEU  18  -2.503  -0.617  -8.182
  128    HA   LEU  18           HA       LEU  18   0.460  -0.939  -8.008
  129    HB2  LEU  18           2HB      LEU  18  -1.078   1.472  -8.954
  130    HB3  LEU  18           3HB      LEU  18   0.671   1.449  -8.643
  131    HG   LEU  18           HG       LEU  18  -0.780  -0.099 -10.839
  132   HD11  LEU  18          1HD1      LEU  18   1.145   2.268 -10.969
  133   HD12  LEU  18          2HD1      LEU  18   0.464   1.409 -12.369
  134   HD13  LEU  18          3HD1      LEU  18  -0.604   2.334 -11.289
  135   HD21  LEU  18          3HD2      LEU  18   2.186   0.049 -10.270
  136   HD22  LEU  18          1HD2      LEU  18   1.135  -1.371 -10.059
  137   HD23  LEU  18          2HD2      LEU  18   1.419  -0.715 -11.683
  138    H    GLN  19           H        GLN  19   1.357   0.222  -6.326
  139    HA   GLN  19           HA       GLN  19  -0.335   1.555  -4.287
  140    HB2  GLN  19           2HB      GLN  19   1.534  -0.750  -3.689
  141    HB3  GLN  19           3HB      GLN  19   0.597   0.198  -2.514
  142    HG2  GLN  19           2HG      GLN  19  -1.497  -0.746  -3.348
  143    HG3  GLN  19           3HG      GLN  19  -0.648  -1.627  -4.638
  144   HE21  GLN  19          2HE2      GLN  19   1.095  -3.199  -3.873
  145   HE22  GLN  19          1HE2      GLN  19   0.752  -4.100  -2.409
  146    H    ALA  20           H        ALA  20   1.131   2.764  -2.782
  147    HA   ALA  20           HA       ALA  20   3.421   3.924  -3.946
  148    HB1  ALA  20           1HB      ALA  20   2.637   3.777  -1.005
  149    HB2  ALA  20           2HB      ALA  20   3.768   4.944  -1.729
  150    HB3  ALA  20           3HB      ALA  20   2.047   4.978  -2.180
  151    H    TYR  21           H        TYR  21   3.251   0.805  -2.667
  152    HA   TYR  21           HA       TYR  21   6.218   0.686  -2.265
  153    HB2  TYR  21           2HB      TYR  21   4.548   0.459  -0.240
  154    HB3  TYR  21           3HB      TYR  21   4.283  -1.164  -0.913
  155    HD1  TYR  21           HD2      TYR  21   6.977   1.172   0.257
  156    HD2  TYR  21           HD1      TYR  21   5.793  -2.933  -0.373
  157    HE1  TYR  21           HE2      TYR  21   9.061   0.402   1.385
  158    HE2  TYR  21           HE1      TYR  21   7.872  -3.715   0.754
  159    HH   TYR  21           HH       TYR  21   9.833  -3.070   1.819
  160    H    GLY  22           H        GLY  22   3.848  -0.270  -4.474
  161    HA2  GLY  22           2HA      GLY  22   5.575  -1.730  -5.994
  162    HA3  GLY  22           3HA      GLY  22   4.920  -2.937  -4.867
  163    H    ALA  23           H        ALA  23   4.445  -3.640  -7.228
  164    HA   ALA  23           HA       ALA  23   1.670  -2.815  -8.074
  165    HB1  ALA  23           1HB      ALA  23   4.030  -3.753  -9.755
  166    HB2  ALA  23           2HB      ALA  23   2.384  -3.444 -10.350
  167    HB3  ALA  23           3HB      ALA  23   3.368  -2.104  -9.721
  168    H    PHE  24           H        PHE  24   0.217  -4.426  -7.813
  169    HA   PHE  24           HA       PHE  24   1.117  -7.158  -7.331
  170    HB2  PHE  24           2HB      PHE  24  -1.660  -5.927  -7.701
  171    HB3  PHE  24           3HB      PHE  24  -1.335  -7.657  -7.467
  172    HD1  PHE  24           HD2      PHE  24   0.396  -8.063  -5.364
  173    HD2  PHE  24           HD1      PHE  24  -2.423  -4.822  -5.830
  174    HE1  PHE  24           HE2      PHE  24   0.255  -7.828  -2.889
  175    HE2  PHE  24           HE1      PHE  24  -2.578  -4.606  -3.357
  176    HZ   PHE  24           HZ       PHE  24  -1.238  -6.102  -1.882
  177    H    VAL  25           H        VAL  25   1.125  -8.830  -8.778
  178    HA   VAL  25           HA       VAL  25   0.047  -8.409 -11.528
  179    HB   VAL  25           HB       VAL  25   2.771  -9.636 -10.923
  180   HG11  VAL  25          1HG1      VAL  25   1.382  -8.835 -13.522
  181   HG12  VAL  25          2HG1      VAL  25   3.019  -9.515 -13.390
  182   HG13  VAL  25          3HG1      VAL  25   1.610 -10.500 -12.939
  183   HG21  VAL  25          3HG2      VAL  25   2.189  -6.898 -12.098
  184   HG22  VAL  25          1HG2      VAL  25   2.912  -7.223 -10.507
  185   HG23  VAL  25          2HG2      VAL  25   3.784  -7.677 -11.984
  186    H    ALA  26           H        ALA  26  -1.496  -9.828 -11.704
  187    HA   ALA  26           HA       ALA  26  -1.544 -12.385 -10.273
  188    HB1  ALA  26           1HB      ALA  26  -3.260 -11.273 -12.528
  189    HB2  ALA  26           2HB      ALA  26  -3.598 -12.746 -11.588
  190    HB3  ALA  26           3HB      ALA  26  -3.619 -11.161 -10.788
  191    H    LEU  27           H        LEU  27  -1.436 -14.398 -11.203
  192    HA   LEU  27           HA       LEU  27   0.229 -14.624 -13.694
  193    HB2  LEU  27           2HB      LEU  27   0.691 -15.774 -10.936
  194    HB3  LEU  27           3HB      LEU  27   1.529 -16.367 -12.386
  195    HG   LEU  27           HG       LEU  27   1.645 -13.439 -11.554
  196   HD11  LEU  27          1HD1      LEU  27   3.568 -15.671 -10.783
  197   HD12  LEU  27          2HD1      LEU  27   3.818 -13.935 -10.483
  198   HD13  LEU  27          3HD1      LEU  27   2.492 -14.796  -9.668
  199   HD21  LEU  27          3HD2      LEU  27   3.470 -15.172 -13.258
  200   HD22  LEU  27          1HD2      LEU  27   2.312 -13.966 -13.858
  201   HD23  LEU  27          2HD2      LEU  27   3.707 -13.449 -12.892
  202    H    ASP  28           H        ASP  28  -2.051 -16.017 -11.451
  203    HA   ASP  28           HA       ASP  28  -3.250 -17.652 -13.595
  204    HB2  ASP  28           2HB      ASP  28  -1.564 -19.072 -12.361
  205    HB3  ASP  28           3HB      ASP  28  -2.556 -18.854 -10.903
  206    H    GLU  29           H        GLU  29  -5.399 -18.491 -12.651
  207    HA   GLU  29           HA       GLU  29  -7.006 -16.433 -11.492
  208    HB2  GLU  29           2HB      GLU  29  -7.327 -19.432 -11.765
  209    HB3  GLU  29           3HB      GLU  29  -8.617 -18.348 -11.201
  210    HG2  GLU  29           2HG      GLU  29  -7.246 -18.162 -13.920
  211    HG3  GLU  29           3HG      GLU  29  -8.804 -18.953 -13.600
  212    H    GLU  30           H        GLU  30  -4.792 -18.464  -9.965
  213    HA   GLU  30           HA       GLU  30  -5.759 -17.825  -7.224
  214    HB2  GLU  30           2HB      GLU  30  -5.404 -20.220  -6.602
  215    HB3  GLU  30           3HB      GLU  30  -6.785 -19.953  -7.689
  216    HG2  GLU  30           2HG      GLU  30  -5.668 -20.828  -9.543
  217    HG3  GLU  30           3HG      GLU  30  -4.061 -20.717  -8.792
  218    H    THR  31           H        THR  31  -3.378 -17.172  -9.171
  219    HA   THR  31           HA       THR  31  -1.318 -17.344  -7.025
  220    HB   THR  31           HB       THR  31  -0.723 -18.144  -9.889
  221    HG1  THR  31           1HG      THR  31  -0.647 -20.294  -9.052
  222   HG21  THR  31          1HG2      THR  31   0.840 -18.577  -7.302
  223   HG22  THR  31          2HG2      THR  31   1.335 -19.131  -8.920
  224   HG23  THR  31          3HG2      THR  31   1.237 -17.391  -8.567
  225    H    GLN  32           H        GLN  32  -0.103 -15.576  -6.915
  226    HA   GLN  32           HA       GLN  32  -0.140 -13.382  -8.876
  227    HB2  GLN  32           2HB      GLN  32  -2.379 -13.339  -7.887
  228    HB3  GLN  32           3HB      GLN  32  -1.662 -13.306  -6.262
  229    HG2  GLN  32           2HG      GLN  32  -0.786 -11.089  -8.000
  230    HG3  GLN  32           3HG      GLN  32  -2.533 -11.094  -7.699
  231   HE21  GLN  32          2HE2      GLN  32  -2.885  -9.500  -6.202
  232   HE22  GLN  32          1HE2      GLN  32  -2.012  -9.343  -4.694
  233    H    GLY  33           H        GLY  33   1.362 -11.712  -8.159
  234    HA2  GLY  33           2HA      GLY  33   2.637 -12.028  -5.514
  235    HA3  GLY  33           3HA      GLY  33   3.689 -12.134  -6.942
  236    H    LEU  34           H        LEU  34   4.535 -10.252  -5.586
  237    HA   LEU  34           HA       LEU  34   3.242  -7.641  -6.294
  238    HB2  LEU  34           2HB      LEU  34   2.672  -8.177  -4.043
  239    HB3  LEU  34           3HB      LEU  34   4.346  -8.621  -3.643
  240    HG   LEU  34           HG       LEU  34   5.053  -6.278  -3.911
  241   HD11  LEU  34          1HD1      LEU  34   2.096  -5.658  -4.353
  242   HD12  LEU  34          2HD1      LEU  34   3.391  -4.457  -4.142
  243   HD13  LEU  34          3HD1      LEU  34   3.382  -5.508  -5.572
  244   HD21  LEU  34          3HD2      LEU  34   2.659  -6.619  -2.064
  245   HD22  LEU  34          1HD2      LEU  34   4.346  -7.052  -1.702
  246   HD23  LEU  34          2HD2      LEU  34   3.897  -5.348  -1.926
  247    H    VAL  35           H        VAL  35   4.639  -6.973  -7.864
  248    HA   VAL  35           HA       VAL  35   7.515  -7.056  -7.631
  249    HB   VAL  35           HB       VAL  35   5.748  -5.060  -9.109
  250   HG11  VAL  35          1HG1      VAL  35   8.677  -5.847  -9.477
  251   HG12  VAL  35          2HG1      VAL  35   7.772  -4.712 -10.504
  252   HG13  VAL  35          3HG1      VAL  35   8.096  -4.307  -8.805
  253   HG21  VAL  35          3HG2      VAL  35   6.983  -7.625 -10.156
  254   HG22  VAL  35          1HG2      VAL  35   5.250  -7.322  -9.890
  255   HG23  VAL  35          2HG2      VAL  35   6.133  -6.397 -11.121
  256    H    HIS  36           H        HIS  36   8.593  -6.033  -5.935
  257    HA   HIS  36           HA       HIS  36   7.256  -3.974  -4.361
  258    HB2  HIS  36           2HB      HIS  36  10.068  -5.170  -4.337
  259    HB3  HIS  36           3HB      HIS  36   9.525  -3.885  -3.235
  260    HD1  HIS  36           HD1      HIS  36   7.513  -7.107  -4.137
  261    HD2  HIS  36           HD2      HIS  36   9.403  -5.139  -0.894
  262    HE1  HIS  36           HE1      HIS  36   6.925  -8.384  -2.109
  263    H    ILE  37           H        ILE  37   7.786  -1.757  -4.313
  264    HA   ILE  37           HA       ILE  37   8.224  -0.550  -6.891
  265    HB   ILE  37           HB       ILE  37   6.960   0.501  -5.001
  266   HG12  ILE  37          2HG1      ILE  37   9.176   2.215  -6.045
  267   HG13  ILE  37          3HG1      ILE  37   7.766   1.670  -6.982
  268   HG21  ILE  37          1HG2      ILE  37   9.736   1.028  -3.824
  269   HG22  ILE  37          2HG2      ILE  37   8.215   1.728  -3.233
  270   HG23  ILE  37          3HG2      ILE  37   8.489  -0.020  -3.109
  271   HD11  ILE  37          3HD1      ILE  37   6.257   2.844  -5.401
  272   HD12  ILE  37          1HD1      ILE  37   7.665   3.394  -4.464
  273   HD13  ILE  37          2HD1      ILE  37   7.427   3.971  -6.127
  274    H    SER  38           H        SER  38  10.646  -1.149  -4.470
  275    HA   SER  38           HA       SER  38  12.787   0.197  -5.826
  276    HB2  SER  38           2HB      SER  38  13.034  -2.249  -4.059
  277    HB3  SER  38           3HB      SER  38  14.166  -0.888  -4.239
  278    HG   SER  38           HG       SER  38  12.911  -0.753  -2.290
  279    H    GLU  39           H        GLU  39  11.082  -2.424  -6.924
  280    HA   GLU  39           HA       GLU  39  13.382  -3.617  -8.428
  281    HB2  GLU  39           2HB      GLU  39  10.834  -4.943  -7.462
  282    HB3  GLU  39           3HB      GLU  39  12.165  -5.717  -8.341
  283    HG2  GLU  39           2HG      GLU  39  12.374  -4.518  -5.541
  284    HG3  GLU  39           3HG      GLU  39  12.154  -6.234  -5.929
  285    H    VAL  40           H        VAL  40  10.794  -1.578  -8.842
  286    HA   VAL  40           HA       VAL  40   9.568  -2.799 -11.184
  287    HB   VAL  40           HB       VAL  40   9.474  -0.010  -9.989
  288   HG11  VAL  40          1HG1      VAL  40   7.711  -1.199 -12.177
  289   HG12  VAL  40          2HG1      VAL  40   7.462   0.375 -11.384
  290   HG13  VAL  40          3HG1      VAL  40   8.896   0.106 -12.398
  291   HG21  VAL  40          3HG2      VAL  40   7.466  -2.305  -9.949
  292   HG22  VAL  40          1HG2      VAL  40   8.450  -1.750  -8.578
  293   HG23  VAL  40          2HG2      VAL  40   7.200  -0.689  -9.259
  294    H    THR  41           H        THR  41  12.219  -0.451 -10.752
  295    HA   THR  41           HA       THR  41  13.134  -0.981 -13.511
  296    HB   THR  41           HB       THR  41  12.193   1.743 -12.564
  297    HG1  THR  41           1HG      THR  41  10.832   1.541 -14.430
  298   HG21  THR  41          1HG2      THR  41  13.529   1.026 -15.215
  299   HG22  THR  41          2HG2      THR  41  12.830   2.607 -14.800
  300   HG23  THR  41          3HG2      THR  41  14.253   2.012 -13.922
  301    H    HIS  42           H        HIS  42  15.291  -0.338 -13.790
  302    HA   HIS  42           HA       HIS  42  16.896  -0.370 -11.336
  303    HB2  HIS  42           2HB      HIS  42  17.305  -1.694 -13.538
  304    HB3  HIS  42           3HB      HIS  42  17.939  -0.168 -14.189
  305    HD1  HIS  42           HD1      HIS  42  20.012   0.881 -12.496
  306    HD2  HIS  42           HD2      HIS  42  19.138  -3.258 -12.393
  307    HE1  HIS  42           HE1      HIS  42  21.993  -0.222 -11.491
  308    H    GLY  43           H        GLY  43  15.606   1.803 -10.953
  309    HA2  GLY  43           2HA      GLY  43  17.594   3.899 -10.873
  310    HA3  GLY  43           3HA      GLY  43  16.303   4.263 -12.041
  311    H    PHE  44           H        PHE  44  16.357   6.029 -10.076
  312    HA   PHE  44           HA       PHE  44  14.802   5.310  -7.756
  313    HB2  PHE  44           2HB      PHE  44  16.308   7.293  -7.806
  314    HB3  PHE  44           3HB      PHE  44  15.264   8.045  -9.031
  315    HD1  PHE  44           HD2      PHE  44  14.802   6.381  -5.668
  316    HD2  PHE  44           HD1      PHE  44  13.926   9.735  -8.240
  317    HE1  PHE  44           HE2      PHE  44  13.399   7.391  -3.876
  318    HE2  PHE  44           HE1      PHE  44  12.543  10.755  -6.436
  319    HZ   PHE  44           HZ       PHE  44  12.263   9.574  -4.259
  320    H    VAL  45           H        VAL  45  12.942   4.312  -8.157
  321    HA   VAL  45           HA       VAL  45  10.955   5.242 -10.060
  322    HB   VAL  45           HB       VAL  45  10.748   3.293  -7.731
  323   HG11  VAL  45          1HG1      VAL  45   8.965   3.607 -10.194
  324   HG12  VAL  45          2HG1      VAL  45   8.814   2.335  -8.961
  325   HG13  VAL  45          3HG1      VAL  45   8.511   4.032  -8.529
  326   HG21  VAL  45          3HG2      VAL  45  11.272   2.794 -10.701
  327   HG22  VAL  45          1HG2      VAL  45  12.448   2.583  -9.384
  328   HG23  VAL  45          2HG2      VAL  45  11.023   1.532  -9.473
  329    H    LYS  46           H        LYS  46  11.130   7.493  -9.435
  330    HA   LYS  46           HA       LYS  46  10.312   8.535  -6.938
  331    HB2  LYS  46           2HB      LYS  46   9.921  10.623  -8.077
  332    HB3  LYS  46           3HB      LYS  46  11.415   9.863  -8.667
  333    HG2  LYS  46           2HG      LYS  46  10.241   9.118 -10.713
  334    HG3  LYS  46           3HG      LYS  46   8.734   9.856 -10.123
  335    HD2  LYS  46           2HD      LYS  46   9.820  12.087 -10.138
  336    HD3  LYS  46           3HD      LYS  46  11.327  11.348 -10.734
  337    HE2  LYS  46           2HE      LYS  46  10.140  10.555 -12.753
  338    HE3  LYS  46           3HE      LYS  46   8.632  11.289 -12.158
  339    HZ1  LYS  46           3HZ      LYS  46   9.703  13.434 -12.285
  340    HZ2  LYS  46           1HZ      LYS  46  11.102  12.754 -12.837
  341    HZ3  LYS  46           2HZ      LYS  46   9.734  12.694 -13.759
  342    H    ASP  47           H        ASP  47   8.243   7.477  -9.573
  343    HA   ASP  47           HA       ASP  47   6.111   7.077  -7.589
  344    HB2  ASP  47           2HB      ASP  47   5.583   9.312  -8.468
  345    HB3  ASP  47           3HB      ASP  47   5.652   8.693 -10.133
  346    H    ILE  48           H        ILE  48   5.030   5.184  -8.107
  347    HA   ILE  48           HA       ILE  48   6.315   3.407 -10.057
  348    HB   ILE  48           HB       ILE  48   5.432   2.752  -7.789
  349   HG12  ILE  48          2HG1      ILE  48   4.253   1.213 -10.068
  350   HG13  ILE  48          3HG1      ILE  48   5.964   1.208  -9.587
  351   HG21  ILE  48          1HG2      ILE  48   2.695   3.065  -9.121
  352   HG22  ILE  48          2HG2      ILE  48   2.994   2.310  -7.543
  353   HG23  ILE  48          3HG2      ILE  48   3.306   4.040  -7.765
  354   HD11  ILE  48          3HD1      ILE  48   5.337   0.341  -7.349
  355   HD12  ILE  48          1HD1      ILE  48   3.625   0.340  -7.830
  356   HD13  ILE  48          2HD1      ILE  48   4.772  -0.744  -8.639
  357    H    ASN  49           H        ASN  49   3.340   5.299 -10.365
  358    HA   ASN  49           HA       ASN  49   2.569   3.825 -12.721
  359    HB2  ASN  49           2HB      ASN  49   0.717   5.053 -12.598
  360    HB3  ASN  49           3HB      ASN  49   1.364   5.792 -11.117
  361   HD21  ASN  49          2HD2      ASN  49   2.815   7.766 -11.480
  362   HD22  ASN  49          1HD2      ASN  49   2.344   8.864 -12.777
  363    H    GLU  50           H        GLU  50   5.015   6.225 -12.280
  364    HA   GLU  50           HA       GLU  50   5.194   6.846 -15.145
  365    HB2  GLU  50           2HB      GLU  50   7.133   7.338 -12.868
  366    HB3  GLU  50           3HB      GLU  50   7.218   8.041 -14.496
  367    HG2  GLU  50           2HG      GLU  50   5.088   8.587 -12.382
  368    HG3  GLU  50           3HG      GLU  50   6.400   9.659 -12.915
  369    H    HIS  51           H        HIS  51   5.858   4.050 -13.485
  370    HA   HIS  51           HA       HIS  51   8.174   3.284 -15.233
  371    HB2  HIS  51           2HB      HIS  51   7.951   2.886 -12.191
  372    HB3  HIS  51           3HB      HIS  51   9.185   2.217 -13.278
  373    HD1  HIS  51           HD1      HIS  51   8.143   5.558 -11.699
  374    HD2  HIS  51           HD2      HIS  51  11.171   3.888 -14.146
  375    HE1  HIS  51           HE1      HIS  51   9.881   7.294 -11.950
  376    H    LEU  52           H        LEU  52   5.183   2.318 -13.762
  377    HA   LEU  52           HA       LEU  52   5.180  -0.027 -15.574
  378    HB2  LEU  52           2HB      LEU  52   5.743  -0.548 -13.029
  379    HB3  LEU  52           3HB      LEU  52   3.985  -0.404 -12.838
  380    HG   LEU  52           HG       LEU  52   3.838  -2.076 -14.835
  381   HD11  LEU  52          1HD1      LEU  52   6.700  -2.600 -13.913
  382   HD12  LEU  52          2HD1      LEU  52   5.770  -3.615 -15.039
  383   HD13  LEU  52          3HD1      LEU  52   6.225  -1.960 -15.502
  384   HD21  LEU  52          3HD2      LEU  52   4.901  -3.000 -12.150
  385   HD22  LEU  52          1HD2      LEU  52   3.203  -2.653 -12.553
  386   HD23  LEU  52          2HD2      LEU  52   4.041  -4.012 -13.335
  387    H    SER  53           H        SER  53   2.717  -0.914 -15.392
  388    HA   SER  53           HA       SER  53   0.770   1.318 -15.100
  389    HB2  SER  53           2HB      SER  53   1.081  -0.364 -17.615
  390    HB3  SER  53           3HB      SER  53  -0.137   0.899 -17.320
  391    HG   SER  53           HG       SER  53   1.656   1.663 -18.571
  392    H    VAL  54           H        VAL  54  -1.104   0.506 -14.161
  393    HA   VAL  54           HA       VAL  54  -1.637  -2.374 -13.880
  394    HB   VAL  54           HB       VAL  54  -2.354  -0.603 -12.257
  395   HG11  VAL  54          1HG1      VAL  54  -4.382   0.139 -14.418
  396   HG12  VAL  54          2HG1      VAL  54  -4.406   0.713 -12.736
  397   HG13  VAL  54          3HG1      VAL  54  -3.078   1.187 -13.818
  398   HG21  VAL  54          3HG2      VAL  54  -4.544  -2.313 -13.384
  399   HG22  VAL  54          1HG2      VAL  54  -3.350  -2.742 -12.136
  400   HG23  VAL  54          2HG2      VAL  54  -4.569  -1.488 -11.812
  401    H    GLY  55           H        GLY  55  -3.202  -3.609 -14.756
  402    HA2  GLY  55           2HA      GLY  55  -4.566  -4.394 -16.425
  403    HA3  GLY  55           3HA      GLY  55  -4.821  -2.712 -16.944
  404    H    ASP  56           H        ASP  56  -1.616  -4.196 -16.736
  405    HA   ASP  56           HA       ASP  56  -1.480  -4.456 -19.718
  406    HB2  ASP  56           2HB      ASP  56  -0.421  -2.401 -18.890
  407    HB3  ASP  56           3HB      ASP  56   0.678  -3.350 -17.864
  408    H    GLU  57           H        GLU  57   0.214  -5.977 -20.394
  409    HA   GLU  57           HA       GLU  57   0.536  -8.248 -18.480
  410    HB2  GLU  57           2HB      GLU  57  -0.602  -8.642 -20.641
  411    HB3  GLU  57           3HB      GLU  57   0.855  -8.077 -21.491
  412    HG2  GLU  57           2HG      GLU  57   2.157  -9.923 -20.508
  413    HG3  GLU  57           3HG      GLU  57   0.720 -10.493 -19.630
  414    H    VAL  58           H        VAL  58   2.542  -8.879 -17.838
  415    HA   VAL  58           HA       VAL  58   4.993  -7.502 -18.856
  416    HB   VAL  58           HB       VAL  58   5.605  -6.946 -16.504
  417   HG11  VAL  58          1HG1      VAL  58   3.016  -5.605 -17.426
  418   HG12  VAL  58          2HG1      VAL  58   4.162  -4.939 -16.241
  419   HG13  VAL  58          3HG1      VAL  58   4.658  -5.152 -17.936
  420   HG21  VAL  58          3HG2      VAL  58   2.744  -7.591 -15.785
  421   HG22  VAL  58          1HG2      VAL  58   4.204  -8.454 -15.250
  422   HG23  VAL  58          2HG2      VAL  58   3.931  -6.774 -14.743
  423    H    GLN  59           H        GLN  59   6.826  -8.681 -18.673
  424    HA   GLN  59           HA       GLN  59   6.573 -11.394 -17.552
  425    HB2  GLN  59           2HB      GLN  59   8.952 -10.015 -18.848
  426    HB3  GLN  59           3HB      GLN  59   8.840 -11.733 -18.399
  427    HG2  GLN  59           2HG      GLN  59   6.665 -11.637 -19.948
  428    HG3  GLN  59           3HG      GLN  59   7.512 -10.250 -20.661
  429   HE21  GLN  59          2HE2      GLN  59   7.206 -13.659 -20.620
  430   HE22  GLN  59          1HE2      GLN  59   8.606 -14.035 -21.611
  431    H    VAL  60           H        VAL  60   7.469 -11.980 -15.647
  432    HA   VAL  60           HA       VAL  60   8.821  -9.921 -13.906
  433    HB   VAL  60           HB       VAL  60   7.532 -11.120 -12.043
  434   HG11  VAL  60          1HG1      VAL  60   5.913  -9.467 -14.031
  435   HG12  VAL  60          2HG1      VAL  60   5.494  -9.737 -12.325
  436   HG13  VAL  60          3HG1      VAL  60   6.957  -8.824 -12.740
  437   HG21  VAL  60          3HG2      VAL  60   5.741 -12.046 -14.286
  438   HG22  VAL  60          1HG2      VAL  60   6.717 -13.063 -13.201
  439   HG23  VAL  60          2HG2      VAL  60   5.373 -12.102 -12.549
  440    H    LYS  61           H        LYS  61  10.480 -10.611 -12.683
  441    HA   LYS  61           HA       LYS  61  11.178 -13.512 -12.820
  442    HB2  LYS  61           2HB      LYS  61  12.977 -12.011 -13.456
  443    HB3  LYS  61           3HB      LYS  61  12.750 -11.054 -11.976
  444    HG2  LYS  61           2HG      LYS  61  13.284 -13.142 -10.657
  445    HG3  LYS  61           3HG      LYS  61  13.713 -13.929 -12.190
  446    HD2  LYS  61           2HD      LYS  61  15.537 -12.378 -12.548
  447    HD3  LYS  61           3HD      LYS  61  15.028 -11.379 -11.167
  448    HE2  LYS  61           2HE      LYS  61  15.946 -14.275 -10.976
  449    HE3  LYS  61           3HE      LYS  61  16.993 -12.866 -10.685
  450    HZ1  LYS  61           3HZ      LYS  61  15.545 -12.250  -8.860
  451    HZ2  LYS  61           1HZ      LYS  61  14.570 -13.555  -9.130
  452    HZ3  LYS  61           2HZ      LYS  61  16.127 -13.773  -8.630
  453    H    VAL  62           H        VAL  62  10.764 -14.758 -11.053
  454    HA   VAL  62           HA       VAL  62   9.550 -13.701  -8.673
  455    HB   VAL  62           HB       VAL  62  10.962 -16.380  -8.953
  456   HG11  VAL  62          1HG1      VAL  62   8.573 -15.447  -7.287
  457   HG12  VAL  62          2HG1      VAL  62   9.242 -17.094  -7.303
  458   HG13  VAL  62          3HG1      VAL  62  10.211 -15.748  -6.666
  459   HG21  VAL  62          3HG2      VAL  62   8.103 -15.699  -9.735
  460   HG22  VAL  62          1HG2      VAL  62   9.412 -16.144 -10.854
  461   HG23  VAL  62          2HG2      VAL  62   8.814 -17.331  -9.676
  462    H    LEU  63           H        LEU  63  10.378 -12.956  -6.886
  463    HA   LEU  63           HA       LEU  63  13.362 -12.725  -6.650
  464    HB2  LEU  63           2HB      LEU  63  12.128 -10.674  -7.166
  465    HB3  LEU  63           3HB      LEU  63  11.110 -10.921  -5.732
  466    HG   LEU  63           HG       LEU  63  13.113 -10.692  -4.282
  467   HD11  LEU  63          1HD1      LEU  63  14.556  -9.922  -6.863
  468   HD12  LEU  63          2HD1      LEU  63  15.222  -9.780  -5.219
  469   HD13  LEU  63          3HD1      LEU  63  14.871 -11.384  -5.895
  470   HD21  LEU  63          3HD2      LEU  63  12.647  -8.405  -6.246
  471   HD22  LEU  63          1HD2      LEU  63  11.684  -8.748  -4.791
  472   HD23  LEU  63          2HD2      LEU  63  13.381  -8.238  -4.634
  473    H    ALA  64           H        ALA  64  10.352 -13.312  -4.787
  474    HA   ALA  64           HA       ALA  64  11.843 -15.054  -2.944
  475    HB1  ALA  64           1HB      ALA  64  10.437 -12.551  -1.920
  476    HB2  ALA  64           2HB      ALA  64  11.078 -13.868  -0.916
  477    HB3  ALA  64           3HB      ALA  64  12.188 -12.854  -1.866
  478    H    VAL  65           H        VAL  65  10.377 -16.273  -1.607
  479    HA   VAL  65           HA       VAL  65   7.447 -16.032  -2.193
  480    HB   VAL  65           HB       VAL  65   9.132 -18.560  -1.971
  481   HG11  VAL  65          1HG1      VAL  65   6.108 -18.249  -2.298
  482   HG12  VAL  65          2HG1      VAL  65   7.005 -19.786  -2.349
  483   HG13  VAL  65          3HG1      VAL  65   6.938 -18.847  -0.843
  484   HG21  VAL  65          3HG2      VAL  65   7.481 -17.488  -4.289
  485   HG22  VAL  65          1HG2      VAL  65   9.255 -17.553  -4.204
  486   HG23  VAL  65          2HG2      VAL  65   8.313 -19.060  -4.242
  487    H    ASP  66           H        ASP  66   6.494 -15.430  -0.373
  488    HA   ASP  66           HA       ASP  66   8.043 -15.300   2.115
  489    HB2  ASP  66           2HB      ASP  66   6.880 -13.344   2.046
  490    HB3  ASP  66           3HB      ASP  66   5.805 -14.043   0.824
  491    H    GLU  67           H        GLU  67   5.115 -16.921   1.143
  492    HA   GLU  67           HA       GLU  67   3.835 -18.611   2.111
  493    HB2  GLU  67           2HB      GLU  67   6.031 -19.623   1.043
  494    HB3  GLU  67           3HB      GLU  67   6.414 -20.013   2.734
  495    HG2  GLU  67           2HG      GLU  67   4.311 -21.258   2.939
  496    HG3  GLU  67           3HG      GLU  67   3.870 -20.869   1.263
  497    H    GLU  68           H        GLU  68   4.471 -16.490   3.927
  498    HA   GLU  68           HA       GLU  68   3.322 -18.001   6.240
  499    HB2  GLU  68           2HB      GLU  68   4.475 -16.623   7.814
  500    HB3  GLU  68           3HB      GLU  68   5.658 -17.425   6.757
  501    HG2  GLU  68           2HG      GLU  68   5.953 -15.322   5.482
  502    HG3  GLU  68           3HG      GLU  68   4.741 -14.532   6.515
  503    H    LYS  69           H        LYS  69   3.370 -15.162   4.317
  504    HA   LYS  69           HA       LYS  69   0.679 -14.276   5.321
  505    HB2  LYS  69           2HB      LYS  69   2.854 -12.866   5.125
  506    HB3  LYS  69           3HB      LYS  69   2.500 -12.899   3.382
  507    HG2  LYS  69           2HG      LYS  69   0.301 -11.819   3.850
  508    HG3  LYS  69           3HG      LYS  69   0.744 -11.720   5.569
  509    HD2  LYS  69           2HD      LYS  69   2.085 -10.362   3.213
  510    HD3  LYS  69           3HD      LYS  69   1.166  -9.591   4.523
  511    HE2  LYS  69           2HE      LYS  69   3.295  -9.107   5.223
  512    HE3  LYS  69           3HE      LYS  69   3.041 -10.663   6.048
  513    HZ1  LYS  69           3HZ      LYS  69   4.292 -11.736   4.281
  514    HZ2  LYS  69           1HZ      LYS  69   4.522 -10.289   3.518
  515    HZ3  LYS  69           2HZ      LYS  69   5.201 -10.564   4.991
  516    H    GLY  70           H        GLY  70   2.122 -16.316   3.034
  517    HA2  GLY  70           2HA      GLY  70   1.381 -17.292   1.082
  518    HA3  GLY  70           3HA      GLY  70  -0.211 -16.554   1.379
  519    H    LYS  71           H        LYS  71   3.053 -15.101   0.807
  520    HA   LYS  71           HA       LYS  71   1.968 -13.769  -1.647
  521    HB2  LYS  71           2HB      LYS  71   3.654 -12.502   0.537
  522    HB3  LYS  71           3HB      LYS  71   3.176 -11.730  -0.991
  523    HG2  LYS  71           2HG      LYS  71   1.249 -12.669   1.161
  524    HG3  LYS  71           3HG      LYS  71   1.828 -11.000   0.990
  525    HD2  LYS  71           2HD      LYS  71   0.667 -10.677  -1.049
  526    HD3  LYS  71           3HD      LYS  71   0.413 -12.419  -1.284
  527    HE2  LYS  71           2HE      LYS  71  -0.847 -10.816   0.968
  528    HE3  LYS  71           3HE      LYS  71  -1.642 -11.113  -0.595
  529    HZ1  LYS  71           3HZ      LYS  71  -1.508 -13.471  -0.142
  530    HZ2  LYS  71           1HZ      LYS  71  -0.775 -13.200   1.308
  531    HZ3  LYS  71           2HZ      LYS  71  -2.328 -12.705   1.069
  532    H    ILE  72           H        ILE  72   3.671 -12.847  -2.975
  533    HA   ILE  72           HA       ILE  72   6.254 -14.349  -3.036
  534    HB   ILE  72           HB       ILE  72   4.161 -14.241  -5.266
  535   HG12  ILE  72          2HG1      ILE  72   5.271 -16.541  -3.675
  536   HG13  ILE  72          3HG1      ILE  72   3.614 -15.899  -3.648
  537   HG21  ILE  72          1HG2      ILE  72   6.995 -15.391  -5.299
  538   HG22  ILE  72          2HG2      ILE  72   5.813 -15.517  -6.620
  539   HG23  ILE  72          3HG2      ILE  72   6.459 -13.932  -6.164
  540   HD11  ILE  72          3HD1      ILE  72   3.279 -16.644  -5.985
  541   HD12  ILE  72          1HD1      ILE  72   4.934 -17.298  -6.012
  542   HD13  ILE  72          2HD1      ILE  72   3.721 -18.008  -4.930
  543    H    SER  73           H        SER  73   7.808 -12.872  -3.352
  544    HA   SER  73           HA       SER  73   7.094 -10.166  -4.285
  545    HB2  SER  73           2HB      SER  73   9.811 -11.275  -3.507
  546    HB3  SER  73           3HB      SER  73   9.337  -9.568  -3.652
  547    HG   SER  73           HG       SER  73   9.317 -10.310  -1.460
  548    H    LEU  74           H        LEU  74   7.814  -9.310  -6.184
  549    HA   LEU  74           HA       LEU  74   9.029 -11.143  -8.222
  550    HB2  LEU  74           2HB      LEU  74   6.774  -9.177  -8.537
  551    HB3  LEU  74           3HB      LEU  74   7.495 -10.117  -9.861
  552    HG   LEU  74           HG       LEU  74   5.934 -11.302  -7.511
  553   HD11  LEU  74          1HD1      LEU  74   5.154 -10.907 -10.434
  554   HD12  LEU  74          2HD1      LEU  74   4.179 -11.746  -9.208
  555   HD13  LEU  74          3HD1      LEU  74   4.493 -10.002  -9.053
  556   HD21  LEU  74          3HD2      LEU  74   6.990 -12.645 -10.009
  557   HD22  LEU  74          1HD2      LEU  74   7.600 -12.863  -8.353
  558   HD23  LEU  74          2HD2      LEU  74   5.956 -13.390  -8.766
  559    H    SER  75           H        SER  75   9.908  -9.827 -10.082
  560    HA   SER  75           HA       SER  75  10.581  -6.993  -9.486
  561    HB2  SER  75           2HB      SER  75  12.958  -7.552 -10.167
  562    HB3  SER  75           3HB      SER  75  12.452  -8.079  -8.546
  563    HG   SER  75           HG       SER  75  13.609  -9.715  -9.688
  564    H    ILE  76           H        ILE  76  11.046  -5.766 -11.227
  565    HA   ILE  76           HA       ILE  76  10.527  -6.868 -13.993
  566    HB   ILE  76           HB       ILE  76   9.550  -4.311 -12.660
  567   HG12  ILE  76          2HG1      ILE  76   8.168  -6.218 -12.210
  568   HG13  ILE  76          3HG1      ILE  76   7.357  -4.934 -13.129
  569   HG21  ILE  76          1HG2      ILE  76   9.344  -5.094 -15.607
  570   HG22  ILE  76          2HG2      ILE  76   8.563  -3.683 -14.852
  571   HG23  ILE  76          3HG2      ILE  76  10.331  -3.773 -14.950
  572   HD11  ILE  76          3HD1      ILE  76   7.596  -6.271 -15.206
  573   HD12  ILE  76          1HD1      ILE  76   8.412  -7.552 -14.280
  574   HD13  ILE  76          2HD1      ILE  76   6.704  -7.165 -13.966
  575    H    ARG  77           H        ARG  77  12.429  -4.513 -12.009
  576    HA   ARG  77           HA       ARG  77  14.009  -3.644 -14.182
  577    HB2  ARG  77           2HB      ARG  77  15.683  -3.086 -12.637
  578    HB3  ARG  77           3HB      ARG  77  14.103  -2.751 -11.899
  579    HG2  ARG  77           2HG      ARG  77  14.332  -4.700 -10.417
  580    HG3  ARG  77           3HG      ARG  77  15.852  -5.168 -11.216
  581    HD2  ARG  77           2HD      ARG  77  16.953  -3.147 -10.474
  582    HD3  ARG  77           3HD      ARG  77  15.423  -2.466  -9.872
  583    HE   ARG  77           HE       ARG  77  15.658  -4.768  -8.438
  584   HH11  ARG  77          1HH2      ARG  77  18.112  -2.286  -9.048
  585   HH12  ARG  77          2HH2      ARG  77  18.769  -2.375  -7.435
  586   HH21  ARG  77          1HH1      ARG  77  16.425  -4.760  -6.309
  587   HH22  ARG  77          2HH1      ARG  77  17.814  -3.784  -5.881
  588    H    ALA  78           H        ALA  78  14.103  -6.755 -12.599
  589    HA   ALA  78           HA       ALA  78  16.370  -7.844 -13.916
  590    HB1  ALA  78           1HB      ALA  78  13.733  -9.161 -13.128
  591    HB2  ALA  78           2HB      ALA  78  15.254 -10.008 -13.495
  592    HB3  ALA  78           3HB      ALA  78  15.148  -8.950 -12.069
  593    H    THR  79           H        THR  79  12.905  -7.950 -14.992
  594    HA   THR  79           HA       THR  79  13.668  -9.267 -17.453
  595    HB   THR  79           HB       THR  79  11.200  -9.018 -17.944
  596    HG1  THR  79           1HG      THR  79   9.933  -8.251 -16.171
  597   HG21  THR  79          1HG2      THR  79  11.929 -10.084 -15.172
  598   HG22  THR  79          2HG2      THR  79  10.481 -10.520 -16.102
  599   HG23  THR  79          3HG2      THR  79  12.086 -10.980 -16.701
  600    H    GLN  80           H        GLN  80  12.938  -5.883 -16.649
  601    HA   GLN  80           HA       GLN  80  13.124  -4.818 -19.294
  602    HB2  GLN  80           2HB      GLN  80  13.861  -3.712 -16.574
  603    HB3  GLN  80           3HB      GLN  80  13.949  -2.760 -18.071
  604    HG2  GLN  80           2HG      GLN  80  11.512  -3.039 -18.414
  605    HG3  GLN  80           3HG      GLN  80  11.425  -4.044 -16.953
  606   HE21  GLN  80          2HE2      GLN  80   9.733  -1.854 -17.032
  607   HE22  GLN  80          1HE2      GLN  80  10.320  -0.599 -15.957
  608    H    ALA  81           H        ALA  81  15.549  -6.358 -17.415
  609    HA   ALA  81           HA       ALA  81  17.688  -5.458 -19.306
  610    HB1  ALA  81           1HB      ALA  81  17.918  -6.082 -16.331
  611    HB2  ALA  81           2HB      ALA  81  19.262  -5.649 -17.413
  612    HB3  ALA  81           3HB      ALA  81  17.986  -4.460 -17.061
  613    H    ALA  82           H        ALA  82  15.790  -7.746 -19.471
  614    HA   ALA  82           HA       ALA  82  17.020 -10.213 -18.945
  615    HB1  ALA  82           1HB      ALA  82  15.313  -9.401 -21.335
  616    HB2  ALA  82           2HB      ALA  82  15.610 -11.067 -20.788
  617    HB3  ALA  82           3HB      ALA  82  14.701  -9.944 -19.754
  618    HA   PRO  83           HA       PRO  83  20.589 -10.683 -21.360
  619    HB2  PRO  83           2HB      PRO  83  19.479 -13.241 -22.507
  620    HB3  PRO  83           3HB      PRO  83  21.063 -12.932 -21.750
  621    HG2  PRO  83           2HG      PRO  83  19.146 -14.132 -20.268
  622    HG3  PRO  83           3HG      PRO  83  20.214 -12.900 -19.549
  623    HD2  PRO  83           2HD      PRO  83  17.351 -12.569 -20.552
  624    HD3  PRO  83           3HD      PRO  83  18.119 -11.860 -19.110
  625    H    GLU  84           H        GLU  84  17.569 -10.905 -23.142
  626    HA   GLU  84           HA       GLU  84  18.834  -9.658 -25.524
  627    HB2  GLU  84           2HB      GLU  84  18.777 -12.127 -25.870
  628    HB3  GLU  84           3HB      GLU  84  17.018 -12.092 -25.613
  629    HG2  GLU  84           2HG      GLU  84  16.713 -10.699 -27.606
  630    HG3  GLU  84           3HG      GLU  84  18.475 -10.558 -27.795
  631    H    LYS  85           H        LYS  85  17.456  -8.312 -26.583
  632    HA   LYS  85           HA       LYS  85  14.566  -8.170 -26.053
  633    HB2  LYS  85           2HB      LYS  85  14.624  -5.804 -25.439
  634    HB3  LYS  85           3HB      LYS  85  15.436  -6.822 -24.229
  635    HG2  LYS  85           2HG      LYS  85  17.619  -6.115 -24.999
  636    HG3  LYS  85           3HG      LYS  85  16.908  -5.264 -26.388
  637    HD2  LYS  85           2HD      LYS  85  17.585  -3.669 -24.655
  638    HD3  LYS  85           3HD      LYS  85  15.819  -3.662 -24.872
  639    HE2  LYS  85           2HE      LYS  85  15.559  -5.086 -22.874
  640    HE3  LYS  85           3HE      LYS  85  17.325  -5.127 -22.664
  641    HZ1  LYS  85           3HZ      LYS  85  17.272  -2.751 -22.318
  642    HZ2  LYS  85           1HZ      LYS  85  15.635  -2.714 -22.514
  643    HZ3  LYS  85           2HZ      LYS  85  16.291  -3.508 -21.223
  644    H    LYS  86           H        LYS  86  13.715  -6.219 -27.431
  645    HA   LYS  86           HA       LYS  86  15.335  -5.672 -29.856
  646    HB2  LYS  86           2HB      LYS  86  13.729  -6.389 -31.363
  647    HB3  LYS  86           3HB      LYS  86  13.935  -7.725 -30.212
  648    HG2  LYS  86           2HG      LYS  86  11.620  -5.756 -30.240
  649    HG3  LYS  86           3HG      LYS  86  11.580  -7.389 -30.939
  650    HD2  LYS  86           2HD      LYS  86  12.110  -8.262 -28.596
  651    HD3  LYS  86           3HD      LYS  86  11.788  -6.615 -28.008
  652    HE2  LYS  86           2HE      LYS  86   9.813  -8.311 -29.579
  653    HE3  LYS  86           3HE      LYS  86   9.840  -8.191 -27.804
  654    HZ1  LYS  86           3HZ      LYS  86   9.396  -5.839 -28.020
  655    HZ2  LYS  86           1HZ      LYS  86   9.371  -5.949 -29.665
  656    HZ3  LYS  86           2HZ      LYS  86   8.214  -6.711 -28.770
  657    H    GLU  87           H        GLU  87  14.189  -4.080 -31.256
  658    HA   GLU  87           HA       GLU  87  12.414  -2.166 -29.870
  659    HB2  GLU  87           2HB      GLU  87  13.899  -0.291 -30.276
  660    HB3  GLU  87           3HB      GLU  87  14.664  -1.473 -29.192
  661    HG2  GLU  87           2HG      GLU  87  16.115  -2.273 -30.980
  662    HG3  GLU  87           3HG      GLU  87  15.202  -1.324 -32.174
  663    H    SER  88           H        SER  88  11.840  -0.385 -31.440
  664    HA   SER  88           HA       SER  88  12.431  -0.833 -34.297
  665    HB2  SER  88           2HB      SER  88   9.951  -0.432 -34.779
  666    HB3  SER  88           3HB      SER  88  10.429  -2.056 -34.237
  667    HG   SER  88           HG       SER  88   8.537  -1.277 -33.150
  668    H    LYS  89           H        LYS  89  12.493   1.103 -35.437
  669    HA   LYS  89           HA       LYS  89  12.563   3.576 -33.923
  670    HB2  LYS  89           2HB      LYS  89  12.887   2.754 -36.795
  671    HB3  LYS  89           3HB      LYS  89  12.562   4.462 -36.432
  672    HG2  LYS  89           2HG      LYS  89  14.953   4.081 -36.609
  673    HG3  LYS  89           3HG      LYS  89  14.503   4.548 -34.954
  674    HD2  LYS  89           2HD      LYS  89  14.726   2.196 -34.212
  675    HD3  LYS  89           3HD      LYS  89  15.136   1.703 -35.872
  676    HE2  LYS  89           2HE      LYS  89  17.125   3.139 -35.830
  677    HE3  LYS  89           3HE      LYS  89  16.700   3.710 -34.199
  678    HZ1  LYS  89           3HZ      LYS  89  16.992   1.459 -33.395
  679    HZ2  LYS  89           1HZ      LYS  89  17.386   0.931 -34.912
  680    HZ3  LYS  89           2HZ      LYS  89  18.373   1.991 -34.127
  681    HA   PRO  90           HA       PRO  90   8.391   4.643 -33.918
  682    HB2  PRO  90           2HB      PRO  90   8.352   7.378 -34.176
  683    HB3  PRO  90           3HB      PRO  90   8.842   6.531 -32.687
  684    HG2  PRO  90           2HG      PRO  90  10.576   7.682 -34.945
  685    HG3  PRO  90           3HG      PRO  90  10.838   7.815 -33.187
  686    HD2  PRO  90           2HD      PRO  90  12.153   5.911 -34.693
  687    HD3  PRO  90           3HD      PRO  90  11.640   5.568 -33.021
  688    H    ARG  91           H        ARG  91   6.594   5.232 -35.195
  689    HA   ARG  91           HA       ARG  91   7.146   5.309 -38.131
  690    HB2  ARG  91           2HB      ARG  91   4.768   4.363 -36.496
  691    HB3  ARG  91           3HB      ARG  91   4.810   4.404 -38.271
  692    HG2  ARG  91           2HG      ARG  91   6.784   2.832 -36.564
  693    HG3  ARG  91           3HG      ARG  91   5.296   2.137 -37.243
  694    HD2  ARG  91           2HD      ARG  91   6.065   2.510 -39.506
  695    HD3  ARG  91           3HD      ARG  91   7.459   3.450 -38.930
  696    HE   ARG  91           HE       ARG  91   7.357   0.688 -37.979
  697   HH11  ARG  91          1HH1      ARG  91   8.334   2.737 -40.679
  698   HH12  ARG  91          2HH1      ARG  91   9.718   1.754 -41.106
  699   HH21  ARG  91          1HH2      ARG  91   9.254  -0.527 -38.460
  700   HH22  ARG  91          2HH2      ARG  91  10.235  -0.101 -39.841
  701    H    LYS  92           H        LYS  92   6.755   7.586 -36.032
  702    HA   LYS  92           HA       LYS  92   5.686   9.408 -38.127
  703    HB2  LYS  92           2HB      LYS  92   4.966   9.434 -35.175
  704    HB3  LYS  92           3HB      LYS  92   4.695  10.801 -36.277
  705    HG2  LYS  92           2HG      LYS  92   3.237   9.366 -37.681
  706    HG3  LYS  92           3HG      LYS  92   3.486   8.022 -36.546
  707    HD2  LYS  92           2HD      LYS  92   1.348   9.023 -36.093
  708    HD3  LYS  92           3HD      LYS  92   2.458   9.365 -34.748
  709    HE2  LYS  92           2HE      LYS  92   1.171  11.354 -35.161
  710    HE3  LYS  92           3HE      LYS  92   2.839  11.648 -35.702
  711    HZ1  LYS  92           3HZ      LYS  92   2.106  11.251 -37.957
  712    HZ2  LYS  92           1HZ      LYS  92   0.559  10.982 -37.453
  713    HZ3  LYS  92           2HZ      LYS  92   1.232  12.476 -37.282
  714    HA   PRO  93           HA       PRO  93   9.470  11.527 -36.785
  715    HB2  PRO  93           2HB      PRO  93   8.833  14.174 -37.185
  716    HB3  PRO  93           3HB      PRO  93   9.315  13.068 -38.496
  717    HG2  PRO  93           2HG      PRO  93   6.519  13.944 -37.571
  718    HG3  PRO  93           3HG      PRO  93   7.118  13.781 -39.242
  719    HD2  PRO  93           2HD      PRO  93   5.620  11.794 -38.024
  720    HD3  PRO  93           3HD      PRO  93   6.889  11.410 -39.214
  721    H    LYS  94           H        LYS  94  10.164  13.118 -35.106
  722    HA   LYS  94           HA       LYS  94   8.176  13.658 -32.945
  723    HB2  LYS  94           2HB      LYS  94  10.874  12.295 -32.616
  724    HB3  LYS  94           3HB      LYS  94   9.845  12.873 -31.287
  725    HG2  LYS  94           2HG      LYS  94   8.060  11.305 -31.999
  726    HG3  LYS  94           3HG      LYS  94   9.113  10.713 -33.303
  727    HD2  LYS  94           2HD      LYS  94   9.173   9.138 -31.488
  728    HD3  LYS  94           3HD      LYS  94  10.749   9.949 -31.623
  729    HE2  LYS  94           2HE      LYS  94  10.228   9.721 -29.283
  730    HE3  LYS  94           3HE      LYS  94  10.097  11.439 -29.724
  731    HZ1  LYS  94           3HZ      LYS  94   7.709  11.164 -29.817
  732    HZ2  LYS  94           1HZ      LYS  94   7.833   9.574 -29.405
  733    HZ3  LYS  94           2HZ      LYS  94   8.273  10.738 -28.326
  734    H    ALA  95           H        ALA  95   8.938  15.276 -31.443
  735    HA   ALA  95           HA       ALA  95  11.100  17.078 -32.416
  736    HB1  ALA  95           1HB      ALA  95   8.214  17.901 -31.866
  737    HB2  ALA  95           2HB      ALA  95   9.550  18.998 -32.283
  738    HB3  ALA  95           3HB      ALA  95   8.979  17.803 -33.471
  739    H    ALA  96           H        ALA  96  10.556  15.232 -30.007
  740    HA   ALA  96           HA       ALA  96  10.268  16.948 -27.711
  741    HB1  ALA  96           1HB      ALA  96  11.367  14.113 -27.950
  742    HB2  ALA  96           2HB      ALA  96  10.846  14.908 -26.447
  743    HB3  ALA  96           3HB      ALA  96   9.655  14.549 -27.719
  744    H    GLN  97           H        GLN  97  12.933  16.514 -29.776
  745    HA   GLN  97           HA       GLN  97  15.145  16.661 -27.970
  746    HB2  GLN  97           2HB      GLN  97  14.800  17.627 -30.834
  747    HB3  GLN  97           3HB      GLN  97  16.354  17.551 -29.972
  748    HG2  GLN  97           2HG      GLN  97  16.111  15.096 -29.724
  749    HG3  GLN  97           3HG      GLN  97  14.535  15.167 -30.543
  750   HE21  GLN  97          2HE2      GLN  97  18.041  15.837 -31.019
  751   HE22  GLN  97          1HE2      GLN  97  18.017  15.550 -32.755
  752    H    VAL  98           H        VAL  98  16.606  18.431 -27.776
  753    HA   VAL  98           HA       VAL  98  15.496  21.218 -27.672
  754    HB   VAL  98           HB       VAL  98  16.597  21.456 -25.437
  755   HG11  VAL  98          1HG1      VAL  98  14.389  19.345 -25.518
  756   HG12  VAL  98          2HG1      VAL  98  14.831  20.327 -24.104
  757   HG13  VAL  98          3HG1      VAL  98  14.144  21.106 -25.548
  758   HG21  VAL  98          3HG2      VAL  98  16.820  18.439 -25.451
  759   HG22  VAL  98          1HG2      VAL  98  18.159  19.610 -25.472
  760   HG23  VAL  98          2HG2      VAL  98  17.093  19.506 -24.055
  761    H    SER  99           H        SER  99  17.361  22.784 -27.330
  762    HA   SER  99           HA       SER  99  19.182  22.523 -29.473
  763    HB2  SER  99           2HB      SER  99  19.598  24.226 -26.997
  764    HB3  SER  99           3HB      SER  99  20.132  24.554 -28.663
  765    HG   SER  99           HG       SER  99  18.224  25.739 -28.088
  766    H    GLU 100           H        GLU 100  19.634  21.624 -26.088
  767    HA   GLU 100           HA       GLU 100  22.472  21.087 -26.235
  768    HB2  GLU 100           2HB      GLU 100  20.278  20.127 -24.377
  769    HB3  GLU 100           3HB      GLU 100  22.011  19.826 -24.133
  770    HG2  GLU 100           2HG      GLU 100  21.433  21.646 -22.715
  771    HG3  GLU 100           3HG      GLU 100  22.377  22.284 -24.079
  772    H    GLU 101           H        GLU 101  19.899  19.428 -27.646
  773    HA   GLU 101           HA       GLU 101  21.445  16.898 -27.998
  774    HB2  GLU 101           2HB      GLU 101  19.796  16.924 -25.978
  775    HB3  GLU 101           3HB      GLU 101  18.526  16.898 -27.222
  776    HG2  GLU 101           2HG      GLU 101  19.377  14.806 -28.116
  777    HG3  GLU 101           3HG      GLU 101  20.762  14.825 -27.004
  778    H    ALA 102           H        ALA 102  20.897  19.212 -29.686
  779    HA   ALA 102           HA       ALA 102  18.779  18.623 -31.536
  780    HB1  ALA 102           1HB      ALA 102  21.181  20.484 -31.787
  781    HB2  ALA 102           2HB      ALA 102  19.711  20.536 -32.788
  782    HB3  ALA 102           3HB      ALA 102  19.616  20.901 -31.050
  783    H    SER 103           H        SER 103  21.067  16.612 -31.167
  784    HA   SER 103           HA       SER 103  22.448  16.137 -33.621
  785    HB2  SER 103           2HB      SER 103  21.440  14.038 -31.683
  786    HB3  SER 103           3HB      SER 103  22.931  14.029 -32.654
  787    HG   SER 103           HG       SER 103  23.318  14.559 -30.428
  788    H    THR 104           H        THR 104  22.061  14.043 -34.916
  789    HA   THR 104           HA       THR 104  19.652  13.899 -36.364
  790    HB   THR 104           HB       THR 104  21.378  11.527 -35.617
  791    HG1  THR 104           1HG      THR 104  22.773  12.241 -37.318
  792   HG21  THR 104          1HG2      THR 104  20.027  12.322 -38.238
  793   HG22  THR 104          2HG2      THR 104  21.004  10.857 -37.976
  794   HG23  THR 104          3HG2      THR 104  19.459  11.059 -37.119
  795    HA   PRO 105           HA       PRO 105  16.813  12.409 -33.301
  796    HB2  PRO 105           2HB      PRO 105  14.830  11.354 -34.916
  797    HB3  PRO 105           3HB      PRO 105  15.014  13.092 -34.565
  798    HG2  PRO 105           2HG      PRO 105  15.979  11.477 -36.987
  799    HG3  PRO 105           3HG      PRO 105  15.203  13.081 -36.974
  800    HD2  PRO 105           2HD      PRO 105  17.937  12.825 -37.161
  801    HD3  PRO 105           3HD      PRO 105  17.207  14.169 -36.249
  802    H    GLN 106           H        GLN 106  15.913  10.380 -32.468
  803    HA   GLN 106           HA       GLN 106  17.563   8.080 -32.776
  804    HB2  GLN 106           2HB      GLN 106  14.732   8.349 -31.705
  805    HB3  GLN 106           3HB      GLN 106  15.756   6.906 -31.529
  806    HG2  GLN 106           2HG      GLN 106  17.433   8.287 -30.278
  807    HG3  GLN 106           3HG      GLN 106  16.335   9.680 -30.391
  808   HE21  GLN 106          2HE2      GLN 106  17.251   7.041 -28.446
  809   HE22  GLN 106          1HE2      GLN 106  15.846   7.009 -27.401
  810    H    GLY 107           H        GLY 107  14.547   8.983 -34.411
  811    HA2  GLY 107           2HA      GLY 107  15.195   7.767 -36.821
  812    HA3  GLY 107           3HA      GLY 107  14.245   6.561 -35.925
  813    H    PHE 108           H        PHE 108  13.198   7.329 -38.133
  814    HA   PHE 108           HA       PHE 108  10.580   8.343 -37.316
  815    HB2  PHE 108           2HB      PHE 108  10.439   9.944 -39.251
  816    HB3  PHE 108           3HB      PHE 108  11.562  10.455 -37.976
  817    HD1  PHE 108           HD2      PHE 108  13.963  10.552 -38.359
  818    HD2  PHE 108           HD1      PHE 108  11.226   9.359 -41.478
  819    HE1  PHE 108           HE2      PHE 108  15.759  10.873 -40.058
  820    HE2  PHE 108           HE1      PHE 108  13.018   9.683 -43.173
  821    HZ   PHE 108           HZ       PHE 108  15.290  10.433 -42.466
  822    H    ASN 109           H        ASN 109   9.126   8.093 -39.514
  823    HA   ASN 109           HA       ASN 109   9.246   5.271 -39.964
  824    HB2  ASN 109           2HB      ASN 109   7.194   7.052 -40.148
  825    HB3  ASN 109           3HB      ASN 109   7.750   7.026 -41.834
  826   HD21  ASN 109          2HD2      ASN 109   5.226   5.990 -40.433
  827   HD22  ASN 109          1HD2      ASN 109   5.095   4.325 -40.964
  828    H    THR 110           H        THR 110   9.600   4.080 -41.774
  829    HA   THR 110           HA       THR 110  11.516   5.203 -43.798
  830    HB   THR 110           HB       THR 110  12.473   2.854 -43.693
  831    HG1  THR 110           1HG      THR 110  11.960   1.704 -41.750
  832   HG21  THR 110          1HG2      THR 110  12.551   4.458 -41.094
  833   HG22  THR 110          2HG2      THR 110  13.734   3.224 -41.589
  834   HG23  THR 110          3HG2      THR 110  13.583   4.735 -42.515
  835    H    LEU 111           H        LEU 111   8.456   3.733 -43.373
  836    HA   LEU 111           HA       LEU 111   8.538   1.886 -45.623
  837    HB2  LEU 111           2HB      LEU 111   6.399   2.988 -43.810
  838    HB3  LEU 111           3HB      LEU 111   6.004   1.874 -45.134
  839    HG   LEU 111           HG       LEU 111   8.056   1.173 -42.997
  840   HD11  LEU 111          1HD1      LEU 111   5.072   0.539 -43.017
  841   HD12  LEU 111          2HD1      LEU 111   6.263  -0.108 -41.863
  842   HD13  LEU 111          3HD1      LEU 111   5.894   1.632 -41.881
  843   HD21  LEU 111          3HD2      LEU 111   6.439  -0.557 -44.888
  844   HD22  LEU 111          1HD2      LEU 111   8.168  -0.166 -45.032
  845   HD23  LEU 111          2HD2      LEU 111   7.590  -1.135 -43.660
  846    H    LYS 112           H        LYS 112   8.007   2.190 -47.675
  847    HA   LYS 112           HA       LYS 112   7.638   4.821 -48.802
  848    HB2  LYS 112           2HB      LYS 112   8.711   2.836 -49.906
  849    HB3  LYS 112           3HB      LYS 112   7.099   2.095 -50.034
  850    HG2  LYS 112           2HG      LYS 112   6.334   3.999 -51.409
  851    HG3  LYS 112           3HG      LYS 112   7.943   4.743 -51.278
  852    HD2  LYS 112           2HD      LYS 112   7.366   2.045 -52.561
  853    HD3  LYS 112           3HD      LYS 112   7.546   3.573 -53.455
  854    HE2  LYS 112           2HE      LYS 112   9.860   3.798 -52.562
  855    HE3  LYS 112           3HE      LYS 112   9.675   2.233 -51.736
  856    HZ1  LYS 112           3HZ      LYS 112   9.390   1.204 -53.888
  857    HZ2  LYS 112           1HZ      LYS 112   9.562   2.655 -54.653
  858    HZ3  LYS 112           2HZ      LYS 112  10.831   2.003 -53.827
  859    H    ASP 113           H        ASP 113   5.403   2.229 -47.987
  860    HA   ASP 113           HA       ASP 113   3.119   4.106 -47.969
  861    HB2  ASP 113           2HB      ASP 113   3.080   3.164 -50.243
  862    HB3  ASP 113           3HB      ASP 113   3.170   1.524 -49.561
  863    H    LYS 114           H        LYS 114   1.284   3.060 -46.748
  864    HA   LYS 114           HA       LYS 114   2.274   2.135 -44.277
  865    HB2  LYS 114           2HB      LYS 114  -0.522   1.991 -45.453
  866    HB3  LYS 114           3HB      LYS 114  -0.130   1.565 -43.771
  867    HG2  LYS 114           2HG      LYS 114   0.795   3.863 -43.445
  868    HG3  LYS 114           3HG      LYS 114   0.282   4.274 -45.097
  869    HD2  LYS 114           2HD      LYS 114  -1.355   5.134 -43.519
  870    HD3  LYS 114           3HD      LYS 114  -2.079   3.805 -44.455
  871    HE2  LYS 114           2HE      LYS 114  -1.707   2.255 -42.590
  872    HE3  LYS 114           3HE      LYS 114  -0.897   3.537 -41.660
  873    HZ1  LYS 114           3HZ      LYS 114  -2.977   4.734 -41.625
  874    HZ2  LYS 114           1HZ      LYS 114  -3.725   3.543 -42.488
  875    HZ3  LYS 114           2HZ      LYS 114  -3.177   3.229 -40.963
  876    H    LEU 115           H        LEU 115   2.604   0.364 -43.316
  877    HA   LEU 115           HA       LEU 115   1.734  -2.288 -44.376
  878    HB2  LEU 115           2HB      LEU 115   4.007  -1.622 -45.239
  879    HB3  LEU 115           3HB      LEU 115   4.570  -1.640 -43.552
  880    HG   LEU 115           HG       LEU 115   4.074  -4.046 -43.391
  881   HD11  LEU 115          1HD1      LEU 115   3.341  -3.866 -46.351
  882   HD12  LEU 115          2HD1      LEU 115   3.488  -5.367 -45.406
  883   HD13  LEU 115          3HD1      LEU 115   2.207  -4.201 -45.022
  884   HD21  LEU 115          3HD2      LEU 115   5.747  -3.300 -45.831
  885   HD22  LEU 115          1HD2      LEU 115   6.304  -3.319 -44.142
  886   HD23  LEU 115          2HD2      LEU 115   5.852  -4.838 -44.947
  887    H    GLU 116           H        GLU 116   2.220  -0.127 -41.851
  888    HA   GLU 116           HA       GLU 116   2.518  -1.844 -39.561
  889    HB2  GLU 116           2HB      GLU 116   1.148   0.847 -39.730
  890    HB3  GLU 116           3HB      GLU 116   1.882   0.084 -38.302
  891    HG2  GLU 116           2HG      GLU 116   3.598   1.514 -38.769
  892    HG3  GLU 116           3HG      GLU 116   4.049   0.192 -39.866
  893    H    GLU 117           H        GLU 117  -0.089  -1.270 -41.659
  894    HA   GLU 117           HA       GLU 117  -2.019  -2.771 -39.973
  895    HB2  GLU 117           2HB      GLU 117  -2.580  -0.163 -41.425
  896    HB3  GLU 117           3HB      GLU 117  -3.815  -1.228 -40.716
  897    HG2  GLU 117           2HG      GLU 117  -2.743  -0.878 -38.461
  898    HG3  GLU 117           3HG      GLU 117  -1.636   0.283 -39.228
  899    H    TRP 118           H        TRP 118  -3.894  -3.422 -41.446
  900    HA   TRP 118           HA       TRP 118  -3.067  -4.026 -44.251
  901    HB2  TRP 118           2HB      TRP 118  -3.954  -6.100 -42.194
  902    HB3  TRP 118           3HB      TRP 118  -3.560  -6.386 -43.902
  903    HD1  TRP 118           HD1      TRP 118  -2.069  -5.755 -40.586
  904    HE1  TRP 118           HE1      TRP 118   0.505  -6.395 -40.576
  905    HE3  TRP 118           HE3      TRP 118  -1.475  -6.680 -45.582
  906    HZ2  TRP 118           HZ2      TRP 118   2.416  -7.236 -42.512
  907    HZ3  TRP 118           HZ3      TRP 118   0.632  -7.409 -46.482
  908    HH2  TRP 118           HH2      TRP 118   2.632  -7.730 -45.018
  909    H    ILE 119           H        ILE 119  -4.974  -5.306 -45.277
  910    HA   ILE 119           HA       ILE 119  -7.463  -3.770 -45.116
  911    HB   ILE 119           HB       ILE 119  -8.228  -5.373 -46.830
  912   HG12  ILE 119          2HG1      ILE 119  -5.712  -6.941 -46.359
  913   HG13  ILE 119          3HG1      ILE 119  -7.341  -7.389 -45.805
  914   HG21  ILE 119          1HG2      ILE 119  -5.315  -4.539 -47.272
  915   HG22  ILE 119          2HG2      ILE 119  -6.471  -4.969 -48.550
  916   HG23  ILE 119          3HG2      ILE 119  -6.743  -3.520 -47.564
  917   HD11  ILE 119          3HD1      ILE 119  -8.119  -7.490 -48.160
  918   HD12  ILE 119          1HD1      ILE 119  -6.489  -7.049 -48.717
  919   HD13  ILE 119          2HD1      ILE 119  -6.751  -8.595 -47.888
  920    H    GLU 120           H        GLU 120  -6.457  -5.858 -42.888
  921    HA   GLU 120           HA       GLU 120  -9.216  -6.319 -41.888
  922    HB2  GLU 120           2HB      GLU 120  -8.586  -8.277 -43.239
  923    HB3  GLU 120           3HB      GLU 120  -7.100  -8.452 -42.279
  924    HG2  GLU 120           2HG      GLU 120  -8.852 -10.084 -41.647
  925    HG3  GLU 120           3HG      GLU 120  -8.381  -9.032 -40.297
  926    H    MET 121           H        MET 121  -9.121  -6.840 -39.563
  927    HA   MET 121           HA       MET 121  -7.311  -5.220 -38.049
  928    HB2  MET 121           2HB      MET 121  -9.636  -5.951 -37.454
  929    HB3  MET 121           3HB      MET 121  -8.987  -7.576 -37.141
  930    HG2  MET 121           2HG      MET 121  -9.260  -6.365 -35.057
  931    HG3  MET 121           3HG      MET 121  -7.542  -6.677 -35.384
  932    HE1  MET 121           3HE      MET 121  -8.573  -4.666 -33.134
  933    HE2  MET 121           1HE      MET 121  -6.854  -4.976 -33.472
  934    HE3  MET 121           2HE      MET 121  -7.451  -3.303 -33.364
  935    H    SER 122           H        SER 122  -7.067  -8.590 -39.017
  936    HA   SER 122           HA       SER 122  -5.042  -9.521 -37.271
  937    HB2  SER 122           2HB      SER 122  -5.325 -10.186 -40.220
  938    HB3  SER 122           3HB      SER 122  -4.693 -11.221 -38.918
  939    HG   SER 122           HG       SER 122  -6.885 -11.731 -39.479
  940    H    ASN 123           H        ASN 123  -2.811  -9.782 -37.509
  941    HA   ASN 123           HA       ASN 123  -1.352  -8.104 -39.477
  942    HB2  ASN 123           2HB      ASN 123  -1.595  -6.628 -37.561
  943    HB3  ASN 123           3HB      ASN 123  -1.042  -7.898 -36.446
  944   HD21  ASN 123          2HD2      ASN 123   0.956  -7.241 -35.704
  945   HD22  ASN 123          1HD2      ASN 123   2.261  -6.700 -36.739
  946    H    ARG 124           H        ARG 124   0.555  -9.022 -40.044
  947    HA   ARG 124           HA       ARG 124   1.791 -11.212 -38.465
  948    HB2  ARG 124           2HB      ARG 124   0.991 -11.424 -41.386
  949    HB3  ARG 124           3HB      ARG 124   2.117 -12.528 -40.564
  950    HG2  ARG 124           2HG      ARG 124   0.284 -13.168 -38.985
  951    HG3  ARG 124           3HG      ARG 124  -0.834 -12.132 -39.904
  952    HD2  ARG 124           2HD      ARG 124  -0.435 -13.492 -41.934
  953    HD3  ARG 124           3HD      ARG 124   0.689 -14.528 -41.022
  954    HE   ARG 124           HE       ARG 124  -1.731 -14.515 -39.616
  955   HH11  ARG 124          1HH1      ARG 124  -0.592 -15.603 -42.786
  956   HH12  ARG 124          2HH1      ARG 124  -1.767 -16.889 -42.902
  957   HH21  ARG 124          1HH2      ARG 124  -3.256 -16.203 -39.792
  958   HH22  ARG 124          2HH2      ARG 124  -3.279 -17.229 -41.204
  959    H    LYS 125           H        LYS 125   4.090 -11.444 -39.083
  960    HA   LYS 125           HA       LYS 125   5.431  -9.076 -39.959
  961    HB2  LYS 125           2HB      LYS 125   6.336 -10.994 -38.579
  962    HB3  LYS 125           3HB      LYS 125   6.422 -11.937 -40.084
  963    HG2  LYS 125           2HG      LYS 125   8.618 -11.089 -39.650
  964    HG3  LYS 125           3HG      LYS 125   7.950 -10.177 -41.021
  965    HD2  LYS 125           2HD      LYS 125   7.461  -8.265 -39.563
  966    HD3  LYS 125           3HD      LYS 125   7.996  -9.183 -38.135
  967    HE2  LYS 125           2HE      LYS 125  10.264  -9.371 -39.124
  968    HE3  LYS 125           3HE      LYS 125   9.722  -8.420 -40.527
  969    HZ1  LYS 125           3HZ      LYS 125   9.309  -6.583 -39.038
  970    HZ2  LYS 125           1HZ      LYS 125   9.811  -7.464 -37.737
  971    HZ3  LYS 125           2HZ      LYS 125  10.882  -7.060 -38.923
  972    H    ASP 126           H        ASP 126   6.008  -8.367 -41.977
  973    HA   ASP 126           HA       ASP 126   4.703  -9.278 -44.338
  974    HB2  ASP 126           2HB      ASP 126   5.666  -6.992 -43.979
  975    HB3  ASP 126           3HB      ASP 126   7.277  -7.743 -44.010
  976    H    LEU 127           H        LEU 127   7.649 -10.334 -42.887
  977    HA   LEU 127           HA       LEU 127   9.031 -11.605 -45.000
  978    HB2  LEU 127           2HB      LEU 127   9.804 -11.084 -42.701
  979    HB3  LEU 127           3HB      LEU 127   8.812 -12.429 -42.093
  980    HG   LEU 127           HG       LEU 127  10.186 -14.042 -43.331
  981   HD11  LEU 127          1HD1      LEU 127  11.890 -11.646 -44.169
  982   HD12  LEU 127          2HD1      LEU 127  12.288 -13.357 -44.458
  983   HD13  LEU 127          3HD1      LEU 127  10.880 -12.629 -45.256
  984   HD21  LEU 127          3HD2      LEU 127  11.840 -12.090 -41.676
  985   HD22  LEU 127          1HD2      LEU 127  10.855 -13.434 -41.049
  986   HD23  LEU 127          2HD2      LEU 127  12.292 -13.772 -42.039
  987    H    ILE 128           H        ILE 128   6.006 -12.733 -43.597
  988    HA   ILE 128           HA       ILE 128   6.216 -15.496 -44.483
  989    HB   ILE 128           HB       ILE 128   3.760 -15.453 -44.484
  990   HG12  ILE 128          2HG1      ILE 128   3.922 -12.481 -44.301
  991   HG13  ILE 128          3HG1      ILE 128   3.370 -13.466 -45.672
  992   HG21  ILE 128          1HG2      ILE 128   4.900 -13.828 -42.154
  993   HG22  ILE 128          2HG2      ILE 128   3.363 -14.718 -42.137
  994   HG23  ILE 128          3HG2      ILE 128   4.893 -15.602 -42.279
  995   HD11  ILE 128          3HD1      ILE 128   1.482 -14.316 -44.308
  996   HD12  ILE 128          1HD1      ILE 128   2.029 -13.325 -42.935
  997   HD13  ILE 128          2HD1      ILE 128   1.448 -12.540 -44.416
  998    H    LYS 129           H        LYS 129   5.917 -12.645 -46.469
  999    HA   LYS 129           HA       LYS 129   4.935 -14.019 -48.788
 1000    HB2  LYS 129           2HB      LYS 129   6.678 -11.557 -48.438
 1001    HB3  LYS 129           3HB      LYS 129   6.044 -12.107 -50.006
 1002    HG2  LYS 129           2HG      LYS 129   3.750 -11.796 -49.264
 1003    HG3  LYS 129           3HG      LYS 129   4.283 -11.454 -47.602
 1004    HD2  LYS 129           2HD      LYS 129   5.464  -9.427 -48.397
 1005    HD3  LYS 129           3HD      LYS 129   4.919  -9.763 -50.058
 1006    HE2  LYS 129           2HE      LYS 129   2.632  -9.397 -49.494
 1007    HE3  LYS 129           3HE      LYS 129   2.973  -9.460 -47.749
 1008    HZ1  LYS 129           3HZ      LYS 129   4.205  -7.416 -47.968
 1009    HZ2  LYS 129           1HZ      LYS 129   3.890  -7.354 -49.592
 1010    HZ3  LYS 129           2HZ      LYS 129   2.657  -7.210 -48.504
 1011    H    LYS 130           H        LYS 130   5.910 -15.292 -50.282
 1012    HA   LYS 130           HA       LYS 130   8.512 -16.355 -49.958
 1013    HB2  LYS 130           2HB      LYS 130   8.298 -17.242 -52.176
 1014    HB3  LYS 130           3HB      LYS 130   6.762 -17.426 -51.300
 1015    HG2  LYS 130           2HG      LYS 130   5.835 -15.472 -52.538
 1016    HG3  LYS 130           3HG      LYS 130   7.367 -15.320 -53.430
 1017    HD2  LYS 130           2HD      LYS 130   7.056 -17.639 -54.290
 1018    HD3  LYS 130           3HD      LYS 130   5.483 -17.711 -53.464
 1019    HE2  LYS 130           2HE      LYS 130   6.218 -15.667 -55.592
 1020    HE3  LYS 130           3HE      LYS 130   5.367 -17.193 -55.931
 1021    HZ1  LYS 130           3HZ      LYS 130   3.588 -16.443 -54.501
 1022    HZ2  LYS 130           1HZ      LYS 130   4.377 -15.029 -54.185
 1023    HZ3  LYS 130           2HZ      LYS 130   3.840 -15.353 -55.712
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1   7.334 -25.103  -4.638
    2    H2   MET   1           H2       MET   1   7.143 -26.659  -5.134
    3    H3   MET   1           H3       MET   1   8.674 -25.998  -4.856
    4    HA   MET   1           HA       MET   1   7.067 -27.413  -3.142
    5    HB2  MET   1           2HB      MET   1   9.550 -27.522  -3.331
    6    HB3  MET   1           3HB      MET   1   9.653 -25.902  -2.622
    7    HG2  MET   1           2HG      MET   1  10.064 -27.623  -0.941
    8    HG3  MET   1           3HG      MET   1   8.603 -26.700  -0.567
    9    HE1  MET   1           3HE      MET   1   9.398 -29.439   0.869
   10    HE2  MET   1           1HE      MET   1   7.929 -28.509   1.250
   11    HE3  MET   1           2HE      MET   1   7.818 -30.253   0.923
   12    H    ALA   2           H        ALA   2   8.397 -24.117  -2.375
   13    HA   ALA   2           HA       ALA   2   6.409 -23.626  -0.361
   14    HB1  ALA   2           1HB      ALA   2   8.104 -21.702  -2.022
   15    HB2  ALA   2           2HB      ALA   2   7.232 -21.304  -0.521
   16    HB3  ALA   2           3HB      ALA   2   8.580 -22.455  -0.481
   17    H    ALA   3           H        ALA   3   6.571 -22.878  -3.820
   18    HA   ALA   3           HA       ALA   3   3.603 -22.887  -3.987
   19    HB1  ALA   3           1HB      ALA   3   5.389 -20.684  -5.121
   20    HB2  ALA   3           2HB      ALA   3   3.659 -20.895  -5.476
   21    HB3  ALA   3           3HB      ALA   3   4.182 -20.492  -3.832
   22    H    LYS   4           H        LYS   4   3.120 -22.925  -6.526
   23    HA   LYS   4           HA       LYS   4   4.793 -24.949  -7.759
   24    HB2  LYS   4           2HB      LYS   4   3.275 -24.779  -9.649
   25    HB3  LYS   4           3HB      LYS   4   2.424 -24.973  -8.111
   26    HG2  LYS   4           2HG      LYS   4   1.864 -22.541  -8.118
   27    HG3  LYS   4           3HG      LYS   4   2.693 -22.370  -9.679
   28    HD2  LYS   4           2HD      LYS   4   1.121 -23.935 -10.728
   29    HD3  LYS   4           3HD      LYS   4   0.330 -24.229  -9.160
   30    HE2  LYS   4           2HE      LYS   4  -0.306 -21.830  -9.043
   31    HE3  LYS   4           3HE      LYS   4   0.451 -21.565 -10.633
   32    HZ1  LYS   4           3HZ      LYS   4  -1.165 -23.078 -11.573
   33    HZ2  LYS   4           1HZ      LYS   4  -1.865 -23.322 -10.097
   34    HZ3  LYS   4           2HZ      LYS   4  -1.933 -21.847 -10.807
   35    H    PHE   5           H        PHE   5   5.550 -21.820  -7.394
   36    HA   PHE   5           HA       PHE   5   7.625 -22.082  -9.497
   37    HB2  PHE   5           2HB      PHE   5   5.848 -19.690  -8.923
   38    HB3  PHE   5           3HB      PHE   5   7.522 -19.451  -9.426
   39    HD1  PHE   5           HD2      PHE   5   4.285 -20.985 -10.458
   40    HD2  PHE   5           HD1      PHE   5   8.171 -19.602 -11.691
   41    HE1  PHE   5           HE2      PHE   5   3.679 -21.404 -12.834
   42    HE2  PHE   5           HE1      PHE   5   7.552 -19.978 -14.068
   43    HZ   PHE   5           HZ       PHE   5   5.318 -20.916 -14.637
   44    H    GLU   6           H        GLU   6   9.583 -20.749  -8.798
   45    HA   GLU   6           HA       GLU   6   9.891 -20.568  -5.857
   46    HB2  GLU   6           2HB      GLU   6  11.473 -22.309  -7.771
   47    HB3  GLU   6           3HB      GLU   6  12.087 -21.816  -6.189
   48    HG2  GLU   6           2HG      GLU   6   9.581 -23.478  -6.689
   49    HG3  GLU   6           3HG      GLU   6  11.155 -24.059  -6.141
   50    H    VAL   7           H        VAL   7  11.842 -19.488  -5.255
   51    HA   VAL   7           HA       VAL   7  12.295 -17.034  -6.539
   52    HB   VAL   7           HB       VAL   7  14.207 -18.512  -4.680
   53   HG11  VAL   7          1HG1      VAL   7  13.709 -15.539  -5.162
   54   HG12  VAL   7          2HG1      VAL   7  14.837 -16.217  -3.968
   55   HG13  VAL   7          3HG1      VAL   7  15.133 -16.447  -5.699
   56   HG21  VAL   7          3HG2      VAL   7  11.813 -16.775  -3.989
   57   HG22  VAL   7          1HG2      VAL   7  11.943 -18.513  -3.698
   58   HG23  VAL   7          2HG2      VAL   7  13.006 -17.406  -2.825
   59    H    GLY   8           H        GLY   8  13.426 -16.343  -8.133
   60    HA2  GLY   8           2HA      GLY   8  15.360 -16.185  -9.486
   61    HA3  GLY   8           3HA      GLY   8  15.728 -17.892  -9.177
   62    H    SER   9           H        SER   9  12.667 -18.442  -9.759
   63    HA   SER   9           HA       SER   9  12.856 -18.986 -12.557
   64    HB2  SER   9           2HB      SER   9  10.310 -18.590 -10.950
   65    HB3  SER   9           3HB      SER   9  10.542 -19.578 -12.409
   66    HG   SER   9           HG       SER   9  10.529 -20.835 -10.469
   67    H    VAL  10           H        VAL  10  11.626 -17.988 -14.306
   68    HA   VAL  10           HA       VAL  10  10.616 -15.231 -13.775
   69    HB   VAL  10           HB       VAL  10  11.952 -16.248 -16.313
   70   HG11  VAL  10          1HG1      VAL  10  11.006 -13.448 -15.527
   71   HG12  VAL  10          2HG1      VAL  10  11.867 -13.872 -17.022
   72   HG13  VAL  10          3HG1      VAL  10  10.236 -14.500 -16.734
   73   HG21  VAL  10          3HG2      VAL  10  13.006 -14.288 -14.231
   74   HG22  VAL  10          1HG2      VAL  10  13.635 -15.922 -14.539
   75   HG23  VAL  10          2HG2      VAL  10  13.779 -14.674 -15.784
   76    H    TYR  11           H        TYR  11   8.652 -14.808 -14.522
   77    HA   TYR  11           HA       TYR  11   7.068 -16.872 -15.954
   78    HB2  TYR  11           2HB      TYR  11   7.081 -17.087 -13.421
   79    HB3  TYR  11           3HB      TYR  11   6.218 -15.544 -13.371
   80    HD1  TYR  11           HD2      TYR  11   5.111 -17.648 -16.170
   81    HD2  TYR  11           HD1      TYR  11   4.702 -17.001 -11.924
   82    HE1  TYR  11           HE2      TYR  11   2.973 -18.888 -16.195
   83    HE2  TYR  11           HE1      TYR  11   2.549 -18.245 -11.944
   84    HH   TYR  11           HH       TYR  11   1.066 -19.453 -13.210
   85    H    THR  12           H        THR  12   4.654 -15.623 -15.882
   86    HA   THR  12           HA       THR  12   5.045 -12.766 -16.584
   87    HB   THR  12           HB       THR  12   3.553 -14.872 -18.195
   88    HG1  THR  12           1HG      THR  12   5.110 -14.320 -19.785
   89   HG21  THR  12          1HG2      THR  12   3.936 -11.901 -18.763
   90   HG22  THR  12          2HG2      THR  12   3.166 -13.077 -19.853
   91   HG23  THR  12          3HG2      THR  12   2.407 -12.675 -18.309
   92    H    GLY  13           H        GLY  13   3.176 -11.501 -16.150
   93    HA2  GLY  13           2HA      GLY  13   0.728 -12.770 -15.195
   94    HA3  GLY  13           3HA      GLY  13   1.637 -11.893 -13.953
   95    H    LYS  14           H        LYS  14  -0.665 -10.870 -14.231
   96    HA   LYS  14           HA       LYS  14  -0.553  -8.583 -16.165
   97    HB2  LYS  14           2HB      LYS  14  -2.228 -10.517 -16.514
   98    HB3  LYS  14           3HB      LYS  14  -3.059  -9.893 -15.086
   99    HG2  LYS  14           2HG      LYS  14  -2.481  -8.325 -17.625
  100    HG3  LYS  14           3HG      LYS  14  -3.997  -9.172 -17.296
  101    HD2  LYS  14           2HD      LYS  14  -2.890  -6.748 -15.858
  102    HD3  LYS  14           3HD      LYS  14  -4.290  -6.804 -16.920
  103    HE2  LYS  14           2HE      LYS  14  -4.093  -8.241 -14.239
  104    HE3  LYS  14           3HE      LYS  14  -4.842  -6.652 -14.469
  105    HZ1  LYS  14           3HZ      LYS  14  -6.439  -7.683 -15.946
  106    HZ2  LYS  14           1HZ      LYS  14  -5.748  -9.166 -15.747
  107    HZ3  LYS  14           2HZ      LYS  14  -6.487  -8.418 -14.477
  108    H    VAL  15           H        VAL  15  -0.432  -6.665 -15.167
  109    HA   VAL  15           HA       VAL  15  -0.186  -6.493 -12.319
  110    HB   VAL  15           HB       VAL  15  -0.584  -4.185 -14.242
  111   HG11  VAL  15          1HG1      VAL  15   1.062  -4.517 -11.687
  112   HG12  VAL  15          2HG1      VAL  15   0.960  -3.037 -12.665
  113   HG13  VAL  15          3HG1      VAL  15  -0.477  -3.638 -11.816
  114   HG21  VAL  15          3HG2      VAL  15   2.012  -5.690 -13.759
  115   HG22  VAL  15          1HG2      VAL  15   1.100  -5.617 -15.279
  116   HG23  VAL  15          2HG2      VAL  15   1.828  -4.158 -14.649
  117    H    THR  16           H        THR  16  -1.657  -6.217 -10.810
  118    HA   THR  16           HA       THR  16  -4.486  -5.696 -11.608
  119    HB   THR  16           HB       THR  16  -4.779  -6.938  -9.292
  120    HG1  THR  16           1HG      THR  16  -3.112  -8.479  -9.001
  121   HG21  THR  16          1HG2      THR  16  -3.882  -8.400 -11.816
  122   HG22  THR  16          2HG2      THR  16  -4.828  -9.096 -10.478
  123   HG23  THR  16          3HG2      THR  16  -5.529  -7.819 -11.478
  124    H    GLY  17           H        GLY  17  -1.909  -4.250  -9.743
  125    HA2  GLY  17           2HA      GLY  17  -3.575  -1.978  -9.294
  126    HA3  GLY  17           3HA      GLY  17  -3.409  -2.895  -7.785
  127    H    LEU  18           H        LEU  18  -2.453  -0.410  -7.739
  128    HA   LEU  18           HA       LEU  18   0.508  -0.720  -7.713
  129    HB2  LEU  18           2HB      LEU  18  -1.072   1.707  -8.595
  130    HB3  LEU  18           3HB      LEU  18   0.675   1.689  -8.326
  131    HG   LEU  18           HG       LEU  18  -0.799   0.117 -10.482
  132   HD11  LEU  18          1HD1      LEU  18   1.015   2.561 -10.680
  133   HD12  LEU  18          2HD1      LEU  18   0.328   1.671 -12.053
  134   HD13  LEU  18          3HD1      LEU  18  -0.739   2.547 -10.938
  135   HD21  LEU  18          3HD2      LEU  18   2.186   0.392 -10.010
  136   HD22  LEU  18          1HD2      LEU  18   1.205  -1.075  -9.774
  137   HD23  LEU  18          2HD2      LEU  18   1.409  -0.408 -11.397
  138    H    GLN  19           H        GLN  19   1.493   0.481  -6.102
  139    HA   GLN  19           HA       GLN  19  -0.087   1.807  -3.982
  140    HB2  GLN  19           2HB      GLN  19   1.939  -0.395  -3.465
  141    HB3  GLN  19           3HB      GLN  19   1.042   0.532  -2.255
  142    HG2  GLN  19           2HG      GLN  19  -1.086  -0.563  -3.034
  143    HG3  GLN  19           3HG      GLN  19  -0.135  -1.497  -4.202
  144   HE21  GLN  19          2HE2      GLN  19  -1.270  -1.373  -0.945
  145   HE22  GLN  19          1HE2      GLN  19  -0.312  -2.720  -0.347
  146    H    ALA  20           H        ALA  20   1.451   3.123  -2.638
  147    HA   ALA  20           HA       ALA  20   3.541   4.334  -4.093
  148    HB1  ALA  20           1HB      ALA  20   3.040   4.351  -1.085
  149    HB2  ALA  20           2HB      ALA  20   4.014   5.528  -1.995
  150    HB3  ALA  20           3HB      ALA  20   2.265   5.427  -2.279
  151    H    TYR  21           H        TYR  21   3.695   1.293  -2.623
  152    HA   TYR  21           HA       TYR  21   6.676   1.339  -2.689
  153    HB2  TYR  21           2HB      TYR  21   6.702  -0.164  -0.805
  154    HB3  TYR  21           3HB      TYR  21   5.967   1.377  -0.373
  155    HD1  TYR  21           HD2      TYR  21   5.331  -2.242  -0.934
  156    HD2  TYR  21           HD1      TYR  21   3.603   1.521   0.276
  157    HE1  TYR  21           HE2      TYR  21   3.405  -3.450   0.061
  158    HE2  TYR  21           HE1      TYR  21   1.667   0.320   1.260
  159    HH   TYR  21           HH       TYR  21   0.743  -1.751   1.753
  160    H    GLY  22           H        GLY  22   4.159   0.141  -4.470
  161    HA2  GLY  22           2HA      GLY  22   5.790  -1.593  -5.862
  162    HA3  GLY  22           3HA      GLY  22   5.037  -2.599  -4.619
  163    H    ALA  23           H        ALA  23   4.487  -3.474  -6.952
  164    HA   ALA  23           HA       ALA  23   1.745  -2.529  -7.734
  165    HB1  ALA  23           1HB      ALA  23   3.981  -3.595  -9.508
  166    HB2  ALA  23           2HB      ALA  23   2.324  -3.230 -10.030
  167    HB3  ALA  23           3HB      ALA  23   3.386  -1.922  -9.473
  168    H    PHE  24           H        PHE  24   0.234  -4.072  -7.568
  169    HA   PHE  24           HA       PHE  24   0.977  -6.818  -6.878
  170    HB2  PHE  24           2HB      PHE  24  -1.681  -5.459  -7.453
  171    HB3  PHE  24           3HB      PHE  24  -1.542  -7.147  -6.962
  172    HD1  PHE  24           HD1      PHE  24   0.164  -7.350  -4.744
  173    HD2  PHE  24           HD2      PHE  24  -2.453  -4.076  -5.774
  174    HE1  PHE  24           HE1      PHE  24   0.026  -6.700  -2.351
  175    HE2  PHE  24           HE2      PHE  24  -2.612  -3.454  -3.377
  176    HZ   PHE  24           HZ       PHE  24  -1.388  -4.776  -1.661
  177    H    VAL  25           H        VAL  25   0.827  -8.600  -8.253
  178    HA   VAL  25           HA       VAL  25  -0.114  -8.199 -11.052
  179    HB   VAL  25           HB       VAL  25   2.485  -9.576 -10.254
  180   HG11  VAL  25          1HG1      VAL  25   1.332  -8.847 -12.983
  181   HG12  VAL  25          2HG1      VAL  25   2.910  -9.602 -12.699
  182   HG13  VAL  25          3HG1      VAL  25   1.427 -10.485 -12.294
  183   HG21  VAL  25          3HG2      VAL  25   2.160  -6.874 -11.609
  184   HG22  VAL  25          1HG2      VAL  25   2.796  -7.161  -9.975
  185   HG23  VAL  25          2HG2      VAL  25   3.684  -7.757 -11.381
  186    H    ALA  26           H        ALA  26  -1.632  -9.669 -11.430
  187    HA   ALA  26           HA       ALA  26  -1.888 -12.187  -9.901
  188    HB1  ALA  26           1HB      ALA  26  -3.282 -11.092 -12.383
  189    HB2  ALA  26           2HB      ALA  26  -3.725 -12.581 -11.511
  190    HB3  ALA  26           3HB      ALA  26  -3.885 -11.011 -10.707
  191    H    LEU  27           H        LEU  27  -0.606 -13.876 -10.313
  192    HA   LEU  27           HA       LEU  27   0.988 -13.958 -12.820
  193    HB2  LEU  27           2HB      LEU  27   0.972 -15.593 -10.271
  194    HB3  LEU  27           3HB      LEU  27   2.063 -15.900 -11.622
  195    HG   LEU  27           HG       LEU  27   1.997 -13.184 -10.256
  196   HD11  LEU  27          1HD1      LEU  27   3.698 -15.589  -9.473
  197   HD12  LEU  27          2HD1      LEU  27   3.863 -13.942  -8.832
  198   HD13  LEU  27          3HD1      LEU  27   2.401 -14.860  -8.497
  199   HD21  LEU  27          3HD2      LEU  27   4.167 -14.652 -11.805
  200   HD22  LEU  27          1HD2      LEU  27   3.163 -13.320 -12.415
  201   HD23  LEU  27          2HD2      LEU  27   4.299 -13.034 -11.080
  202    H    ASP  28           H        ASP  28  -1.624 -15.605 -11.137
  203    HA   ASP  28           HA       ASP  28  -2.477 -17.142 -13.470
  204    HB2  ASP  28           2HB      ASP  28  -0.744 -18.597 -12.633
  205    HB3  ASP  28           3HB      ASP  28  -1.355 -18.489 -10.977
  206    H    GLU  29           H        GLU  29  -4.553 -18.287 -12.835
  207    HA   GLU  29           HA       GLU  29  -6.395 -16.827 -11.278
  208    HB2  GLU  29           2HB      GLU  29  -6.247 -19.752 -12.068
  209    HB3  GLU  29           3HB      GLU  29  -7.669 -19.011 -11.313
  210    HG2  GLU  29           2HG      GLU  29  -6.433 -18.149 -13.958
  211    HG3  GLU  29           3HG      GLU  29  -7.846 -19.194 -13.807
  212    H    GLU  30           H        GLU  30  -3.957 -19.112 -10.197
  213    HA   GLU  30           HA       GLU  30  -4.909 -18.804  -7.381
  214    HB2  GLU  30           2HB      GLU  30  -3.863 -21.322  -8.725
  215    HB3  GLU  30           3HB      GLU  30  -4.249 -21.150  -7.002
  216    HG2  GLU  30           2HG      GLU  30  -6.638 -20.649  -7.647
  217    HG3  GLU  30           3HG      GLU  30  -6.200 -21.002  -9.326
  218    H    THR  31           H        THR  31  -2.713 -17.397  -9.036
  219    HA   THR  31           HA       THR  31  -0.784 -17.544  -6.800
  220    HB   THR  31           HB       THR  31   0.244 -17.739  -9.651
  221    HG1  THR  31           1HG      THR  31   0.651 -19.948  -9.177
  222   HG21  THR  31          1HG2      THR  31   1.536 -18.393  -6.963
  223   HG22  THR  31          2HG2      THR  31   2.310 -18.548  -8.557
  224   HG23  THR  31          3HG2      THR  31   1.855 -16.951  -7.947
  225    H    GLN  32           H        GLN  32   0.216 -15.535  -6.420
  226    HA   GLN  32           HA       GLN  32  -0.350 -13.219  -8.171
  227    HB2  GLN  32           2HB      GLN  32  -2.402 -13.939  -6.776
  228    HB3  GLN  32           3HB      GLN  32  -1.469 -13.437  -5.362
  229    HG2  GLN  32           2HG      GLN  32  -2.214 -11.584  -7.673
  230    HG3  GLN  32           3HG      GLN  32  -3.173 -11.788  -6.204
  231   HE21  GLN  32          2HE2      GLN  32  -0.919  -9.840  -7.642
  232   HE22  GLN  32          1HE2      GLN  32  -0.194  -9.136  -6.214
  233    H    GLY  33           H        GLY  33   1.198 -11.546  -7.663
  234    HA2  GLY  33           2HA      GLY  33   2.646 -11.751  -5.107
  235    HA3  GLY  33           3HA      GLY  33   3.603 -11.923  -6.589
  236    H    LEU  34           H        LEU  34   4.571 -10.019  -5.289
  237    HA   LEU  34           HA       LEU  34   3.291  -7.405  -6.019
  238    HB2  LEU  34           2HB      LEU  34   2.791  -7.842  -3.733
  239    HB3  LEU  34           3HB      LEU  34   4.447  -8.380  -3.393
  240    HG   LEU  34           HG       LEU  34   5.283  -6.074  -3.717
  241   HD11  LEU  34          1HD1      LEU  34   2.341  -5.297  -4.006
  242   HD12  LEU  34          2HD1      LEU  34   3.706  -4.178  -3.862
  243   HD13  LEU  34          3HD1      LEU  34   3.573  -5.211  -5.284
  244   HD21  LEU  34          3HD2      LEU  34   2.967  -6.290  -1.751
  245   HD22  LEU  34          1HD2      LEU  34   4.640  -6.818  -1.470
  246   HD23  LEU  34          2HD2      LEU  34   4.277  -5.094  -1.676
  247    H    VAL  35           H        VAL  35   4.648  -6.570  -7.529
  248    HA   VAL  35           HA       VAL  35   7.550  -6.850  -7.404
  249    HB   VAL  35           HB       VAL  35   5.821  -4.816  -8.879
  250   HG11  VAL  35          1HG1      VAL  35   8.719  -5.676  -9.309
  251   HG12  VAL  35          2HG1      VAL  35   7.814  -4.540 -10.331
  252   HG13  VAL  35          3HG1      VAL  35   8.190  -4.118  -8.656
  253   HG21  VAL  35          3HG2      VAL  35   6.979  -7.419  -9.933
  254   HG22  VAL  35          1HG2      VAL  35   5.255  -7.076  -9.640
  255   HG23  VAL  35          2HG2      VAL  35   6.138  -6.184 -10.885
  256    H    HIS  36           H        HIS  36   8.762  -5.775  -5.796
  257    HA   HIS  36           HA       HIS  36   7.568  -3.575  -4.292
  258    HB2  HIS  36           2HB      HIS  36   9.137  -5.177  -3.277
  259    HB3  HIS  36           3HB      HIS  36  10.432  -4.641  -4.364
  260    HD1  HIS  36           HD1      HIS  36   8.082  -2.282  -2.343
  261    HD2  HIS  36           HD2      HIS  36  12.111  -3.559  -2.598
  262    HE1  HIS  36           HE1      HIS  36   9.384  -0.856  -0.752
  263    H    ILE  37           H        ILE  37   8.060  -1.381  -4.503
  264    HA   ILE  37           HA       ILE  37   8.431  -0.385  -7.110
  265    HB   ILE  37           HB       ILE  37   7.307   0.792  -5.214
  266   HG12  ILE  37          2HG1      ILE  37   9.386   2.360  -6.715
  267   HG13  ILE  37          3HG1      ILE  37   7.841   1.791  -7.367
  268   HG21  ILE  37          1HG2      ILE  37  10.165   1.496  -4.382
  269   HG22  ILE  37          2HG2      ILE  37   8.696   2.210  -3.710
  270   HG23  ILE  37          3HG2      ILE  37   9.027   0.498  -3.448
  271   HD11  ILE  37          3HD1      ILE  37   6.623   3.188  -5.717
  272   HD12  ILE  37          1HD1      ILE  37   8.170   3.779  -5.075
  273   HD13  ILE  37          2HD1      ILE  37   7.703   4.170  -6.733
  274    H    SER  38           H        SER  38  11.034  -0.793  -4.725
  275    HA   SER  38           HA       SER  38  13.031   0.454  -6.335
  276    HB2  SER  38           2HB      SER  38  13.375  -1.788  -4.313
  277    HB3  SER  38           3HB      SER  38  14.569  -0.557  -4.787
  278    HG   SER  38           HG       SER  38  13.485  -0.054  -2.805
  279    H    GLU  39           H        GLU  39  11.456  -2.547  -6.771
  280    HA   GLU  39           HA       GLU  39  13.530  -3.532  -8.644
  281    HB2  GLU  39           2HB      GLU  39  11.470  -4.819  -6.893
  282    HB3  GLU  39           3HB      GLU  39  11.905  -5.614  -8.401
  283    HG2  GLU  39           2HG      GLU  39  13.244  -6.503  -6.652
  284    HG3  GLU  39           3HG      GLU  39  14.294  -5.608  -7.747
  285    H    VAL  40           H        VAL  40  11.003  -1.498  -8.932
  286    HA   VAL  40           HA       VAL  40   9.797  -2.652 -11.321
  287    HB   VAL  40           HB       VAL  40   9.795   0.152 -10.158
  288   HG11  VAL  40          1HG1      VAL  40   8.009  -0.999 -12.347
  289   HG12  VAL  40          2HG1      VAL  40   7.818   0.592 -11.574
  290   HG13  VAL  40          3HG1      VAL  40   9.242   0.255 -12.572
  291   HG21  VAL  40          3HG2      VAL  40   7.719  -2.094 -10.108
  292   HG22  VAL  40          1HG2      VAL  40   8.697  -1.565  -8.743
  293   HG23  VAL  40          2HG2      VAL  40   7.493  -0.468  -9.432
  294    H    THR  41           H        THR  41  12.593  -0.500 -10.737
  295    HA   THR  41           HA       THR  41  13.601  -0.948 -13.453
  296    HB   THR  41           HB       THR  41  11.974   0.757 -13.962
  297    HG1  THR  41           1HG      THR  41  13.387   2.413 -14.650
  298   HG21  THR  41          1HG2      THR  41  13.217   2.468 -11.765
  299   HG22  THR  41          2HG2      THR  41  11.985   3.005 -12.925
  300   HG23  THR  41          3HG2      THR  41  11.591   1.763 -11.730
  301    H    HIS  42           H        HIS  42  15.751  -0.057 -13.720
  302    HA   HIS  42           HA       HIS  42  17.309   0.194 -11.261
  303    HB2  HIS  42           2HB      HIS  42  17.973   0.554 -14.215
  304    HB3  HIS  42           3HB      HIS  42  19.154   0.814 -12.922
  305    HD1  HIS  42           HD1      HIS  42  16.870  -2.068 -14.100
  306    HD2  HIS  42           HD2      HIS  42  20.628  -1.316 -12.346
  307    HE1  HIS  42           HE1      HIS  42  17.958  -4.312 -13.801
  308    H    GLY  43           H        GLY  43  15.532   2.382 -13.330
  309    HA2  GLY  43           2HA      GLY  43  17.093   4.755 -12.837
  310    HA3  GLY  43           3HA      GLY  43  15.449   4.677 -13.496
  311    H    PHE  44           H        PHE  44  16.247   6.691 -11.689
  312    HA   PHE  44           HA       PHE  44  15.230   6.232  -9.054
  313    HB2  PHE  44           2HB      PHE  44  16.511   8.268  -9.597
  314    HB3  PHE  44           3HB      PHE  44  15.291   8.738 -10.788
  315    HD1  PHE  44           HD2      PHE  44  15.814   8.128  -7.127
  316    HD2  PHE  44           HD1      PHE  44  13.413  10.024 -10.171
  317    HE1  PHE  44           HE2      PHE  44  14.555   9.363  -5.373
  318    HE2  PHE  44           HE1      PHE  44  12.173  11.271  -8.411
  319    HZ   PHE  44           HZ       PHE  44  12.736  10.933  -6.016
  320    H    VAL  45           H        VAL  45  13.206   5.566  -8.571
  321    HA   VAL  45           HA       VAL  45  10.976   5.812 -10.393
  322    HB   VAL  45           HB       VAL  45   9.692   4.995  -8.290
  323   HG11  VAL  45          1HG1      VAL  45  11.952   3.336  -9.503
  324   HG12  VAL  45          2HG1      VAL  45  10.527   2.685  -8.674
  325   HG13  VAL  45          3HG1      VAL  45  10.334   3.565 -10.198
  326   HG21  VAL  45          3HG2      VAL  45  12.517   4.490  -7.268
  327   HG22  VAL  45          1HG2      VAL  45  11.318   5.597  -6.554
  328   HG23  VAL  45          2HG2      VAL  45  11.015   3.855  -6.581
  329    H    LYS  46           H        LYS  46  10.442   7.784 -10.985
  330    HA   LYS  46           HA       LYS  46  10.176  10.052  -9.256
  331    HB2  LYS  46           2HB      LYS  46   8.641   9.382 -11.806
  332    HB3  LYS  46           3HB      LYS  46   8.782  10.982 -11.052
  333    HG2  LYS  46           2HG      LYS  46  11.266  10.888 -11.421
  334    HG3  LYS  46           3HG      LYS  46  11.051   9.345 -12.274
  335    HD2  LYS  46           2HD      LYS  46   9.597  10.461 -13.944
  336    HD3  LYS  46           3HD      LYS  46   9.806  12.008 -13.091
  337    HE2  LYS  46           2HE      LYS  46  12.253  11.883 -13.467
  338    HE3  LYS  46           3HE      LYS  46  12.042  10.338 -14.318
  339    HZ1  LYS  46           3HZ      LYS  46  10.724  11.502 -15.965
  340    HZ2  LYS  46           1HZ      LYS  46  10.919  12.928 -15.177
  341    HZ3  LYS  46           2HZ      LYS  46  12.223  12.180 -15.851
  342    H    ASP  47           H        ASP  47   7.782   7.768 -10.496
  343    HA   ASP  47           HA       ASP  47   6.512   7.362  -7.931
  344    HB2  ASP  47           2HB      ASP  47   5.227   9.355  -8.596
  345    HB3  ASP  47           3HB      ASP  47   4.928   8.645 -10.194
  346    H    ILE  48           H        ILE  48   5.446   5.240  -8.130
  347    HA   ILE  48           HA       ILE  48   6.464   3.502 -10.127
  348    HB   ILE  48           HB       ILE  48   5.618   2.870  -7.856
  349   HG12  ILE  48          2HG1      ILE  48   4.407   1.263 -10.094
  350   HG13  ILE  48          3HG1      ILE  48   6.131   1.301  -9.676
  351   HG21  ILE  48          1HG2      ILE  48   2.856   3.121  -9.136
  352   HG22  ILE  48          2HG2      ILE  48   3.192   2.399  -7.559
  353   HG23  ILE  48          3HG2      ILE  48   3.481   4.117  -7.811
  354   HD11  ILE  48          3HD1      ILE  48   5.615   0.456  -7.404
  355   HD12  ILE  48          1HD1      ILE  48   3.889   0.403  -7.821
  356   HD13  ILE  48          2HD1      ILE  48   5.032  -0.654  -8.658
  357    H    ASN  49           H        ASN  49   3.396   5.311 -10.372
  358    HA   ASN  49           HA       ASN  49   2.623   3.821 -12.712
  359    HB2  ASN  49           2HB      ASN  49   0.750   5.081 -12.705
  360    HB3  ASN  49           3HB      ASN  49   1.293   5.531 -11.082
  361   HD21  ASN  49          2HD2      ASN  49   2.609   7.581 -10.908
  362   HD22  ASN  49          1HD2      ASN  49   2.233   8.876 -12.035
  363    H    GLU  50           H        GLU  50   5.089   6.192 -12.401
  364    HA   GLU  50           HA       GLU  50   5.043   6.814 -15.282
  365    HB2  GLU  50           2HB      GLU  50   7.000   7.562 -13.061
  366    HB3  GLU  50           3HB      GLU  50   7.079   8.132 -14.737
  367    HG2  GLU  50           2HG      GLU  50   4.750   9.025 -14.467
  368    HG3  GLU  50           3HG      GLU  50   4.842   8.684 -12.732
  369    H    HIS  51           H        HIS  51   6.027   4.141 -13.529
  370    HA   HIS  51           HA       HIS  51   8.034   3.378 -15.614
  371    HB2  HIS  51           2HB      HIS  51   8.285   2.884 -12.633
  372    HB3  HIS  51           3HB      HIS  51   9.513   2.469 -13.841
  373    HD1  HIS  51           HD1      HIS  51  10.594   4.798 -15.113
  374    HD2  HIS  51           HD2      HIS  51   8.526   5.227 -11.465
  375    HE1  HIS  51           HE1      HIS  51  11.180   7.069 -14.226
  376    H    LEU  52           H        LEU  52   5.177   2.531 -14.057
  377    HA   LEU  52           HA       LEU  52   5.176  -0.064 -15.425
  378    HB2  LEU  52           2HB      LEU  52   5.587   0.097 -12.624
  379    HB3  LEU  52           3HB      LEU  52   3.875  -0.284 -12.817
  380    HG   LEU  52           HG       LEU  52   6.228  -1.888 -13.923
  381   HD11  LEU  52          1HD1      LEU  52   4.127  -2.503 -11.807
  382   HD12  LEU  52          2HD1      LEU  52   5.395  -3.620 -12.352
  383   HD13  LEU  52          3HD1      LEU  52   5.834  -2.129 -11.495
  384   HD21  LEU  52          3HD2      LEU  52   3.262  -2.504 -14.156
  385   HD22  LEU  52          1HD2      LEU  52   4.336  -2.044 -15.501
  386   HD23  LEU  52          2HD2      LEU  52   4.601  -3.562 -14.648
  387    H    SER  53           H        SER  53   2.793  -0.892 -15.340
  388    HA   SER  53           HA       SER  53   0.797   1.309 -15.188
  389    HB2  SER  53           2HB      SER  53   1.212  -0.538 -17.572
  390    HB3  SER  53           3HB      SER  53  -0.048   0.701 -17.397
  391    HG   SER  53           HG       SER  53   1.753   1.436 -18.638
  392    H    VAL  54           H        VAL  54  -1.014   0.527 -14.146
  393    HA   VAL  54           HA       VAL  54  -1.500  -2.314 -13.694
  394    HB   VAL  54           HB       VAL  54  -2.185  -0.520 -12.136
  395   HG11  VAL  54          1HG1      VAL  54  -4.243   0.224 -14.258
  396   HG12  VAL  54          2HG1      VAL  54  -4.212   0.831 -12.591
  397   HG13  VAL  54          3HG1      VAL  54  -2.901   1.246 -13.709
  398   HG21  VAL  54          3HG2      VAL  54  -4.456  -2.201 -13.181
  399   HG22  VAL  54          1HG2      VAL  54  -3.243  -2.644 -11.957
  400   HG23  VAL  54          2HG2      VAL  54  -4.419  -1.357 -11.625
  401    H    GLY  55           H        GLY  55  -3.100  -3.608 -14.513
  402    HA2  GLY  55           2HA      GLY  55  -4.498  -4.458 -16.105
  403    HA3  GLY  55           3HA      GLY  55  -4.769  -2.808 -16.703
  404    H    ASP  56           H        ASP  56  -1.538  -4.274 -16.495
  405    HA   ASP  56           HA       ASP  56  -1.479  -4.677 -19.462
  406    HB2  ASP  56           2HB      ASP  56  -0.349  -2.541 -18.744
  407    HB3  ASP  56           3HB      ASP  56   0.697  -3.525 -17.707
  408    H    GLU  57           H        GLU  57   0.299  -6.214 -20.075
  409    HA   GLU  57           HA       GLU  57   0.607  -8.361 -18.016
  410    HB2  GLU  57           2HB      GLU  57  -0.769  -8.902 -20.005
  411    HB3  GLU  57           3HB      GLU  57   0.615  -8.511 -21.047
  412    HG2  GLU  57           2HG      GLU  57   1.925 -10.323 -20.001
  413    HG3  GLU  57           3HG      GLU  57   0.572 -10.699 -18.923
  414    H    VAL  58           H        VAL  58   2.628  -9.069 -17.518
  415    HA   VAL  58           HA       VAL  58   5.011  -7.848 -18.825
  416    HB   VAL  58           HB       VAL  58   5.785  -7.151 -16.519
  417   HG11  VAL  58          1HG1      VAL  58   3.318  -5.695 -17.580
  418   HG12  VAL  58          2HG1      VAL  58   4.529  -5.016 -16.476
  419   HG13  VAL  58          3HG1      VAL  58   4.985  -5.458 -18.130
  420   HG21  VAL  58          3HG2      VAL  58   2.872  -7.460 -15.726
  421   HG22  VAL  58          1HG2      VAL  58   4.248  -8.389 -15.098
  422   HG23  VAL  58          2HG2      VAL  58   4.137  -6.652 -14.779
  423    H    GLN  59           H        GLN  59   6.821  -9.042 -18.696
  424    HA   GLN  59           HA       GLN  59   6.743 -11.683 -17.454
  425    HB2  GLN  59           2HB      GLN  59   8.808 -10.047 -18.944
  426    HB3  GLN  59           3HB      GLN  59   9.286 -11.482 -18.020
  427    HG2  GLN  59           2HG      GLN  59   8.956 -12.136 -20.324
  428    HG3  GLN  59           3HG      GLN  59   7.693 -12.860 -19.323
  429   HE21  GLN  59          2HE2      GLN  59   5.668 -12.734 -20.175
  430   HE22  GLN  59          1HE2      GLN  59   5.113 -11.522 -21.327
  431    H    VAL  60           H        VAL  60   7.614 -12.159 -15.456
  432    HA   VAL  60           HA       VAL  60   8.850  -9.997 -13.802
  433    HB   VAL  60           HB       VAL  60   7.349 -11.069 -11.944
  434   HG11  VAL  60          1HG1      VAL  60   6.152  -9.188 -14.010
  435   HG12  VAL  60          2HG1      VAL  60   5.565  -9.405 -12.345
  436   HG13  VAL  60          3HG1      VAL  60   7.176  -8.727 -12.627
  437   HG21  VAL  60          3HG2      VAL  60   5.588 -11.670 -14.342
  438   HG22  VAL  60          1HG2      VAL  60   6.312 -12.860 -13.232
  439   HG23  VAL  60          2HG2      VAL  60   5.101 -11.703 -12.647
  440    H    LYS  61           H        LYS  61  10.541 -10.672 -12.595
  441    HA   LYS  61           HA       LYS  61  11.189 -13.561 -12.543
  442    HB2  LYS  61           2HB      LYS  61  12.955 -11.852 -12.926
  443    HB3  LYS  61           3HB      LYS  61  12.622 -11.174 -11.316
  444    HG2  LYS  61           2HG      LYS  61  13.295 -13.273 -10.249
  445    HG3  LYS  61           3HG      LYS  61  13.510 -14.045 -11.834
  446    HD2  LYS  61           2HD      LYS  61  15.338 -12.473 -12.365
  447    HD3  LYS  61           3HD      LYS  61  15.112 -11.671 -10.789
  448    HE2  LYS  61           2HE      LYS  61  15.642 -13.797  -9.637
  449    HE3  LYS  61           3HE      LYS  61  15.865 -14.599 -11.207
  450    HZ1  LYS  61           3HZ      LYS  61  17.695 -13.092 -11.646
  451    HZ2  LYS  61           1HZ      LYS  61  17.492 -12.354 -10.186
  452    HZ3  LYS  61           2HZ      LYS  61  17.963 -13.928 -10.250
  453    H    VAL  62           H        VAL  62  10.785 -14.863 -10.817
  454    HA   VAL  62           HA       VAL  62   9.307 -13.930  -8.506
  455    HB   VAL  62           HB       VAL  62  10.743 -16.577  -8.981
  456   HG11  VAL  62          1HG1      VAL  62   8.453 -15.801  -7.116
  457   HG12  VAL  62          2HG1      VAL  62   9.112 -17.436  -7.310
  458   HG13  VAL  62          3HG1      VAL  62  10.115 -16.153  -6.609
  459   HG21  VAL  62          3HG2      VAL  62   7.844 -15.809  -9.565
  460   HG22  VAL  62          1HG2      VAL  62   9.093 -16.155 -10.781
  461   HG23  VAL  62          2HG2      VAL  62   8.543 -17.439  -9.699
  462    H    LEU  63           H        LEU  63  10.154 -12.829  -6.909
  463    HA   LEU  63           HA       LEU  63  13.108 -12.712  -6.550
  464    HB2  LEU  63           2HB      LEU  63  11.771 -10.692  -7.097
  465    HB3  LEU  63           3HB      LEU  63  10.860 -10.915  -5.596
  466    HG   LEU  63           HG       LEU  63  13.016 -10.637  -4.310
  467   HD11  LEU  63          1HD1      LEU  63  14.084  -9.725  -7.025
  468   HD12  LEU  63          2HD1      LEU  63  14.924  -9.567  -5.466
  469   HD13  LEU  63          3HD1      LEU  63  14.615 -11.175  -6.136
  470   HD21  LEU  63          3HD2      LEU  63  12.139  -8.351  -6.122
  471   HD22  LEU  63          1HD2      LEU  63  11.394  -8.810  -4.581
  472   HD23  LEU  63          2HD2      LEU  63  13.049  -8.173  -4.607
  473    H    ALA  64           H        ALA  64  10.114 -13.507  -4.827
  474    HA   ALA  64           HA       ALA  64  11.572 -15.090  -2.855
  475    HB1  ALA  64           1HB      ALA  64   9.952 -12.689  -1.942
  476    HB2  ALA  64           2HB      ALA  64  10.569 -13.969  -0.897
  477    HB3  ALA  64           3HB      ALA  64  11.705 -12.899  -1.744
  478    H    VAL  65           H        VAL  65  10.006 -16.405  -1.613
  479    HA   VAL  65           HA       VAL  65   7.156 -16.247  -2.472
  480    HB   VAL  65           HB       VAL  65   8.800 -18.796  -2.154
  481   HG11  VAL  65          1HG1      VAL  65   5.900 -18.382  -3.029
  482   HG12  VAL  65          2HG1      VAL  65   6.760 -19.934  -2.996
  483   HG13  VAL  65          3HG1      VAL  65   6.426 -19.081  -1.484
  484   HG21  VAL  65          3HG2      VAL  65   7.652 -17.567  -4.693
  485   HG22  VAL  65          1HG2      VAL  65   9.373 -17.700  -4.278
  486   HG23  VAL  65          2HG2      VAL  65   8.426 -19.165  -4.563
  487    H    ASP  66           H        ASP  66   5.725 -16.656  -0.805
  488    HA   ASP  66           HA       ASP  66   6.803 -16.838   1.967
  489    HB2  ASP  66           2HB      ASP  66   6.727 -14.497   1.359
  490    HB3  ASP  66           3HB      ASP  66   5.019 -14.606   0.902
  491    H    GLU  67           H        GLU  67   5.975 -18.973   1.586
  492    HA   GLU  67           HA       GLU  67   3.281 -19.587   0.983
  493    HB2  GLU  67           2HB      GLU  67   3.807 -21.807   1.677
  494    HB3  GLU  67           3HB      GLU  67   5.209 -21.132   0.829
  495    HG2  GLU  67           2HG      GLU  67   6.294 -20.654   3.000
  496    HG3  GLU  67           3HG      GLU  67   4.925 -21.378   3.858
  497    H    GLU  68           H        GLU  68   4.579 -18.401   3.982
  498    HA   GLU  68           HA       GLU  68   2.550 -19.341   5.759
  499    HB2  GLU  68           2HB      GLU  68   4.110 -16.736   5.799
  500    HB3  GLU  68           3HB      GLU  68   3.205 -17.422   7.156
  501    HG2  GLU  68           2HG      GLU  68   5.596 -18.734   5.811
  502    HG3  GLU  68           3HG      GLU  68   5.686 -17.792   7.300
  503    H    LYS  69           H        LYS  69   2.536 -16.874   3.296
  504    HA   LYS  69           HA       LYS  69  -0.238 -16.016   4.077
  505    HB2  LYS  69           2HB      LYS  69   2.010 -14.418   2.801
  506    HB3  LYS  69           3HB      LYS  69   0.356 -13.832   3.040
  507    HG2  LYS  69           2HG      LYS  69   2.288 -14.610   5.265
  508    HG3  LYS  69           3HG      LYS  69   1.959 -12.957   4.723
  509    HD2  LYS  69           2HD      LYS  69  -0.428 -13.221   5.382
  510    HD3  LYS  69           3HD      LYS  69  -0.073 -14.864   5.949
  511    HE2  LYS  69           2HE      LYS  69  -0.102 -13.455   7.876
  512    HE3  LYS  69           3HE      LYS  69   1.584 -13.917   7.565
  513    HZ1  LYS  69           3HZ      LYS  69   1.916 -11.762   6.549
  514    HZ2  LYS  69           1HZ      LYS  69   0.350 -11.329   6.841
  515    HZ3  LYS  69           2HZ      LYS  69   1.385 -11.580   8.099
  516    H    GLY  70           H        GLY  70   1.493 -17.772   1.824
  517    HA2  GLY  70           2HA      GLY  70   1.058 -18.465  -0.330
  518    HA3  GLY  70           3HA      GLY  70  -0.601 -17.860  -0.125
  519    H    LYS  71           H        LYS  71   2.508 -16.088   0.020
  520    HA   LYS  71           HA       LYS  71   1.604 -14.341  -2.245
  521    HB2  LYS  71           2HB      LYS  71   2.831 -13.708   0.452
  522    HB3  LYS  71           3HB      LYS  71   3.021 -12.597  -0.910
  523    HG2  LYS  71           2HG      LYS  71   0.293 -13.560   0.015
  524    HG3  LYS  71           3HG      LYS  71   1.091 -12.146   0.725
  525    HD2  LYS  71           2HD      LYS  71   1.205 -11.083  -1.527
  526    HD3  LYS  71           3HD      LYS  71   0.356 -12.486  -2.222
  527    HE2  LYS  71           2HE      LYS  71  -1.600 -12.059  -0.853
  528    HE3  LYS  71           3HE      LYS  71  -0.759 -10.764   0.026
  529    HZ1  LYS  71           3HZ      LYS  71  -0.668  -9.515  -2.042
  530    HZ2  LYS  71           1HZ      LYS  71  -1.438 -10.705  -2.859
  531    HZ3  LYS  71           2HZ      LYS  71  -2.225  -9.881  -1.665
  532    H    ILE  72           H        ILE  72   3.375 -13.192  -3.259
  533    HA   ILE  72           HA       ILE  72   6.038 -14.507  -3.302
  534    HB   ILE  72           HB       ILE  72   4.039 -14.244  -5.596
  535   HG12  ILE  72          2HG1      ILE  72   5.560 -16.543  -4.375
  536   HG13  ILE  72          3HG1      ILE  72   3.809 -16.276  -4.403
  537   HG21  ILE  72          1HG2      ILE  72   7.019 -14.815  -5.822
  538   HG22  ILE  72          2HG2      ILE  72   5.849 -14.896  -7.158
  539   HG23  ILE  72          3HG2      ILE  72   6.202 -13.355  -6.396
  540   HD11  ILE  72          3HD1      ILE  72   3.780 -16.658  -6.843
  541   HD12  ILE  72          1HD1      ILE  72   5.529 -16.964  -6.822
  542   HD13  ILE  72          2HD1      ILE  72   4.442 -18.059  -5.971
  543    H    SER  73           H        SER  73   7.648 -13.038  -3.708
  544    HA   SER  73           HA       SER  73   6.817 -10.227  -4.275
  545    HB2  SER  73           2HB      SER  73   9.525 -11.251  -3.373
  546    HB3  SER  73           3HB      SER  73   9.000  -9.565  -3.491
  547    HG   SER  73           HG       SER  73   8.853 -10.383  -1.324
  548    H    LEU  74           H        LEU  74   7.882  -9.150  -6.044
  549    HA   LEU  74           HA       LEU  74   8.927 -10.990  -8.163
  550    HB2  LEU  74           2HB      LEU  74   6.693  -8.968  -8.330
  551    HB3  LEU  74           3HB      LEU  74   7.376  -9.800  -9.736
  552    HG   LEU  74           HG       LEU  74   5.938 -11.188  -7.429
  553   HD11  LEU  74          1HD1      LEU  74   4.936 -10.502 -10.226
  554   HD12  LEU  74          2HD1      LEU  74   4.064 -11.473  -9.023
  555   HD13  LEU  74          3HD1      LEU  74   4.392  -9.759  -8.708
  556   HD21  LEU  74          3HD2      LEU  74   6.847 -12.250 -10.127
  557   HD22  LEU  74          1HD2      LEU  74   7.559 -12.636  -8.546
  558   HD23  LEU  74          2HD2      LEU  74   5.909 -13.138  -8.915
  559    H    SER  75           H        SER  75   9.860  -9.794  -9.998
  560    HA   SER  75           HA       SER  75  10.610  -6.962  -9.467
  561    HB2  SER  75           2HB      SER  75  12.477  -8.322  -8.651
  562    HB3  SER  75           3HB      SER  75  12.519  -9.218 -10.181
  563    HG   SER  75           HG       SER  75  14.086  -7.511 -10.066
  564    H    ILE  76           H        ILE  76  10.917  -5.770 -11.225
  565    HA   ILE  76           HA       ILE  76  10.385  -6.896 -13.959
  566    HB   ILE  76           HB       ILE  76   9.626  -4.246 -12.679
  567   HG12  ILE  76          2HG1      ILE  76   8.084  -6.074 -12.221
  568   HG13  ILE  76          3HG1      ILE  76   7.373  -4.745 -13.143
  569   HG21  ILE  76          1HG2      ILE  76   9.374  -5.035 -15.613
  570   HG22  ILE  76          2HG2      ILE  76   8.687  -3.568 -14.871
  571   HG23  ILE  76          3HG2      ILE  76  10.442  -3.786 -14.965
  572   HD11  ILE  76          3HD1      ILE  76   7.540  -6.090 -15.226
  573   HD12  ILE  76          1HD1      ILE  76   8.273  -7.414 -14.296
  574   HD13  ILE  76          2HD1      ILE  76   6.594  -6.918 -13.994
  575    H    ARG  77           H        ARG  77  12.397  -4.611 -11.989
  576    HA   ARG  77           HA       ARG  77  14.068  -3.898 -14.162
  577    HB2  ARG  77           2HB      ARG  77  15.643  -3.184 -12.597
  578    HB3  ARG  77           3HB      ARG  77  14.060  -2.902 -11.870
  579    HG2  ARG  77           2HG      ARG  77  14.369  -4.965 -10.489
  580    HG3  ARG  77           3HG      ARG  77  16.001  -5.148 -11.158
  581    HD2  ARG  77           2HD      ARG  77  15.068  -2.617  -9.759
  582    HD3  ARG  77           3HD      ARG  77  15.783  -3.979  -8.873
  583    HE   ARG  77           HE       ARG  77  17.608  -3.370 -10.896
  584   HH11  ARG  77          1HH1      ARG  77  16.045  -1.461  -8.318
  585   HH12  ARG  77          2HH1      ARG  77  17.452  -0.511  -7.994
  586   HH21  ARG  77          1HH2      ARG  77  19.486  -2.197 -10.356
  587   HH22  ARG  77          2HH2      ARG  77  19.427  -0.938  -9.153
  588    H    ALA  78           H        ALA  78  13.894  -6.916 -12.453
  589    HA   ALA  78           HA       ALA  78  16.281  -8.069 -13.549
  590    HB1  ALA  78           1HB      ALA  78  13.685  -9.369 -12.621
  591    HB2  ALA  78           2HB      ALA  78  15.243 -10.190 -12.861
  592    HB3  ALA  78           3HB      ALA  78  15.077  -8.967 -11.582
  593    H    THR  79           H        THR  79  13.137  -7.443 -15.058
  594    HA   THR  79           HA       THR  79  13.751  -9.418 -17.212
  595    HB   THR  79           HB       THR  79  11.327  -9.422 -17.621
  596    HG1  THR  79           1HG      THR  79   9.960  -8.365 -16.112
  597   HG21  THR  79          1HG2      THR  79  11.971  -9.845 -14.660
  598   HG22  THR  79          2HG2      THR  79  10.581 -10.512 -15.528
  599   HG23  THR  79          3HG2      THR  79  12.212 -11.041 -15.956
  600    H    GLN  80           H        GLN  80  12.904  -6.055 -16.598
  601    HA   GLN  80           HA       GLN  80  14.267  -5.326 -19.109
  602    HB2  GLN  80           2HB      GLN  80  12.557  -3.580 -19.522
  603    HB3  GLN  80           3HB      GLN  80  12.010  -5.239 -19.795
  604    HG2  GLN  80           2HG      GLN  80  10.769  -5.211 -17.661
  605    HG3  GLN  80           3HG      GLN  80  11.340  -3.570 -17.338
  606   HE21  GLN  80          2HE2      GLN  80   9.116  -2.878 -17.144
  607   HE22  GLN  80          1HE2      GLN  80   8.154  -2.625 -18.598
  608    H    ALA  81           H        ALA  81  16.001  -4.304 -18.376
  609    HA   ALA  81           HA       ALA  81  16.398  -3.508 -15.753
  610    HB1  ALA  81           1HB      ALA  81  17.779  -2.397 -18.232
  611    HB2  ALA  81           2HB      ALA  81  18.404  -2.323 -16.569
  612    HB3  ALA  81           3HB      ALA  81  18.215  -3.896 -17.371
  613    H    ALA  82           H        ALA  82  15.228  -1.539 -18.426
  614    HA   ALA  82           HA       ALA  82  13.977   0.377 -16.512
  615    HB1  ALA  82           1HB      ALA  82  15.495   1.043 -19.079
  616    HB2  ALA  82           2HB      ALA  82  14.504   2.189 -18.155
  617    HB3  ALA  82           3HB      ALA  82  15.973   1.507 -17.428
  618    HA   PRO  83           HA       PRO  83  10.487  -0.844 -18.802
  619    HB2  PRO  83           2HB      PRO  83   8.798   1.300 -18.820
  620    HB3  PRO  83           3HB      PRO  83   9.213   0.375 -17.358
  621    HG2  PRO  83           2HG      PRO  83  10.480   2.977 -18.297
  622    HG3  PRO  83           3HG      PRO  83   9.875   2.557 -16.667
  623    HD2  PRO  83           2HD      PRO  83  12.527   2.305 -17.305
  624    HD3  PRO  83           3HD      PRO  83  11.727   1.121 -16.235
  625    H    GLU  84           H        GLU  84  12.733   0.471 -20.445
  626    HA   GLU  84           HA       GLU  84  11.282   0.652 -23.022
  627    HB2  GLU  84           2HB      GLU  84  12.568   2.592 -23.672
  628    HB3  GLU  84           3HB      GLU  84  11.635   2.942 -22.207
  629    HG2  GLU  84           2HG      GLU  84  13.688   2.633 -20.828
  630    HG3  GLU  84           3HG      GLU  84  14.605   2.264 -22.294
  631    H    LYS  85           H        LYS  85  13.789  -0.874 -21.267
  632    HA   LYS  85           HA       LYS  85  14.802  -2.032 -23.767
  633    HB2  LYS  85           2HB      LYS  85  16.133   0.157 -23.142
  634    HB3  LYS  85           3HB      LYS  85  16.858  -0.855 -21.879
  635    HG2  LYS  85           2HG      LYS  85  17.585  -2.479 -23.624
  636    HG3  LYS  85           3HG      LYS  85  16.855  -1.449 -24.878
  637    HD2  LYS  85           2HD      LYS  85  18.366   0.417 -24.113
  638    HD3  LYS  85           3HD      LYS  85  19.165  -0.737 -23.031
  639    HE2  LYS  85           2HE      LYS  85  19.051  -0.864 -26.072
  640    HE3  LYS  85           3HE      LYS  85  20.458  -0.416 -25.087
  641    HZ1  LYS  85           3HZ      LYS  85  20.464  -2.657 -24.182
  642    HZ2  LYS  85           1HZ      LYS  85  19.178  -3.067 -25.101
  643    HZ3  LYS  85           2HZ      LYS  85  20.597  -2.693 -25.831
  644    H    LYS  86           H        LYS  86  15.574  -4.094 -23.473
  645    HA   LYS  86           HA       LYS  86  14.848  -5.496 -21.107
  646    HB2  LYS  86           2HB      LYS  86  16.700  -6.284 -23.388
  647    HB3  LYS  86           3HB      LYS  86  16.166  -7.389 -22.101
  648    HG2  LYS  86           2HG      LYS  86  13.788  -6.906 -22.740
  649    HG3  LYS  86           3HG      LYS  86  14.383  -5.943 -24.106
  650    HD2  LYS  86           2HD      LYS  86  14.947  -8.907 -23.677
  651    HD3  LYS  86           3HD      LYS  86  13.680  -8.254 -24.737
  652    HE2  LYS  86           2HE      LYS  86  15.434  -7.061 -26.057
  653    HE3  LYS  86           3HE      LYS  86  16.681  -7.800 -25.028
  654    HZ1  LYS  86           3HZ      LYS  86  15.942  -9.956 -25.792
  655    HZ2  LYS  86           1HZ      LYS  86  14.789  -9.277 -26.750
  656    HZ3  LYS  86           2HZ      LYS  86  16.382  -9.024 -27.076
  657    H    GLU  87           H        GLU  87  18.117  -4.519 -22.226
  658    HA   GLU  87           HA       GLU  87  18.955  -4.114 -19.453
  659    HB2  GLU  87           2HB      GLU  87  19.381  -6.500 -19.793
  660    HB3  GLU  87           3HB      GLU  87  20.268  -6.144 -21.282
  661    HG2  GLU  87           2HG      GLU  87  21.741  -6.694 -19.390
  662    HG3  GLU  87           3HG      GLU  87  22.060  -5.080 -20.028
  663    H    SER  88           H        SER  88  20.826  -2.818 -19.395
  664    HA   SER  88           HA       SER  88  21.556  -1.405 -21.938
  665    HB2  SER  88           2HB      SER  88  21.151  -0.122 -19.221
  666    HB3  SER  88           3HB      SER  88  21.402   0.685 -20.782
  667    HG   SER  88           HG       SER  88  19.181   0.678 -20.132
  668    H    LYS  89           H        LYS  89  22.644  -2.925 -18.978
  669    HA   LYS  89           HA       LYS  89  25.211  -1.679 -18.744
  670    HB2  LYS  89           2HB      LYS  89  24.303  -4.503 -18.093
  671    HB3  LYS  89           3HB      LYS  89  25.836  -3.783 -17.564
  672    HG2  LYS  89           2HG      LYS  89  24.693  -2.160 -16.174
  673    HG3  LYS  89           3HG      LYS  89  23.120  -2.611 -16.846
  674    HD2  LYS  89           2HD      LYS  89  23.738  -5.027 -15.950
  675    HD3  LYS  89           3HD      LYS  89  24.878  -4.136 -14.922
  676    HE2  LYS  89           2HE      LYS  89  22.861  -4.413 -13.657
  677    HE3  LYS  89           3HE      LYS  89  22.932  -2.707 -14.155
  678    HZ1  LYS  89           3HZ      LYS  89  21.405  -3.283 -15.967
  679    HZ2  LYS  89           1HZ      LYS  89  21.344  -4.818 -15.507
  680    HZ3  LYS  89           2HZ      LYS  89  20.737  -3.654 -14.486
  681    HA   PRO  90           HA       PRO  90  27.281  -3.770 -22.194
  682    HB2  PRO  90           2HB      PRO  90  29.903  -3.406 -21.450
  683    HB3  PRO  90           3HB      PRO  90  28.909  -2.092 -22.134
  684    HG2  PRO  90           2HG      PRO  90  29.557  -2.747 -19.219
  685    HG3  PRO  90           3HG      PRO  90  29.580  -1.144 -20.002
  686    HD2  PRO  90           2HD      PRO  90  27.426  -2.067 -18.505
  687    HD3  PRO  90           3HD      PRO  90  27.224  -0.946 -19.882
  688    H    ARG  91           H        ARG  91  29.042  -5.612 -22.329
  689    HA   ARG  91           HA       ARG  91  29.435  -7.103 -19.798
  690    HB2  ARG  91           2HB      ARG  91  27.392  -7.957 -21.134
  691    HB3  ARG  91           3HB      ARG  91  28.572  -8.512 -22.339
  692    HG2  ARG  91           2HG      ARG  91  29.705  -9.809 -20.466
  693    HG3  ARG  91           3HG      ARG  91  28.342  -9.366 -19.423
  694    HD2  ARG  91           2HD      ARG  91  28.272 -11.052 -21.952
  695    HD3  ARG  91           3HD      ARG  91  27.997 -11.612 -20.296
  696    HE   ARG  91           HE       ARG  91  26.008  -9.930 -20.398
  697   HH11  ARG  91          1HH2      ARG  91  27.047 -12.074 -23.053
  698   HH12  ARG  91          2HH2      ARG  91  25.451 -12.063 -23.796
  699   HH21  ARG  91          1HH1      ARG  91  23.951  -9.939 -21.504
  700   HH22  ARG  91          2HH1      ARG  91  23.780 -10.917 -22.961
  701    H    LYS  92           H        LYS  92  31.408  -8.191 -19.771
  702    HA   LYS  92           HA       LYS  92  33.493  -7.456 -21.595
  703    HB2  LYS  92           2HB      LYS  92  33.137  -9.523 -19.411
  704    HB3  LYS  92           3HB      LYS  92  34.545  -9.612 -20.470
  705    HG2  LYS  92           2HG      LYS  92  35.162  -8.442 -18.466
  706    HG3  LYS  92           3HG      LYS  92  35.200  -7.319 -19.838
  707    HD2  LYS  92           2HD      LYS  92  33.113  -6.287 -19.134
  708    HD3  LYS  92           3HD      LYS  92  32.876  -7.523 -17.883
  709    HE2  LYS  92           2HE      LYS  92  33.648  -5.524 -16.801
  710    HE3  LYS  92           3HE      LYS  92  34.949  -6.728 -16.746
  711    HZ1  LYS  92           3HZ      LYS  92  35.993  -5.584 -18.593
  712    HZ2  LYS  92           1HZ      LYS  92  34.784  -4.464 -18.639
  713    HZ3  LYS  92           2HZ      LYS  92  35.777  -4.548 -17.331
  714    HA   PRO  93           HA       PRO  93  33.044 -10.516 -24.839
  715    HB2  PRO  93           2HB      PRO  93  35.676 -11.256 -25.287
  716    HB3  PRO  93           3HB      PRO  93  34.947  -9.750 -25.905
  717    HG2  PRO  93           2HG      PRO  93  36.643 -10.191 -23.415
  718    HG3  PRO  93           3HG      PRO  93  36.780  -8.874 -24.613
  719    HD2  PRO  93           2HD      PRO  93  35.449  -8.528 -22.238
  720    HD3  PRO  93           3HD      PRO  93  34.874  -7.747 -23.734
  721    H    LYS  94           H        LYS  94  33.222 -12.884 -25.135
  722    HA   LYS  94           HA       LYS  94  33.541 -14.434 -22.714
  723    HB2  LYS  94           2HB      LYS  94  32.084 -14.937 -24.775
  724    HB3  LYS  94           3HB      LYS  94  33.565 -15.521 -25.544
  725    HG2  LYS  94           2HG      LYS  94  32.577 -16.560 -22.865
  726    HG3  LYS  94           3HG      LYS  94  32.011 -17.230 -24.404
  727    HD2  LYS  94           2HD      LYS  94  34.385 -17.789 -24.990
  728    HD3  LYS  94           3HD      LYS  94  34.884 -17.242 -23.378
  729    HE2  LYS  94           2HE      LYS  94  32.775 -19.396 -23.800
  730    HE3  LYS  94           3HE      LYS  94  34.512 -19.770 -23.713
  731    HZ1  LYS  94           3HZ      LYS  94  34.545 -18.797 -21.500
  732    HZ2  LYS  94           1HZ      LYS  94  32.955 -18.459 -21.576
  733    HZ3  LYS  94           2HZ      LYS  94  33.435 -20.009 -21.558
  734    H    ALA  95           H        ALA  95  35.503 -13.937 -21.875
  735    HA   ALA  95           HA       ALA  95  37.937 -14.925 -23.291
  736    HB1  ALA  95           1HB      ALA  95  37.611 -12.256 -21.854
  737    HB2  ALA  95           2HB      ALA  95  39.116 -12.888 -22.559
  738    HB3  ALA  95           3HB      ALA  95  37.750 -12.485 -23.615
  739    H    ALA  96           H        ALA  96  36.178 -16.000 -21.072
  740    HA   ALA  96           HA       ALA  96  38.420 -16.716 -19.253
  741    HB1  ALA  96           1HB      ALA  96  35.622 -15.874 -18.372
  742    HB2  ALA  96           2HB      ALA  96  36.878 -16.571 -17.322
  743    HB3  ALA  96           3HB      ALA  96  37.128 -14.978 -18.065
  744    H    GLN  97           H        GLN  97  38.279 -18.829 -18.484
  745    HA   GLN  97           HA       GLN  97  36.739 -20.696 -20.076
  746    HB2  GLN  97           2HB      GLN  97  37.857 -22.362 -18.789
  747    HB3  GLN  97           3HB      GLN  97  39.013 -21.069 -19.145
  748    HG2  GLN  97           2HG      GLN  97  38.488 -20.151 -16.784
  749    HG3  GLN  97           3HG      GLN  97  37.646 -21.679 -16.493
  750   HE21  GLN  97          2HE2      GLN  97  40.832 -20.148 -17.055
  751   HE22  GLN  97          1HE2      GLN  97  41.755 -21.539 -16.567
  752    H    VAL  98           H        VAL  98  35.824 -18.889 -17.331
  753    HA   VAL  98           HA       VAL  98  34.355 -20.885 -15.890
  754    HB   VAL  98           HB       VAL  98  34.059 -17.850 -15.872
  755   HG11  VAL  98          1HG1      VAL  98  33.429 -19.933 -13.728
  756   HG12  VAL  98          2HG1      VAL  98  33.294 -18.169 -13.532
  757   HG13  VAL  98          3HG1      VAL  98  32.232 -19.022 -14.666
  758   HG21  VAL  98          3HG2      VAL  98  35.903 -19.608 -14.201
  759   HG22  VAL  98          1HG2      VAL  98  36.412 -18.461 -15.457
  760   HG23  VAL  98          2HG2      VAL  98  35.648 -17.863 -13.979
  761    H    SER  99           H        SER  99  33.243 -18.434 -18.301
  762    HA   SER  99           HA       SER  99  30.491 -19.270 -18.086
  763    HB2  SER  99           2HB      SER  99  30.369 -17.881 -20.260
  764    HB3  SER  99           3HB      SER  99  30.837 -17.056 -18.761
  765    HG   SER  99           HG       SER  99  32.198 -16.498 -20.514
  766    H    GLU 100           H        GLU 100  29.206 -20.329 -19.639
  767    HA   GLU 100           HA       GLU 100  30.522 -21.925 -21.738
  768    HB2  GLU 100           2HB      GLU 100  29.467 -23.963 -21.006
  769    HB3  GLU 100           3HB      GLU 100  30.528 -23.338 -19.735
  770    HG2  GLU 100           2HG      GLU 100  28.561 -22.434 -18.533
  771    HG3  GLU 100           3HG      GLU 100  27.485 -23.075 -19.783
  772    H    GLU 101           H        GLU 101  28.776 -23.034 -23.065
  773    HA   GLU 101           HA       GLU 101  26.350 -21.376 -23.412
  774    HB2  GLU 101           2HB      GLU 101  28.547 -21.706 -25.490
  775    HB3  GLU 101           3HB      GLU 101  26.942 -21.018 -25.799
  776    HG2  GLU 101           2HG      GLU 101  27.426 -19.188 -24.190
  777    HG3  GLU 101           3HG      GLU 101  29.056 -19.834 -23.950
  778    H    ALA 102           H        ALA 102  25.117 -22.295 -25.354
  779    HA   ALA 102           HA       ALA 102  25.405 -25.263 -25.592
  780    HB1  ALA 102           1HB      ALA 102  22.850 -23.638 -25.230
  781    HB2  ALA 102           2HB      ALA 102  22.943 -25.399 -25.458
  782    HB3  ALA 102           3HB      ALA 102  23.619 -24.661 -23.992
  783    H    SER 103           H        SER 103  26.187 -22.897 -27.346
  784    HA   SER 103           HA       SER 103  26.225 -22.288 -29.547
  785    HB2  SER 103           2HB      SER 103  25.258 -25.112 -30.111
  786    HB3  SER 103           3HB      SER 103  26.181 -24.047 -31.189
  787    HG   SER 103           HG       SER 103  27.512 -25.608 -30.127
  788    H    THR 104           H        THR 104  23.696 -21.955 -28.009
  789    HA   THR 104           HA       THR 104  21.503 -21.992 -29.814
  790    HB   THR 104           HB       THR 104  20.753 -20.131 -28.074
  791    HG1  THR 104           1HG      THR 104  21.942 -20.362 -26.116
  792   HG21  THR 104          1HG2      THR 104  21.403 -22.991 -27.220
  793   HG22  THR 104          2HG2      THR 104  20.229 -21.912 -26.430
  794   HG23  THR 104          3HG2      THR 104  19.942 -22.476 -28.088
  795    HA   PRO 105           HA       PRO 105  22.336 -18.559 -32.393
  796    HB2  PRO 105           2HB      PRO 105  19.859 -17.599 -33.071
  797    HB3  PRO 105           3HB      PRO 105  20.464 -19.187 -33.617
  798    HG2  PRO 105           2HG      PRO 105  18.635 -18.580 -31.252
  799    HG3  PRO 105           3HG      PRO 105  18.441 -19.844 -32.499
  800    HD2  PRO 105           2HD      PRO 105  19.574 -20.379 -30.040
  801    HD3  PRO 105           3HD      PRO 105  20.122 -21.209 -31.523
  802    H    GLN 106           H        GLN 106  20.853 -17.963 -29.343
  803    HA   GLN 106           HA       GLN 106  20.287 -15.228 -29.311
  804    HB2  GLN 106           2HB      GLN 106  19.831 -16.817 -27.487
  805    HB3  GLN 106           3HB      GLN 106  21.568 -16.947 -27.161
  806    HG2  GLN 106           2HG      GLN 106  20.438 -15.471 -25.542
  807    HG3  GLN 106           3HG      GLN 106  21.655 -14.591 -26.473
  808   HE21  GLN 106          2HE2      GLN 106  20.970 -12.524 -26.894
  809   HE22  GLN 106          1HE2      GLN 106  19.312 -12.110 -27.334
  810    H    GLY 107           H        GLY 107  21.399 -13.416 -29.474
  811    HA2  GLY 107           2HA      GLY 107  23.142 -11.926 -29.368
  812    HA3  GLY 107           3HA      GLY 107  24.180 -13.204 -28.708
  813    H    PHE 108           H        PHE 108  22.818 -14.359 -31.501
  814    HA   PHE 108           HA       PHE 108  23.437 -14.833 -33.616
  815    HB2  PHE 108           2HB      PHE 108  23.185 -12.463 -34.108
  816    HB3  PHE 108           3HB      PHE 108  24.833 -12.117 -33.574
  817    HD1  PHE 108           HD1      PHE 108  22.787 -13.788 -36.183
  818    HD2  PHE 108           HD2      PHE 108  26.731 -12.524 -34.977
  819    HE1  PHE 108           HE1      PHE 108  23.647 -14.288 -38.461
  820    HE2  PHE 108           HE2      PHE 108  27.599 -13.077 -37.235
  821    HZ   PHE 108           HZ       PHE 108  26.059 -13.944 -38.987
  822    H    ASN 109           H        ASN 109  26.384 -13.548 -32.030
  823    HA   ASN 109           HA       ASN 109  27.737 -16.138 -32.456
  824    HB2  ASN 109           2HB      ASN 109  28.087 -14.856 -34.584
  825    HB3  ASN 109           3HB      ASN 109  28.795 -13.537 -33.638
  826   HD21  ASN 109          2HD2      ASN 109  30.628 -13.997 -35.259
  827   HD22  ASN 109          1HD2      ASN 109  31.804 -15.189 -34.749
  828    H    THR 110           H        THR 110  29.701 -16.197 -31.163
  829    HA   THR 110           HA       THR 110  29.496 -15.341 -28.535
  830    HB   THR 110           HB       THR 110  32.095 -15.853 -30.021
  831    HG1  THR 110           1HG      THR 110  31.626 -18.070 -29.632
  832   HG21  THR 110          1HG2      THR 110  31.171 -16.531 -27.191
  833   HG22  THR 110          2HG2      THR 110  32.757 -16.933 -27.893
  834   HG23  THR 110          3HG2      THR 110  32.311 -15.234 -27.634
  835    H    LEU 111           H        LEU 111  29.411 -13.356 -27.716
  836    HA   LEU 111           HA       LEU 111  30.081 -11.055 -29.159
  837    HB2  LEU 111           2HB      LEU 111  29.443  -9.812 -27.355
  838    HB3  LEU 111           3HB      LEU 111  28.498 -11.292 -27.182
  839    HG   LEU 111           HG       LEU 111  31.016 -10.622 -25.578
  840   HD11  LEU 111          1HD1      LEU 111  28.076 -10.555 -24.789
  841   HD12  LEU 111          2HD1      LEU 111  29.460 -10.279 -23.697
  842   HD13  LEU 111          3HD1      LEU 111  29.137  -9.148 -25.016
  843   HD21  LEU 111          3HD2      LEU 111  29.017 -12.879 -25.180
  844   HD22  LEU 111          1HD2      LEU 111  30.689 -13.053 -25.760
  845   HD23  LEU 111          2HD2      LEU 111  30.395 -12.478 -24.117
  846    H    LYS 112           H        LYS 112  31.646  -9.600 -29.231
  847    HA   LYS 112           HA       LYS 112  34.219 -10.140 -27.864
  848    HB2  LYS 112           2HB      LYS 112  34.208 -11.340 -30.053
  849    HB3  LYS 112           3HB      LYS 112  33.880  -9.795 -30.867
  850    HG2  LYS 112           2HG      LYS 112  36.021  -8.886 -30.000
  851    HG3  LYS 112           3HG      LYS 112  36.341 -10.425 -29.172
  852    HD2  LYS 112           2HD      LYS 112  36.363 -11.595 -31.364
  853    HD3  LYS 112           3HD      LYS 112  36.044 -10.050 -32.189
  854    HE2  LYS 112           2HE      LYS 112  38.145  -9.123 -31.230
  855    HE3  LYS 112           3HE      LYS 112  38.467 -10.685 -30.448
  856    HZ1  LYS 112           3HZ      LYS 112  38.580 -11.683 -32.632
  857    HZ2  LYS 112           1HZ      LYS 112  38.283 -10.232 -33.359
  858    HZ3  LYS 112           2HZ      LYS 112  39.675 -10.455 -32.510
  859    H    ASP 113           H        ASP 113  34.931  -8.294 -27.099
  860    HA   ASP 113           HA       ASP 113  35.424  -6.117 -26.632
  861    HB2  ASP 113           2HB      ASP 113  36.439  -6.318 -28.958
  862    HB3  ASP 113           3HB      ASP 113  34.934  -5.616 -29.561
  863    H    LYS 114           H        LYS 114  32.299  -6.683 -27.864
  864    HA   LYS 114           HA       LYS 114  31.288  -4.356 -26.313
  865    HB2  LYS 114           2HB      LYS 114  30.549  -5.155 -29.154
  866    HB3  LYS 114           3HB      LYS 114  29.462  -4.225 -28.118
  867    HG2  LYS 114           2HG      LYS 114  30.402  -2.486 -29.211
  868    HG3  LYS 114           3HG      LYS 114  31.559  -2.618 -27.877
  869    HD2  LYS 114           2HD      LYS 114  33.101  -3.894 -29.343
  870    HD3  LYS 114           3HD      LYS 114  31.931  -3.799 -30.674
  871    HE2  LYS 114           2HE      LYS 114  32.116  -1.392 -30.758
  872    HE3  LYS 114           3HE      LYS 114  33.077  -1.361 -29.261
  873    HZ1  LYS 114           3HZ      LYS 114  34.828  -2.519 -30.402
  874    HZ2  LYS 114           1HZ      LYS 114  33.951  -2.563 -31.808
  875    HZ3  LYS 114           2HZ      LYS 114  34.470  -1.121 -31.188
  876    H    LEU 115           H        LEU 115  28.915  -4.698 -25.876
  877    HA   LEU 115           HA       LEU 115  28.101  -7.203 -24.879
  878    HB2  LEU 115           2HB      LEU 115  27.139  -4.996 -24.354
  879    HB3  LEU 115           3HB      LEU 115  26.453  -4.907 -25.987
  880    HG   LEU 115           HG       LEU 115  25.010  -6.876 -25.469
  881   HD11  LEU 115          1HD1      LEU 115  26.086  -6.569 -22.631
  882   HD12  LEU 115          2HD1      LEU 115  24.756  -7.632 -23.129
  883   HD13  LEU 115          3HD1      LEU 115  26.397  -7.952 -23.707
  884   HD21  LEU 115          3HD2      LEU 115  24.782  -4.566 -23.501
  885   HD22  LEU 115          1HD2      LEU 115  24.148  -4.610 -25.163
  886   HD23  LEU 115          2HD2      LEU 115  23.481  -5.696 -23.930
  887    H    GLU 116           H        GLU 116  26.636  -8.818 -25.748
  888    HA   GLU 116           HA       GLU 116  26.836  -9.567 -28.433
  889    HB2  GLU 116           2HB      GLU 116  24.999 -11.045 -28.025
  890    HB3  GLU 116           3HB      GLU 116  26.058 -11.021 -26.606
  891    HG2  GLU 116           2HG      GLU 116  24.444  -9.498 -25.452
  892    HG3  GLU 116           3HG      GLU 116  23.400  -9.563 -26.883
  893    H    GLU 117           H        GLU 117  25.676  -9.295 -30.280
  894    HA   GLU 117           HA       GLU 117  23.421  -7.476 -30.516
  895    HB2  GLU 117           2HB      GLU 117  25.289  -5.914 -30.093
  896    HB3  GLU 117           3HB      GLU 117  26.203  -6.649 -31.413
  897    HG2  GLU 117           2HG      GLU 117  25.220  -4.494 -32.087
  898    HG3  GLU 117           3HG      GLU 117  24.565  -5.821 -33.041
  899    H    TRP 118           H        TRP 118  22.808  -7.361 -32.870
  900    HA   TRP 118           HA       TRP 118  22.981  -9.919 -34.124
  901    HB2  TRP 118           2HB      TRP 118  21.741  -8.929 -35.932
  902    HB3  TRP 118           3HB      TRP 118  21.118  -8.272 -34.416
  903    HD1  TRP 118           HD1      TRP 118  21.217  -5.801 -34.060
  904    HE1  TRP 118           HE1      TRP 118  21.837  -3.719 -35.497
  905    HE3  TRP 118           HE3      TRP 118  23.393  -8.201 -38.024
  906    HZ2  TRP 118           HZ2      TRP 118  23.117  -3.225 -38.025
  907    HZ3  TRP 118           HZ3      TRP 118  24.287  -6.953 -39.908
  908    HH2  TRP 118           HH2      TRP 118  24.184  -4.462 -39.966
  909    H    ILE 119           H        ILE 119  25.144  -7.211 -34.442
  910    HA   ILE 119           HA       ILE 119  26.265  -7.808 -37.013
  911    HB   ILE 119           HB       ILE 119  28.137  -6.380 -36.281
  912   HG12  ILE 119          2HG1      ILE 119  26.928  -6.462 -33.523
  913   HG13  ILE 119          3HG1      ILE 119  28.425  -7.255 -34.040
  914   HG21  ILE 119          1HG2      ILE 119  25.418  -5.315 -35.361
  915   HG22  ILE 119          2HG2      ILE 119  26.823  -4.322 -35.772
  916   HG23  ILE 119          3HG2      ILE 119  26.043  -5.289 -37.023
  917   HD11  ILE 119          3HD1      ILE 119  29.440  -5.049 -34.529
  918   HD12  ILE 119          1HD1      ILE 119  27.951  -4.243 -33.986
  919   HD13  ILE 119          2HD1      ILE 119  28.916  -5.166 -32.834
  920    H    GLU 120           H        GLU 120  28.269  -8.669 -37.626
  921    HA   GLU 120           HA       GLU 120  28.912 -11.174 -36.443
  922    HB2  GLU 120           2HB      GLU 120  29.795  -9.552 -38.689
  923    HB3  GLU 120           3HB      GLU 120  31.201 -10.202 -37.838
  924    HG2  GLU 120           2HG      GLU 120  28.849 -11.903 -38.732
  925    HG3  GLU 120           3HG      GLU 120  30.271 -11.616 -39.736
  926    H    MET 121           H        MET 121  30.691 -11.838 -35.382
  927    HA   MET 121           HA       MET 121  32.267  -9.898 -33.741
  928    HB2  MET 121           2HB      MET 121  31.129 -12.563 -32.859
  929    HB3  MET 121           3HB      MET 121  32.131 -11.473 -31.886
  930    HG2  MET 121           2HG      MET 121  29.391 -10.746 -32.968
  931    HG3  MET 121           3HG      MET 121  29.660 -11.459 -31.378
  932    HE1  MET 121           3HE      MET 121  28.047  -8.746 -31.982
  933    HE2  MET 121           1HE      MET 121  28.220  -9.459 -30.363
  934    HE3  MET 121           2HE      MET 121  28.596  -7.739 -30.622
  935    H    SER 122           H        SER 122  32.333 -12.292 -36.077
  936    HA   SER 122           HA       SER 122  33.954 -13.488 -37.116
  937    HB2  SER 122           2HB      SER 122  35.987 -12.102 -35.334
  938    HB3  SER 122           3HB      SER 122  36.272 -12.884 -36.898
  939    HG   SER 122           HG       SER 122  36.095 -10.587 -37.084
  940    H    ASN 123           H        ASN 123  36.033 -14.977 -36.534
  941    HA   ASN 123           HA       ASN 123  35.485 -16.579 -34.118
  942    HB2  ASN 123           2HB      ASN 123  33.810 -17.442 -35.731
  943    HB3  ASN 123           3HB      ASN 123  35.081 -17.597 -36.957
  944   HD21  ASN 123          2HD2      ASN 123  34.295 -18.711 -33.605
  945   HD22  ASN 123          1HD2      ASN 123  34.995 -20.305 -33.829
  946    H    ARG 124           H        ARG 124  37.198 -18.052 -33.699
  947    HA   ARG 124           HA       ARG 124  39.429 -18.344 -35.600
  948    HB2  ARG 124           2HB      ARG 124  39.832 -16.349 -34.060
  949    HB3  ARG 124           3HB      ARG 124  39.816 -17.498 -32.712
  950    HG2  ARG 124           2HG      ARG 124  42.102 -16.987 -33.256
  951    HG3  ARG 124           3HG      ARG 124  41.785 -18.660 -33.728
  952    HD2  ARG 124           2HD      ARG 124  41.547 -17.968 -36.091
  953    HD3  ARG 124           3HD      ARG 124  41.784 -16.275 -35.639
  954    HE   ARG 124           HE       ARG 124  43.793 -18.396 -35.849
  955   HH11  ARG 124          1HH1      ARG 124  43.155 -15.102 -34.700
  956   HH12  ARG 124          2HH1      ARG 124  44.832 -14.651 -34.643
  957   HH21  ARG 124          1HH2      ARG 124  45.999 -17.790 -35.756
  958   HH22  ARG 124          2HH2      ARG 124  46.452 -16.201 -35.242
  959    H    LYS 125           H        LYS 125  40.699 -20.288 -34.985
  960    HA   LYS 125           HA       LYS 125  39.142 -22.482 -34.169
  961    HB2  LYS 125           2HB      LYS 125  41.216 -22.577 -35.526
  962    HB3  LYS 125           3HB      LYS 125  42.163 -22.142 -34.091
  963    HG2  LYS 125           2HG      LYS 125  42.335 -24.532 -34.526
  964    HG3  LYS 125           3HG      LYS 125  41.498 -24.244 -32.992
  965    HD2  LYS 125           2HD      LYS 125  39.332 -24.718 -34.021
  966    HD3  LYS 125           3HD      LYS 125  40.082 -24.826 -35.624
  967    HE2  LYS 125           2HE      LYS 125  39.671 -27.063 -34.869
  968    HE3  LYS 125           3HE      LYS 125  41.423 -26.782 -34.824
  969    HZ1  LYS 125           3HZ      LYS 125  41.230 -26.423 -32.442
  970    HZ2  LYS 125           1HZ      LYS 125  39.611 -26.689 -32.489
  971    HZ3  LYS 125           2HZ      LYS 125  40.650 -27.913 -32.851
  972    H    ASP 126           H        ASP 126  41.344 -20.496 -32.193
  973    HA   ASP 126           HA       ASP 126  39.750 -21.100 -29.818
  974    HB2  ASP 126           2HB      ASP 126  41.494 -22.875 -29.812
  975    HB3  ASP 126           3HB      ASP 126  42.741 -21.621 -29.910
  976    H    LEU 127           H        LEU 127  40.434 -19.563 -28.073
  977    HA   LEU 127           HA       LEU 127  41.949 -17.160 -28.916
  978    HB2  LEU 127           2HB      LEU 127  39.086 -17.197 -27.924
  979    HB3  LEU 127           3HB      LEU 127  40.104 -15.753 -27.860
  980    HG   LEU 127           HG       LEU 127  39.318 -17.206 -30.428
  981   HD11  LEU 127          1HD1      LEU 127  38.286 -14.602 -29.223
  982   HD12  LEU 127          2HD1      LEU 127  37.843 -15.254 -30.822
  983   HD13  LEU 127          3HD1      LEU 127  37.381 -16.120 -29.345
  984   HD21  LEU 127          3HD2      LEU 127  40.696 -14.518 -30.027
  985   HD22  LEU 127          1HD2      LEU 127  41.457 -16.002 -30.652
  986   HD23  LEU 127          2HD2      LEU 127  40.175 -15.214 -31.583
  987    H    ILE 128           H        ILE 128  42.835 -16.074 -27.100
  988    HA   ILE 128           HA       ILE 128  43.392 -17.543 -24.736
  989    HB   ILE 128           HB       ILE 128  44.789 -15.703 -25.603
  990   HG12  ILE 128          2HG1      ILE 128  43.827 -15.154 -22.797
  991   HG13  ILE 128          3HG1      ILE 128  44.899 -16.487 -23.279
  992   HG21  ILE 128          1HG2      ILE 128  42.567 -13.837 -24.640
  993   HG22  ILE 128          2HG2      ILE 128  44.163 -13.322 -25.203
  994   HG23  ILE 128          3HG2      ILE 128  43.048 -14.093 -26.328
  995   HD11  ILE 128          3HD1      ILE 128  46.589 -14.855 -24.073
  996   HD12  ILE 128          1HD1      ILE 128  45.530 -13.515 -23.579
  997   HD13  ILE 128          2HD1      ILE 128  46.197 -14.602 -22.358
  998    H    LYS 129           H        LYS 129  42.641 -17.778 -22.798
  999    HA   LYS 129           HA       LYS 129  40.195 -16.333 -21.974
 1000    HB2  LYS 129           2HB      LYS 129  40.548 -19.326 -22.288
 1001    HB3  LYS 129           3HB      LYS 129  39.430 -18.659 -21.086
 1002    HG2  LYS 129           2HG      LYS 129  38.161 -17.506 -22.821
 1003    HG3  LYS 129           3HG      LYS 129  39.309 -18.025 -24.063
 1004    HD2  LYS 129           2HD      LYS 129  37.680 -19.948 -22.367
 1005    HD3  LYS 129           3HD      LYS 129  37.132 -19.333 -23.936
 1006    HE2  LYS 129           2HE      LYS 129  39.708 -20.910 -23.489
 1007    HE3  LYS 129           3HE      LYS 129  38.180 -21.617 -24.051
 1008    HZ1  LYS 129           3HZ      LYS 129  38.317 -20.191 -25.998
 1009    HZ2  LYS 129           1HZ      LYS 129  39.739 -19.544 -25.472
 1010    HZ3  LYS 129           2HZ      LYS 129  39.673 -21.103 -25.904
 1011    H    LYS 130           H        LYS 130  40.370 -15.716 -19.899
 1012    HA   LYS 130           HA       LYS 130  42.498 -16.327 -18.131
 1013    HB2  LYS 130           2HB      LYS 130  40.853 -14.435 -17.931
 1014    HB3  LYS 130           3HB      LYS 130  39.619 -15.614 -17.437
 1015    HG2  LYS 130           2HG      LYS 130  40.978 -16.234 -15.469
 1016    HG3  LYS 130           3HG      LYS 130  42.252 -15.100 -15.977
 1017    HD2  LYS 130           2HD      LYS 130  40.607 -13.230 -15.797
 1018    HD3  LYS 130           3HD      LYS 130  39.391 -14.375 -15.202
 1019    HE2  LYS 130           2HE      LYS 130  42.074 -13.831 -13.862
 1020    HE3  LYS 130           3HE      LYS 130  40.553 -13.034 -13.412
 1021    HZ1  LYS 130           3HZ      LYS 130  39.661 -15.194 -12.842
 1022    HZ2  LYS 130           1HZ      LYS 130  41.073 -15.937 -13.263
 1023    HZ3  LYS 130           2HZ      LYS 130  41.033 -14.905 -11.984
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1   8.508 -26.471   1.808
    2    H2   MET   1           H2       MET   1   9.203 -27.505   2.872
    3    H3   MET   1           H3       MET   1   7.628 -27.150   3.017
    4    HA   MET   1           HA       MET   1   8.786 -29.220   1.667
    5    HB2  MET   1           2HB      MET   1   6.635 -29.274   2.892
    6    HB3  MET   1           3HB      MET   1   5.884 -28.282   1.640
    7    HG2  MET   1           2HG      MET   1   6.367 -30.039  -0.035
    8    HG3  MET   1           3HG      MET   1   7.158 -31.016   1.206
    9    HE1  MET   1           3HE      MET   1   4.892 -32.094  -0.772
   10    HE2  MET   1           1HE      MET   1   5.685 -33.099   0.467
   11    HE3  MET   1           2HE      MET   1   3.914 -33.058   0.353
   12    H    ALA   2           H        ALA   2   6.382 -27.050  -0.028
   13    HA   ALA   2           HA       ALA   2   8.245 -26.649  -2.253
   14    HB1  ALA   2           1HB      ALA   2   5.628 -28.211  -2.507
   15    HB2  ALA   2           2HB      ALA   2   6.618 -27.628  -3.858
   16    HB3  ALA   2           3HB      ALA   2   7.269 -28.854  -2.772
   17    H    ALA   3           H        ALA   3   7.082 -25.241  -3.932
   18    HA   ALA   3           HA       ALA   3   4.730 -23.751  -3.020
   19    HB1  ALA   3           1HB      ALA   3   7.440 -22.466  -3.608
   20    HB2  ALA   3           2HB      ALA   3   5.904 -21.591  -3.406
   21    HB3  ALA   3           3HB      ALA   3   6.601 -22.477  -2.043
   22    H    LYS   4           H        LYS   4   3.841 -22.513  -4.800
   23    HA   LYS   4           HA       LYS   4   4.023 -23.939  -7.335
   24    HB2  LYS   4           2HB      LYS   4   2.565 -21.396  -6.474
   25    HB3  LYS   4           3HB      LYS   4   2.386 -22.146  -8.077
   26    HG2  LYS   4           2HG      LYS   4   1.527 -24.212  -7.079
   27    HG3  LYS   4           3HG      LYS   4   1.828 -23.600  -5.452
   28    HD2  LYS   4           2HD      LYS   4  -0.505 -23.411  -5.876
   29    HD3  LYS   4           3HD      LYS   4   0.183 -21.784  -5.805
   30    HE2  LYS   4           2HE      LYS   4   0.194 -21.698  -8.302
   31    HE3  LYS   4           3HE      LYS   4  -0.468 -23.336  -8.369
   32    HZ1  LYS   4           3HZ      LYS   4  -2.460 -22.494  -7.236
   33    HZ2  LYS   4           1HZ      LYS   4  -1.840 -20.971  -7.207
   34    HZ3  LYS   4           2HZ      LYS   4  -2.190 -21.588  -8.605
   35    H    PHE   5           H        PHE   5   5.861 -21.334  -6.069
   36    HA   PHE   5           HA       PHE   5   7.154 -20.873  -8.675
   37    HB2  PHE   5           2HB      PHE   5   6.188 -18.710  -6.746
   38    HB3  PHE   5           3HB      PHE   5   7.313 -18.435  -8.053
   39    HD1  PHE   5           HD2      PHE   5   3.809 -19.402  -7.276
   40    HD2  PHE   5           HD1      PHE   5   6.544 -18.035 -10.296
   41    HE1  PHE   5           HE2      PHE   5   1.921 -19.107  -8.857
   42    HE2  PHE   5           HE1      PHE   5   4.645 -17.712 -11.860
   43    HZ   PHE   5           HZ       PHE   5   2.341 -18.278 -11.160
   44    H    GLU   6           H        GLU   6   9.413 -19.937  -8.225
   45    HA   GLU   6           HA       GLU   6  10.417 -20.464  -5.499
   46    HB2  GLU   6           2HB      GLU   6  11.436 -21.731  -8.070
   47    HB3  GLU   6           3HB      GLU   6  12.346 -21.672  -6.553
   48    HG2  GLU   6           2HG      GLU   6  10.512 -22.929  -5.422
   49    HG3  GLU   6           3HG      GLU   6   9.678 -23.071  -6.964
   50    H    VAL   7           H        VAL   7  12.267 -19.278  -5.033
   51    HA   VAL   7           HA       VAL   7  12.614 -16.735  -6.080
   52    HB   VAL   7           HB       VAL   7  14.741 -18.428  -4.701
   53   HG11  VAL   7          1HG1      VAL   7  14.236 -15.420  -4.724
   54   HG12  VAL   7          2HG1      VAL   7  15.494 -16.247  -3.783
   55   HG13  VAL   7          3HG1      VAL   7  15.563 -16.252  -5.547
   56   HG21  VAL   7          3HG2      VAL   7  12.495 -16.802  -3.443
   57   HG22  VAL   7          1HG2      VAL   7  12.654 -18.566  -3.385
   58   HG23  VAL   7          2HG2      VAL   7  13.837 -17.571  -2.572
   59    H    GLY   8           H        GLY   8  13.509 -15.892  -7.820
   60    HA2  GLY   8           2HA      GLY   8  15.133 -15.568  -9.418
   61    HA3  GLY   8           3HA      GLY   8  15.783 -17.191  -9.145
   62    H    SER   9           H        SER   9  12.595 -17.959  -9.468
   63    HA   SER   9           HA       SER   9  12.716 -18.623 -12.236
   64    HB2  SER   9           2HB      SER   9  10.218 -18.290 -10.522
   65    HB3  SER   9           3HB      SER   9  10.422 -19.280 -11.986
   66    HG   SER   9           HG       SER   9  10.592 -20.525 -10.027
   67    H    VAL  10           H        VAL  10  11.064 -17.830 -13.884
   68    HA   VAL  10           HA       VAL  10  10.339 -14.989 -13.613
   69    HB   VAL  10           HB       VAL  10  11.877 -16.125 -15.988
   70   HG11  VAL  10          1HG1      VAL  10  10.979 -13.275 -15.345
   71   HG12  VAL  10          2HG1      VAL  10  11.946 -13.765 -16.748
   72   HG13  VAL  10          3HG1      VAL  10  10.284 -14.323 -16.591
   73   HG21  VAL  10          3HG2      VAL  10  12.858 -14.153 -13.885
   74   HG22  VAL  10          1HG2      VAL  10  13.445 -15.819 -14.106
   75   HG23  VAL  10          2HG2      VAL  10  13.721 -14.627 -15.365
   76    H    TYR  11           H        TYR  11   8.342 -14.687 -14.367
   77    HA   TYR  11           HA       TYR  11   7.120 -16.607 -16.280
   78    HB2  TYR  11           2HB      TYR  11   6.088 -15.873 -13.513
   79    HB3  TYR  11           3HB      TYR  11   5.050 -16.502 -14.767
   80    HD1  TYR  11           HD2      TYR  11   5.194 -18.817 -15.563
   81    HD2  TYR  11           HD1      TYR  11   7.736 -17.368 -12.404
   82    HE1  TYR  11           HE2      TYR  11   5.726 -21.149 -14.930
   83    HE2  TYR  11           HE1      TYR  11   8.229 -19.706 -11.732
   84    HH   TYR  11           HH       TYR  11   7.873 -21.938 -12.176
   85    H    THR  12           H        THR  12   4.789 -15.600 -16.803
   86    HA   THR  12           HA       THR  12   5.023 -12.634 -16.938
   87    HB   THR  12           HB       THR  12   3.466 -14.516 -18.741
   88    HG1  THR  12           1HG      THR  12   5.081 -14.028 -20.228
   89   HG21  THR  12          1HG2      THR  12   4.139 -11.554 -19.026
   90   HG22  THR  12          2HG2      THR  12   3.268 -12.544 -20.222
   91   HG23  THR  12          3HG2      THR  12   2.540 -12.208 -18.659
   92    H    GLY  13           H        GLY  13   3.167 -11.415 -16.427
   93    HA2  GLY  13           2HA      GLY  13   0.863 -12.748 -15.192
   94    HA3  GLY  13           3HA      GLY  13   1.915 -11.808 -14.125
   95    H    LYS  14           H        LYS  14  -0.470 -10.839 -14.136
   96    HA   LYS  14           HA       LYS  14  -0.605  -8.632 -16.148
   97    HB2  LYS  14           2HB      LYS  14  -2.213 -10.630 -16.400
   98    HB3  LYS  14           3HB      LYS  14  -3.008 -10.070 -14.940
   99    HG2  LYS  14           2HG      LYS  14  -2.625  -8.472 -17.524
  100    HG3  LYS  14           3HG      LYS  14  -4.068  -9.383 -17.116
  101    HD2  LYS  14           2HD      LYS  14  -3.032  -6.888 -15.753
  102    HD3  LYS  14           3HD      LYS  14  -4.456  -7.030 -16.735
  103    HE2  LYS  14           2HE      LYS  14  -4.059  -8.416 -14.043
  104    HE3  LYS  14           3HE      LYS  14  -4.898  -6.885 -14.268
  105    HZ1  LYS  14           3HZ      LYS  14  -6.516  -8.021 -15.647
  106    HZ2  LYS  14           1HZ      LYS  14  -5.740  -9.462 -15.474
  107    HZ3  LYS  14           2HZ      LYS  14  -6.454  -8.727 -14.178
  108    H    VAL  15           H        VAL  15  -0.501  -6.687 -15.160
  109    HA   VAL  15           HA       VAL  15  -0.177  -6.465 -12.363
  110    HB   VAL  15           HB       VAL  15  -0.821  -4.204 -14.262
  111   HG11  VAL  15          1HG1      VAL  15   0.894  -4.378 -11.735
  112   HG12  VAL  15          2HG1      VAL  15   0.660  -2.920 -12.716
  113   HG13  VAL  15          3HG1      VAL  15  -0.704  -3.626 -11.846
  114   HG21  VAL  15          3HG2      VAL  15   1.916  -5.486 -13.809
  115   HG22  VAL  15          1HG2      VAL  15   0.988  -5.493 -15.322
  116   HG23  VAL  15          2HG2      VAL  15   1.591  -3.986 -14.707
  117    H    THR  16           H        THR  16  -1.656  -6.431 -10.800
  118    HA   THR  16           HA       THR  16  -4.503  -6.089 -11.464
  119    HB   THR  16           HB       THR  16  -4.529  -7.053  -8.966
  120    HG1  THR  16           1HG      THR  16  -2.760  -8.463  -8.707
  121   HG21  THR  16          1HG2      THR  16  -3.791  -8.739 -11.400
  122   HG22  THR  16          2HG2      THR  16  -4.562  -9.314  -9.899
  123   HG23  THR  16          3HG2      THR  16  -5.436  -8.212 -10.955
  124    H    GLY  17           H        GLY  17  -1.924  -4.322  -9.835
  125    HA2  GLY  17           2HA      GLY  17  -3.607  -2.040  -9.663
  126    HA3  GLY  17           3HA      GLY  17  -3.478  -2.770  -8.063
  127    H    LEU  18           H        LEU  18  -2.506  -0.265  -8.346
  128    HA   LEU  18           HA       LEU  18   0.436  -0.636  -8.108
  129    HB2  LEU  18           2HB      LEU  18  -1.059   1.782  -9.208
  130    HB3  LEU  18           3HB      LEU  18   0.660   1.728  -8.852
  131    HG   LEU  18           HG       LEU  18  -0.764   0.138 -11.017
  132   HD11  LEU  18          1HD1      LEU  18   1.215   2.451 -11.180
  133   HD12  LEU  18          2HD1      LEU  18   0.555   1.566 -12.559
  134   HD13  LEU  18          3HD1      LEU  18  -0.513   2.535 -11.537
  135   HD21  LEU  18          3HD2      LEU  18   2.212   0.241 -10.376
  136   HD22  LEU  18          1HD2      LEU  18   1.132  -1.157 -10.156
  137   HD23  LEU  18          2HD2      LEU  18   1.463  -0.568 -11.774
  138    H    GLN  19           H        GLN  19   1.347   0.501  -6.417
  139    HA   GLN  19           HA       GLN  19  -0.370   1.930  -4.465
  140    HB2  GLN  19           2HB      GLN  19   1.540  -0.384  -3.880
  141    HB3  GLN  19           3HB      GLN  19   0.762   0.618  -2.671
  142    HG2  GLN  19           2HG      GLN  19  -0.886  -1.045  -4.612
  143    HG3  GLN  19           3HG      GLN  19  -0.194  -1.729  -3.165
  144   HE21  GLN  19          2HE2      GLN  19  -1.225  -1.432  -1.257
  145   HE22  GLN  19          1HE2      GLN  19  -2.653  -0.380  -1.023
  146    H    ALA  20           H        ALA  20   1.064   3.253  -3.049
  147    HA   ALA  20           HA       ALA  20   3.268   4.435  -4.363
  148    HB1  ALA  20           1HB      ALA  20   2.551   4.499  -1.400
  149    HB2  ALA  20           2HB      ALA  20   3.600   5.647  -2.253
  150    HB3  ALA  20           3HB      ALA  20   1.878   5.568  -2.661
  151    H    TYR  21           H        TYR  21   3.269   1.414  -2.853
  152    HA   TYR  21           HA       TYR  21   6.210   1.465  -2.420
  153    HB2  TYR  21           2HB      TYR  21   5.849  -0.211  -0.682
  154    HB3  TYR  21           3HB      TYR  21   5.028   1.287  -0.324
  155    HD1  TYR  21           HD2      TYR  21   4.525  -2.235  -1.460
  156    HD2  TYR  21           HD1      TYR  21   2.619   1.372  -0.062
  157    HE1  TYR  21           HE2      TYR  21   2.388  -3.470  -1.167
  158    HE2  TYR  21           HE1      TYR  21   0.502   0.142   0.249
  159    HH   TYR  21           HH       TYR  21  -0.546  -1.913   0.167
  160    H    GLY  22           H        GLY  22   3.942   0.311  -4.658
  161    HA2  GLY  22           2HA      GLY  22   5.676  -1.370  -5.970
  162    HA3  GLY  22           3HA      GLY  22   4.914  -2.416  -4.772
  163    H    ALA  23           H        ALA  23   4.448  -3.338  -7.081
  164    HA   ALA  23           HA       ALA  23   1.744  -2.438  -7.970
  165    HB1  ALA  23           1HB      ALA  23   4.038  -3.549  -9.643
  166    HB2  ALA  23           2HB      ALA  23   2.402  -3.237 -10.223
  167    HB3  ALA  23           3HB      ALA  23   3.424  -1.884  -9.691
  168    H    PHE  24           H        PHE  24   0.253  -3.996  -7.692
  169    HA   PHE  24           HA       PHE  24   1.030  -6.716  -6.934
  170    HB2  PHE  24           2HB      PHE  24  -1.685  -5.509  -7.611
  171    HB3  PHE  24           3HB      PHE  24  -1.409  -7.117  -6.977
  172    HD1  PHE  24           HD2      PHE  24   0.072  -7.174  -4.711
  173    HD2  PHE  24           HD1      PHE  24  -2.379  -3.889  -6.056
  174    HE1  PHE  24           HE2      PHE  24  -0.141  -6.359  -2.375
  175    HE2  PHE  24           HE1      PHE  24  -2.612  -3.106  -3.725
  176    HZ   PHE  24           HZ       PHE  24  -1.489  -4.342  -1.878
  177    H    VAL  25           H        VAL  25   1.085  -8.481  -8.347
  178    HA   VAL  25           HA       VAL  25   0.019  -8.134 -11.098
  179    HB   VAL  25           HB       VAL  25   2.773  -9.287 -10.473
  180   HG11  VAL  25          1HG1      VAL  25   1.395  -8.593 -13.104
  181   HG12  VAL  25          2HG1      VAL  25   3.036  -9.220 -12.945
  182   HG13  VAL  25          3HG1      VAL  25   1.672 -10.230 -12.468
  183   HG21  VAL  25          3HG2      VAL  25   2.117  -6.588 -11.737
  184   HG22  VAL  25          1HG2      VAL  25   2.867  -6.839 -10.155
  185   HG23  VAL  25          2HG2      VAL  25   3.731  -7.322 -11.602
  186    H    ALA  26           H        ALA  26  -1.460  -9.683 -11.300
  187    HA   ALA  26           HA       ALA  26  -1.459 -12.164  -9.812
  188    HB1  ALA  26           1HB      ALA  26  -3.003 -11.299 -12.280
  189    HB2  ALA  26           2HB      ALA  26  -3.323 -12.752 -11.299
  190    HB3  ALA  26           3HB      ALA  26  -3.547 -11.158 -10.585
  191    H    LEU  27           H        LEU  27  -1.037 -14.244 -10.613
  192    HA   LEU  27           HA       LEU  27   1.018 -14.298 -12.812
  193    HB2  LEU  27           2HB      LEU  27   1.019 -15.667 -10.083
  194    HB3  LEU  27           3HB      LEU  27   2.207 -15.929 -11.352
  195    HG   LEU  27           HG       LEU  27   1.769 -13.257  -9.970
  196   HD11  LEU  27          1HD1      LEU  27   3.881 -15.382  -9.482
  197   HD12  LEU  27          2HD1      LEU  27   3.836 -13.776  -8.738
  198   HD13  LEU  27          3HD1      LEU  27   2.566 -14.944  -8.385
  199   HD21  LEU  27          3HD2      LEU  27   4.035 -14.218 -11.773
  200   HD22  LEU  27          1HD2      LEU  27   2.780 -13.031 -12.213
  201   HD23  LEU  27          2HD2      LEU  27   3.930 -12.655 -10.922
  202    H    ASP  28           H        ASP  28  -1.542 -15.938 -10.971
  203    HA   ASP  28           HA       ASP  28  -2.000 -17.945 -13.044
  204    HB2  ASP  28           2HB      ASP  28  -0.446 -19.247 -11.907
  205    HB3  ASP  28           3HB      ASP  28  -0.728 -18.473 -10.372
  206    H    GLU  29           H        GLU  29  -4.049 -19.120 -12.431
  207    HA   GLU  29           HA       GLU  29  -6.119 -17.300 -11.963
  208    HB2  GLU  29           2HB      GLU  29  -6.006 -20.331 -11.828
  209    HB3  GLU  29           3HB      GLU  29  -7.515 -19.415 -11.803
  210    HG2  GLU  29           2HG      GLU  29  -5.458 -19.363 -14.061
  211    HG3  GLU  29           3HG      GLU  29  -6.925 -20.301 -14.057
  212    H    GLU  30           H        GLU  30  -4.222 -19.008  -9.562
  213    HA   GLU  30           HA       GLU  30  -6.056 -17.963  -7.437
  214    HB2  GLU  30           2HB      GLU  30  -4.562 -20.610  -7.517
  215    HB3  GLU  30           3HB      GLU  30  -5.444 -20.000  -6.134
  216    HG2  GLU  30           2HG      GLU  30  -6.647 -20.792  -8.808
  217    HG3  GLU  30           3HG      GLU  30  -6.709 -21.690  -7.319
  218    H    THR  31           H        THR  31  -3.265 -17.107  -8.792
  219    HA   THR  31           HA       THR  31  -1.907 -16.639  -6.187
  220    HB   THR  31           HB       THR  31  -0.255 -17.592  -8.524
  221    HG1  THR  31           1HG      THR  31  -0.357 -19.649  -7.737
  222   HG21  THR  31          1HG2      THR  31   0.063 -17.842  -5.504
  223   HG22  THR  31          2HG2      THR  31   1.236 -18.381  -6.714
  224   HG23  THR  31          3HG2      THR  31   0.883 -16.658  -6.545
  225    H    GLN  32           H        GLN  32  -0.768 -14.760  -6.047
  226    HA   GLN  32           HA       GLN  32  -0.008 -13.278  -8.461
  227    HB2  GLN  32           2HB      GLN  32  -1.005 -11.219  -7.658
  228    HB3  GLN  32           3HB      GLN  32  -2.257 -12.434  -7.861
  229    HG2  GLN  32           2HG      GLN  32  -2.467 -12.761  -5.492
  230    HG3  GLN  32           3HG      GLN  32  -1.039 -11.770  -5.163
  231   HE21  GLN  32          2HE2      GLN  32  -1.148  -9.426  -5.954
  232   HE22  GLN  32          1HE2      GLN  32  -2.719  -8.647  -5.767
  233    H    GLY  33           H        GLY  33   1.369 -11.330  -7.757
  234    HA2  GLY  33           2HA      GLY  33   2.673 -11.648  -5.124
  235    HA3  GLY  33           3HA      GLY  33   3.686 -11.721  -6.570
  236    H    LEU  34           H        LEU  34   4.589  -9.824  -5.313
  237    HA   LEU  34           HA       LEU  34   3.232  -7.252  -5.985
  238    HB2  LEU  34           2HB      LEU  34   2.670  -7.757  -3.703
  239    HB3  LEU  34           3HB      LEU  34   4.334  -8.216  -3.327
  240    HG   LEU  34           HG       LEU  34   5.078  -5.867  -3.612
  241   HD11  LEU  34          1HD1      LEU  34   2.118  -5.227  -4.029
  242   HD12  LEU  34          2HD1      LEU  34   3.433  -4.050  -3.825
  243   HD13  LEU  34          3HD1      LEU  34   3.396  -5.075  -5.249
  244   HD21  LEU  34          3HD2      LEU  34   2.706  -6.229  -1.736
  245   HD22  LEU  34          1HD2      LEU  34   4.389  -6.670  -1.400
  246   HD23  LEU  34          2HD2      LEU  34   3.970  -4.983  -1.603
  247    H    VAL  35           H        VAL  35   4.620  -6.540  -7.542
  248    HA   VAL  35           HA       VAL  35   7.484  -6.707  -7.347
  249    HB   VAL  35           HB       VAL  35   5.832  -4.627  -8.830
  250   HG11  VAL  35          1HG1      VAL  35   8.660  -5.688  -9.250
  251   HG12  VAL  35          2HG1      VAL  35   7.845  -4.487 -10.267
  252   HG13  VAL  35          3HG1      VAL  35   8.245  -4.103  -8.593
  253   HG21  VAL  35          3HG2      VAL  35   6.817  -7.305  -9.905
  254   HG22  VAL  35          1HG2      VAL  35   5.120  -6.863  -9.590
  255   HG23  VAL  35          2HG2      VAL  35   6.033  -6.024 -10.832
  256    H    HIS  36           H        HIS  36   8.645  -5.723  -5.731
  257    HA   HIS  36           HA       HIS  36   7.424  -3.565  -4.144
  258    HB2  HIS  36           2HB      HIS  36  10.165  -4.906  -4.154
  259    HB3  HIS  36           3HB      HIS  36   9.717  -3.600  -3.056
  260    HD1  HIS  36           HD1      HIS  36   7.517  -6.740  -3.893
  261    HD2  HIS  36           HD2      HIS  36   9.566  -4.839  -0.735
  262    HE1  HIS  36           HE1      HIS  36   6.950  -8.009  -1.790
  263    H    ILE  37           H        ILE  37   7.848  -1.361  -4.404
  264    HA   ILE  37           HA       ILE  37   8.458  -0.428  -6.930
  265    HB   ILE  37           HB       ILE  37   7.127   0.769  -5.288
  266   HG12  ILE  37          2HG1      ILE  37   9.400   2.448  -6.400
  267   HG13  ILE  37          3HG1      ILE  37   8.052   1.801  -7.351
  268   HG21  ILE  37          1HG2      ILE  37   9.792   1.526  -3.998
  269   HG22  ILE  37          2HG2      ILE  37   8.234   2.213  -3.581
  270   HG23  ILE  37          3HG2      ILE  37   8.528   0.519  -3.265
  271   HD11  ILE  37          3HD1      ILE  37   6.438   3.083  -5.976
  272   HD12  ILE  37          1HD1      ILE  37   7.775   3.768  -5.036
  273   HD13  ILE  37          2HD1      ILE  37   7.641   4.138  -6.745
  274    H    SER  38           H        SER  38  10.761  -0.870  -4.275
  275    HA   SER  38           HA       SER  38  12.931   0.516  -5.346
  276    HB2  SER  38           2HB      SER  38  13.052  -2.046  -3.733
  277    HB3  SER  38           3HB      SER  38  14.207  -0.701  -3.730
  278    HG   SER  38           HG       SER  38  12.777  -0.663  -1.930
  279    H    GLU  39           H        GLU  39  11.506  -2.416  -6.519
  280    HA   GLU  39           HA       GLU  39  13.930  -3.012  -8.134
  281    HB2  GLU  39           2HB      GLU  39  11.878  -5.037  -7.217
  282    HB3  GLU  39           3HB      GLU  39  13.442  -5.332  -7.960
  283    HG2  GLU  39           2HG      GLU  39  12.870  -4.387  -5.140
  284    HG3  GLU  39           3HG      GLU  39  13.586  -5.893  -5.648
  285    H    VAL  40           H        VAL  40  11.157  -1.469  -8.527
  286    HA   VAL  40           HA       VAL  40  10.037  -2.723 -10.866
  287    HB   VAL  40           HB       VAL  40   9.942   0.062  -9.708
  288   HG11  VAL  40          1HG1      VAL  40   8.408  -0.888 -12.146
  289   HG12  VAL  40          2HG1      VAL  40   8.143   0.639 -11.272
  290   HG13  VAL  40          3HG1      VAL  40   9.658   0.362 -12.126
  291   HG21  VAL  40          3HG2      VAL  40   7.858  -2.136 -10.001
  292   HG22  VAL  40          1HG2      VAL  40   8.702  -1.713  -8.526
  293   HG23  VAL  40          2HG2      VAL  40   7.583  -0.546  -9.260
  294    H    THR  41           H        THR  41  12.826  -0.553 -10.380
  295    HA   THR  41           HA       THR  41  13.756  -1.164 -13.086
  296    HB   THR  41           HB       THR  41  13.127   1.670 -12.146
  297    HG1  THR  41           1HG      THR  41  11.901   1.558 -14.091
  298   HG21  THR  41          1HG2      THR  41  14.415   0.786 -14.776
  299   HG22  THR  41          2HG2      THR  41  13.907   2.438 -14.357
  300   HG23  THR  41          3HG2      THR  41  15.224   1.685 -13.473
  301    H    HIS  42           H        HIS  42  16.071  -0.791 -13.184
  302    HA   HIS  42           HA       HIS  42  17.451  -0.911 -10.646
  303    HB2  HIS  42           2HB      HIS  42  19.443  -1.265 -12.100
  304    HB3  HIS  42           3HB      HIS  42  18.143  -2.402 -12.392
  305    HD1  HIS  42           HD1      HIS  42  19.237   0.964 -13.948
  306    HD2  HIS  42           HD2      HIS  42  17.769  -2.844 -14.979
  307    HE1  HIS  42           HE1      HIS  42  19.112   0.884 -16.518
  308    H    GLY  43           H        GLY  43  16.174   1.516 -10.694
  309    HA2  GLY  43           2HA      GLY  43  18.207   3.412 -10.187
  310    HA3  GLY  43           3HA      GLY  43  17.483   3.744 -11.767
  311    H    PHE  44           H        PHE  44  17.064   5.684  -9.989
  312    HA   PHE  44           HA       PHE  44  14.934   5.422  -8.175
  313    HB2  PHE  44           2HB      PHE  44  15.856   7.866  -9.729
  314    HB3  PHE  44           3HB      PHE  44  14.794   7.898  -8.336
  315    HD1  PHE  44           HD2      PHE  44  15.691   6.907  -6.097
  316    HD2  PHE  44           HD1      PHE  44  18.206   8.004  -9.421
  317    HE1  PHE  44           HE2      PHE  44  17.648   7.027  -4.581
  318    HE2  PHE  44           HE1      PHE  44  20.159   8.120  -7.903
  319    HZ   PHE  44           HZ       PHE  44  19.886   7.635  -5.479
  320    H    VAL  45           H        VAL  45  12.931   4.749  -8.638
  321    HA   VAL  45           HA       VAL  45  11.559   5.075 -11.118
  322    HB   VAL  45           HB       VAL  45  10.634   4.480  -8.271
  323   HG11  VAL  45          1HG1      VAL  45   9.052   4.177 -10.872
  324   HG12  VAL  45          2HG1      VAL  45   8.551   3.618  -9.262
  325   HG13  VAL  45          3HG1      VAL  45   8.725   5.338  -9.564
  326   HG21  VAL  45          3HG2      VAL  45  11.091   2.658 -10.688
  327   HG22  VAL  45          1HG2      VAL  45  12.117   2.745  -9.237
  328   HG23  VAL  45          2HG2      VAL  45  10.469   2.163  -9.101
  329    H    LYS  46           H        LYS  46  10.602   6.868 -11.928
  330    HA   LYS  46           HA       LYS  46  10.757   9.419 -10.616
  331    HB2  LYS  46           2HB      LYS  46   8.907   8.565 -12.905
  332    HB3  LYS  46           3HB      LYS  46   9.341  10.221 -12.477
  333    HG2  LYS  46           2HG      LYS  46  11.677   9.822 -13.134
  334    HG3  LYS  46           3HG      LYS  46  11.340   8.117 -13.412
  335    HD2  LYS  46           2HD      LYS  46   9.467   9.107 -15.083
  336    HD3  LYS  46           3HD      LYS  46  10.549  10.497 -15.053
  337    HE2  LYS  46           2HE      LYS  46  11.288   9.194 -16.889
  338    HE3  LYS  46           3HE      LYS  46  12.460   8.872 -15.599
  339    HZ1  LYS  46           3HZ      LYS  46  11.233   6.827 -15.122
  340    HZ2  LYS  46           1HZ      LYS  46  10.161   7.139 -16.308
  341    HZ3  LYS  46           2HZ      LYS  46  11.750   6.839 -16.686
  342    H    ASP  47           H        ASP  47   7.968   7.369 -11.405
  343    HA   ASP  47           HA       ASP  47   6.813   7.395  -8.790
  344    HB2  ASP  47           2HB      ASP  47   5.744   9.458  -9.519
  345    HB3  ASP  47           3HB      ASP  47   5.407   8.782 -11.111
  346    H    ILE  48           H        ILE  48   5.426   5.445  -8.807
  347    HA   ILE  48           HA       ILE  48   6.397   3.504 -10.592
  348    HB   ILE  48           HB       ILE  48   5.665   3.118  -8.274
  349   HG12  ILE  48          2HG1      ILE  48   4.362   1.272 -10.297
  350   HG13  ILE  48          3HG1      ILE  48   6.089   1.318  -9.898
  351   HG21  ILE  48          1HG2      ILE  48   2.832   3.241  -9.392
  352   HG22  ILE  48          2HG2      ILE  48   3.264   2.705  -7.775
  353   HG23  ILE  48          3HG2      ILE  48   3.549   4.362  -8.224
  354   HD11  ILE  48          3HD1      ILE  48   5.592   0.722  -7.545
  355   HD12  ILE  48          1HD1      ILE  48   3.864   0.638  -7.939
  356   HD13  ILE  48          2HD1      ILE  48   4.981  -0.492  -8.682
  357    H    ASN  49           H        ASN  49   3.399   5.442 -10.917
  358    HA   ASN  49           HA       ASN  49   2.400   3.800 -13.060
  359    HB2  ASN  49           2HB      ASN  49   0.631   5.138 -13.006
  360    HB3  ASN  49           3HB      ASN  49   1.338   5.853 -11.566
  361   HD21  ASN  49          2HD2      ASN  49   2.863   7.775 -11.970
  362   HD22  ASN  49          1HD2      ASN  49   2.475   8.808 -13.367
  363    H    GLU  50           H        GLU  50   5.039   6.029 -13.007
  364    HA   GLU  50           HA       GLU  50   4.947   6.431 -15.929
  365    HB2  GLU  50           2HB      GLU  50   7.116   7.176 -13.931
  366    HB3  GLU  50           3HB      GLU  50   6.998   7.728 -15.583
  367    HG2  GLU  50           2HG      GLU  50   5.095   8.355 -13.294
  368    HG3  GLU  50           3HG      GLU  50   6.283   9.433 -13.969
  369    H    HIS  51           H        HIS  51   5.814   3.857 -13.971
  370    HA   HIS  51           HA       HIS  51   7.904   2.872 -15.879
  371    HB2  HIS  51           2HB      HIS  51   7.810   2.616 -12.852
  372    HB3  HIS  51           3HB      HIS  51   8.821   1.630 -13.891
  373    HD1  HIS  51           HD1      HIS  51  11.091   2.482 -14.031
  374    HD2  HIS  51           HD2      HIS  51   8.404   5.526 -13.385
  375    HE1  HIS  51           HE1      HIS  51  12.543   4.592 -13.814
  376    H    LEU  52           H        LEU  52   4.901   2.219 -14.256
  377    HA   LEU  52           HA       LEU  52   4.607  -0.334 -15.638
  378    HB2  LEU  52           2HB      LEU  52   4.543   0.110 -12.624
  379    HB3  LEU  52           3HB      LEU  52   3.482  -1.093 -13.334
  380    HG   LEU  52           HG       LEU  52   6.506  -1.139 -13.606
  381   HD11  LEU  52          1HD1      LEU  52   4.612  -2.778 -11.878
  382   HD12  LEU  52          2HD1      LEU  52   6.365  -3.015 -12.014
  383   HD13  LEU  52          3HD1      LEU  52   5.740  -1.536 -11.297
  384   HD21  LEU  52          3HD2      LEU  52   4.395  -3.221 -14.359
  385   HD22  LEU  52          1HD2      LEU  52   5.361  -2.278 -15.514
  386   HD23  LEU  52          2HD2      LEU  52   6.151  -3.418 -14.473
  387    H    SER  53           H        SER  53   2.234  -1.059 -15.410
  388    HA   SER  53           HA       SER  53   0.355   1.210 -15.094
  389    HB2  SER  53           2HB      SER  53   0.618  -0.544 -17.581
  390    HB3  SER  53           3HB      SER  53  -0.593   0.724 -17.298
  391    HG   SER  53           HG       SER  53   1.214   1.426 -18.576
  392    H    VAL  54           H        VAL  54  -1.424   0.399 -13.968
  393    HA   VAL  54           HA       VAL  54  -1.911  -2.383 -13.543
  394    HB   VAL  54           HB       VAL  54  -2.688  -0.704 -11.996
  395   HG11  VAL  54          1HG1      VAL  54  -4.567   0.287 -14.171
  396   HG12  VAL  54          2HG1      VAL  54  -4.594   0.793 -12.477
  397   HG13  VAL  54          3HG1      VAL  54  -3.204   1.184 -13.486
  398   HG21  VAL  54          3HG2      VAL  54  -5.021  -2.166 -13.273
  399   HG22  VAL  54          1HG2      VAL  54  -3.917  -2.783 -12.023
  400   HG23  VAL  54          2HG2      VAL  54  -5.012  -1.438 -11.667
  401    H    GLY  55           H        GLY  55  -3.378  -3.786 -14.466
  402    HA2  GLY  55           2HA      GLY  55  -4.735  -4.672 -16.059
  403    HA3  GLY  55           3HA      GLY  55  -5.107  -3.039 -16.636
  404    H    ASP  56           H        ASP  56  -1.763  -4.266 -16.450
  405    HA   ASP  56           HA       ASP  56  -1.703  -4.647 -19.412
  406    HB2  ASP  56           2HB      ASP  56  -0.654  -2.498 -18.651
  407    HB3  ASP  56           3HB      ASP  56   0.439  -3.438 -17.635
  408    H    GLU  57           H        GLU  57   0.201  -6.051 -20.026
  409    HA   GLU  57           HA       GLU  57   0.491  -8.293 -18.072
  410    HB2  GLU  57           2HB      GLU  57  -0.887  -8.790 -20.056
  411    HB3  GLU  57           3HB      GLU  57   0.455  -8.313 -21.109
  412    HG2  GLU  57           2HG      GLU  57   1.832 -10.149 -20.180
  413    HG3  GLU  57           3HG      GLU  57   0.523 -10.602 -19.100
  414    H    VAL  58           H        VAL  58   2.544  -8.890 -17.532
  415    HA   VAL  58           HA       VAL  58   4.866  -7.653 -18.889
  416    HB   VAL  58           HB       VAL  58   5.685  -6.841 -16.645
  417   HG11  VAL  58          1HG1      VAL  58   3.123  -5.506 -17.645
  418   HG12  VAL  58          2HG1      VAL  58   4.338  -4.763 -16.604
  419   HG13  VAL  58          3HG1      VAL  58   4.751  -5.233 -18.252
  420   HG21  VAL  58          3HG2      VAL  58   2.800  -7.260 -15.738
  421   HG22  VAL  58          1HG2      VAL  58   4.232  -8.106 -15.128
  422   HG23  VAL  58          2HG2      VAL  58   4.064  -6.373 -14.858
  423    H    GLN  59           H        GLN  59   6.766  -8.822 -18.645
  424    HA   GLN  59           HA       GLN  59   6.681 -11.446 -17.370
  425    HB2  GLN  59           2HB      GLN  59   8.833  -9.781 -18.736
  426    HB3  GLN  59           3HB      GLN  59   9.210 -11.246 -17.833
  427    HG2  GLN  59           2HG      GLN  59   9.038 -11.885 -20.119
  428    HG3  GLN  59           3HG      GLN  59   7.666 -12.557 -19.264
  429   HE21  GLN  59          2HE2      GLN  59   5.840 -12.436 -20.493
  430   HE22  GLN  59          1HE2      GLN  59   5.423 -11.129 -21.612
  431    H    VAL  60           H        VAL  60   7.467 -11.889 -15.312
  432    HA   VAL  60           HA       VAL  60   8.623  -9.698 -13.672
  433    HB   VAL  60           HB       VAL  60   7.186 -10.877 -11.810
  434   HG11  VAL  60          1HG1      VAL  60   5.931  -8.981 -13.805
  435   HG12  VAL  60          2HG1      VAL  60   5.358  -9.256 -12.154
  436   HG13  VAL  60          3HG1      VAL  60   6.953  -8.547 -12.399
  437   HG21  VAL  60          3HG2      VAL  60   5.416 -11.454 -14.241
  438   HG22  VAL  60          1HG2      VAL  60   6.186 -12.666 -13.182
  439   HG23  VAL  60          2HG2      VAL  60   4.951 -11.566 -12.557
  440    H    LYS  61           H        LYS  61  10.265 -10.343 -12.355
  441    HA   LYS  61           HA       LYS  61  11.029 -13.226 -12.395
  442    HB2  LYS  61           2HB      LYS  61  12.760 -11.588 -12.970
  443    HB3  LYS  61           3HB      LYS  61  12.507 -10.743 -11.431
  444    HG2  LYS  61           2HG      LYS  61  13.285 -12.685 -10.175
  445    HG3  LYS  61           3HG      LYS  61  13.382 -13.656 -11.652
  446    HD2  LYS  61           2HD      LYS  61  15.156 -12.169 -12.522
  447    HD3  LYS  61           3HD      LYS  61  15.060 -11.192 -11.031
  448    HE2  LYS  61           2HE      LYS  61  15.666 -13.201  -9.696
  449    HE3  LYS  61           3HE      LYS  61  15.760 -14.165 -11.177
  450    HZ1  LYS  61           3HZ      LYS  61  17.567 -12.744 -11.921
  451    HZ2  LYS  61           1HZ      LYS  61  17.484 -11.840 -10.541
  452    HZ3  LYS  61           2HZ      LYS  61  17.920 -13.416 -10.463
  453    H    VAL  62           H        VAL  62  10.711 -14.481 -10.606
  454    HA   VAL  62           HA       VAL  62   9.422 -13.526  -8.220
  455    HB   VAL  62           HB       VAL  62  10.901 -16.129  -8.776
  456   HG11  VAL  62          1HG1      VAL  62   8.872 -15.381  -6.620
  457   HG12  VAL  62          2HG1      VAL  62   9.540 -17.000  -6.879
  458   HG13  VAL  62          3HG1      VAL  62  10.584 -15.689  -6.351
  459   HG21  VAL  62          3HG2      VAL  62   7.925 -15.464  -8.990
  460   HG22  VAL  62          1HG2      VAL  62   9.014 -15.808 -10.354
  461   HG23  VAL  62          2HG2      VAL  62   8.664 -17.070  -9.188
  462    H    LEU  63           H        LEU  63  10.354 -12.265  -6.780
  463    HA   LEU  63           HA       LEU  63  13.282 -12.216  -6.471
  464    HB2  LEU  63           2HB      LEU  63  11.972 -10.138  -6.771
  465    HB3  LEU  63           3HB      LEU  63  11.051 -10.503  -5.318
  466    HG   LEU  63           HG       LEU  63  13.136 -10.348  -3.952
  467   HD11  LEU  63          1HD1      LEU  63  14.400  -9.379  -6.552
  468   HD12  LEU  63          2HD1      LEU  63  15.150  -9.333  -4.956
  469   HD13  LEU  63          3HD1      LEU  63  14.816 -10.885  -5.700
  470   HD21  LEU  63          3HD2      LEU  63  12.452  -7.921  -5.655
  471   HD22  LEU  63          1HD2      LEU  63  11.630  -8.435  -4.177
  472   HD23  LEU  63          2HD2      LEU  63  13.312  -7.888  -4.100
  473    H    ALA  64           H        ALA  64  10.332 -13.055  -4.636
  474    HA   ALA  64           HA       ALA  64  11.834 -14.856  -2.938
  475    HB1  ALA  64           1HB      ALA  64  10.392 -12.480  -1.696
  476    HB2  ALA  64           2HB      ALA  64  11.011 -13.873  -0.809
  477    HB3  ALA  64           3HB      ALA  64  12.140 -12.792  -1.638
  478    H    VAL  65           H        VAL  65  10.224 -16.218  -1.650
  479    HA   VAL  65           HA       VAL  65   7.390 -15.795  -2.190
  480    HB   VAL  65           HB       VAL  65   7.895 -17.061  -4.114
  481   HG11  VAL  65          1HG1      VAL  65   9.496 -19.007  -2.411
  482   HG12  VAL  65          2HG1      VAL  65   9.112 -19.199  -4.127
  483   HG13  VAL  65          3HG1      VAL  65  10.150 -17.881  -3.620
  484   HG21  VAL  65          3HG2      VAL  65   6.882 -19.039  -2.033
  485   HG22  VAL  65          1HG2      VAL  65   5.914 -17.906  -2.966
  486   HG23  VAL  65          2HG2      VAL  65   6.754 -19.216  -3.793
  487    H    ASP  66           H        ASP  66   6.117 -16.560  -0.584
  488    HA   ASP  66           HA       ASP  66   7.151 -18.537   1.333
  489    HB2  ASP  66           2HB      ASP  66   7.590 -16.286   2.338
  490    HB3  ASP  66           3HB      ASP  66   5.884 -15.908   2.200
  491    H    GLU  67           H        GLU  67   5.720 -20.084   0.742
  492    HA   GLU  67           HA       GLU  67   3.116 -19.501  -0.329
  493    HB2  GLU  67           2HB      GLU  67   4.792 -21.360  -0.941
  494    HB3  GLU  67           3HB      GLU  67   4.250 -22.182   0.519
  495    HG2  GLU  67           2HG      GLU  67   3.035 -23.111  -1.311
  496    HG3  GLU  67           3HG      GLU  67   1.895 -22.127  -0.430
  497    H    GLU  68           H        GLU  68   4.287 -20.054   2.942
  498    HA   GLU  68           HA       GLU  68   1.738 -21.029   3.971
  499    HB2  GLU  68           2HB      GLU  68   4.043 -19.705   5.470
  500    HB3  GLU  68           3HB      GLU  68   2.734 -20.634   6.163
  501    HG2  GLU  68           2HG      GLU  68   4.931 -21.698   4.346
  502    HG3  GLU  68           3HG      GLU  68   4.804 -21.926   6.069
  503    H    LYS  69           H        LYS  69   3.522 -17.923   3.888
  504    HA   LYS  69           HA       LYS  69   1.291 -16.308   4.862
  505    HB2  LYS  69           2HB      LYS  69   3.814 -15.633   3.271
  506    HB3  LYS  69           3HB      LYS  69   2.694 -14.416   3.903
  507    HG2  LYS  69           2HG      LYS  69   3.115 -15.148   6.214
  508    HG3  LYS  69           3HG      LYS  69   4.180 -16.442   5.632
  509    HD2  LYS  69           2HD      LYS  69   5.662 -14.692   4.584
  510    HD3  LYS  69           3HD      LYS  69   4.627 -13.450   5.293
  511    HE2  LYS  69           2HE      LYS  69   6.631 -13.772   6.649
  512    HE3  LYS  69           3HE      LYS  69   5.180 -14.222   7.563
  513    HZ1  LYS  69           3HZ      LYS  69   5.703 -16.544   7.023
  514    HZ2  LYS  69           1HZ      LYS  69   6.992 -16.144   6.188
  515    HZ3  LYS  69           2HZ      LYS  69   6.962 -15.846   7.833
  516    H    GLY  70           H        GLY  70   1.975 -17.807   1.797
  517    HA2  GLY  70           2HA      GLY  70   0.995 -17.684  -0.261
  518    HA3  GLY  70           3HA      GLY  70  -0.380 -16.860   0.506
  519    H    LYS  71           H        LYS  71   3.115 -16.020   0.052
  520    HA   LYS  71           HA       LYS  71   2.311 -13.540  -1.393
  521    HB2  LYS  71           2HB      LYS  71   4.287 -13.694   0.934
  522    HB3  LYS  71           3HB      LYS  71   4.020 -12.268  -0.068
  523    HG2  LYS  71           2HG      LYS  71   1.931 -13.563   1.718
  524    HG3  LYS  71           3HG      LYS  71   2.886 -12.163   2.157
  525    HD2  LYS  71           2HD      LYS  71   1.849 -10.772   0.535
  526    HD3  LYS  71           3HD      LYS  71   1.129 -12.119  -0.333
  527    HE2  LYS  71           2HE      LYS  71   0.372 -11.322   2.502
  528    HE3  LYS  71           3HE      LYS  71  -0.499 -10.831   1.038
  529    HZ1  LYS  71           3HZ      LYS  71  -0.908 -13.189   0.577
  530    HZ2  LYS  71           1HZ      LYS  71  -0.141 -13.643   1.915
  531    HZ3  LYS  71           2HZ      LYS  71  -1.509 -12.776   2.065
  532    H    ILE  72           H        ILE  72   3.834 -12.765  -2.827
  533    HA   ILE  72           HA       ILE  72   6.338 -14.248  -3.240
  534    HB   ILE  72           HB       ILE  72   4.255 -13.742  -5.425
  535   HG12  ILE  72          2HG1      ILE  72   5.172 -16.352  -4.193
  536   HG13  ILE  72          3HG1      ILE  72   3.569 -15.635  -4.002
  537   HG21  ILE  72          1HG2      ILE  72   6.973 -15.111  -5.503
  538   HG22  ILE  72          2HG2      ILE  72   5.874 -14.946  -6.891
  539   HG23  ILE  72          3HG2      ILE  72   6.597 -13.529  -6.201
  540   HD11  ILE  72          3HD1      ILE  72   3.126 -15.906  -6.392
  541   HD12  ILE  72          1HD1      ILE  72   4.695 -16.706  -6.608
  542   HD13  ILE  72          2HD1      ILE  72   3.480 -17.450  -5.597
  543    H    SER  73           H        SER  73   7.815 -12.576  -3.095
  544    HA   SER  73           HA       SER  73   7.078  -9.841  -3.893
  545    HB2  SER  73           2HB      SER  73   9.801 -10.989  -3.167
  546    HB3  SER  73           3HB      SER  73   9.337  -9.281  -3.237
  547    HG   SER  73           HG       SER  73   9.271 -10.096  -1.077
  548    H    LEU  74           H        LEU  74   7.865  -8.851  -5.814
  549    HA   LEU  74           HA       LEU  74   9.077 -10.680  -7.838
  550    HB2  LEU  74           2HB      LEU  74   6.804  -8.723  -8.193
  551    HB3  LEU  74           3HB      LEU  74   7.561  -9.624  -9.498
  552    HG   LEU  74           HG       LEU  74   5.987 -10.855  -7.194
  553   HD11  LEU  74          1HD1      LEU  74   5.160 -10.341 -10.074
  554   HD12  LEU  74          2HD1      LEU  74   4.212 -11.215  -8.872
  555   HD13  LEU  74          3HD1      LEU  74   4.545  -9.498  -8.646
  556   HD21  LEU  74          3HD2      LEU  74   7.015 -12.102  -9.788
  557   HD22  LEU  74          1HD2      LEU  74   7.642 -12.402  -8.150
  558   HD23  LEU  74          2HD2      LEU  74   6.009 -12.899  -8.559
  559    H    SER  75           H        SER  75  10.000  -9.482  -9.654
  560    HA   SER  75           HA       SER  75  10.777  -6.651  -9.106
  561    HB2  SER  75           2HB      SER  75  12.581  -8.887 -10.120
  562    HB3  SER  75           3HB      SER  75  13.008  -7.166 -10.041
  563    HG   SER  75           HG       SER  75  13.777  -8.292  -8.194
  564    H    ILE  76           H        ILE  76  11.016  -5.407 -10.938
  565    HA   ILE  76           HA       ILE  76  10.416  -6.609 -13.601
  566    HB   ILE  76           HB       ILE  76   9.437  -4.069 -12.309
  567   HG12  ILE  76          2HG1      ILE  76   8.083  -6.125 -12.011
  568   HG13  ILE  76          3HG1      ILE  76   7.255  -4.811 -12.816
  569   HG21  ILE  76          1HG2      ILE  76   9.326  -4.668 -15.280
  570   HG22  ILE  76          2HG2      ILE  76   8.458  -3.351 -14.450
  571   HG23  ILE  76          3HG2      ILE  76  10.201  -3.369 -14.485
  572   HD11  ILE  76          3HD1      ILE  76   7.538  -5.917 -15.014
  573   HD12  ILE  76          1HD1      ILE  76   8.408  -7.232 -14.180
  574   HD13  ILE  76          2HD1      ILE  76   6.692  -6.893 -13.873
  575    H    ARG  77           H        ARG  77  12.587  -4.569 -11.699
  576    HA   ARG  77           HA       ARG  77  14.145  -3.546 -13.822
  577    HB2  ARG  77           2HB      ARG  77  15.970  -3.458 -12.264
  578    HB3  ARG  77           3HB      ARG  77  14.485  -3.107 -11.368
  579    HG2  ARG  77           2HG      ARG  77  14.452  -5.449 -10.531
  580    HG3  ARG  77           3HG      ARG  77  15.964  -5.783 -11.380
  581    HD2  ARG  77           2HD      ARG  77  15.661  -3.638  -9.254
  582    HD3  ARG  77           3HD      ARG  77  16.177  -5.291  -8.925
  583    HE   ARG  77           HE       ARG  77  17.865  -4.340 -10.953
  584   HH11  ARG  77          1HH1      ARG  77  17.118  -3.619  -7.503
  585   HH12  ARG  77          2HH1      ARG  77  18.649  -2.960  -7.177
  586   HH21  ARG  77          1HH2      ARG  77  19.950  -3.433 -10.475
  587   HH22  ARG  77          2HH2      ARG  77  20.306  -2.860  -8.888
  588    H    ALA  78           H        ALA  78  13.759  -6.836 -12.792
  589    HA   ALA  78           HA       ALA  78  16.094  -7.910 -14.123
  590    HB1  ALA  78           1HB      ALA  78  13.537  -9.200 -13.065
  591    HB2  ALA  78           2HB      ALA  78  15.014 -10.059 -13.541
  592    HB3  ALA  78           3HB      ALA  78  15.042  -8.961 -12.141
  593    H    THR  79           H        THR  79  12.894  -6.954 -15.239
  594    HA   THR  79           HA       THR  79  13.175  -8.660 -17.655
  595    HB   THR  79           HB       THR  79  10.665  -8.702 -17.606
  596    HG1  THR  79           1HG      THR  79   9.700  -8.105 -15.666
  597   HG21  THR  79          1HG2      THR  79  12.009  -9.786 -15.074
  598   HG22  THR  79          2HG2      THR  79  10.474 -10.326 -15.750
  599   HG23  THR  79          3HG2      THR  79  11.958 -10.603 -16.653
  600    H    GLN  80           H        GLN  80  12.839  -5.354 -16.544
  601    HA   GLN  80           HA       GLN  80  13.106  -4.588 -19.375
  602    HB2  GLN  80           2HB      GLN  80  11.477  -2.912 -19.332
  603    HB3  GLN  80           3HB      GLN  80  10.682  -4.289 -18.577
  604    HG2  GLN  80           2HG      GLN  80  11.265  -3.275 -16.339
  605    HG3  GLN  80           3HG      GLN  80  11.874  -1.861 -17.163
  606   HE21  GLN  80          2HE2      GLN  80  10.239  -0.816 -15.688
  607   HE22  GLN  80          1HE2      GLN  80   8.591  -0.644 -16.314
  608    H    ALA  81           H        ALA  81  14.320  -2.664 -19.656
  609    HA   ALA  81           HA       ALA  81  15.922  -1.774 -17.318
  610    HB1  ALA  81           1HB      ALA  81  16.266  -1.277 -20.312
  611    HB2  ALA  81           2HB      ALA  81  17.386  -0.773 -19.029
  612    HB3  ALA  81           3HB      ALA  81  17.135  -2.498 -19.340
  613    H    ALA  82           H        ALA  82  13.198  -0.782 -19.193
  614    HA   ALA  82           HA       ALA  82  13.001   1.853 -18.041
  615    HB1  ALA  82           1HB      ALA  82  13.506   1.445 -21.029
  616    HB2  ALA  82           2HB      ALA  82  12.975   2.965 -20.313
  617    HB3  ALA  82           3HB      ALA  82  14.569   2.319 -19.896
  618    HA   PRO  83           HA       PRO  83   8.705   0.840 -19.107
  619    HB2  PRO  83           2HB      PRO  83   7.632   3.313 -19.793
  620    HB3  PRO  83           3HB      PRO  83   7.921   2.768 -18.120
  621    HG2  PRO  83           2HG      PRO  83   9.685   4.503 -19.855
  622    HG3  PRO  83           3HG      PRO  83   9.228   4.776 -18.148
  623    HD2  PRO  83           2HD      PRO  83  11.619   3.681 -18.818
  624    HD3  PRO  83           3HD      PRO  83  10.716   3.085 -17.398
  625    H    GLU  84           H        GLU  84   7.120   1.131 -20.997
  626    HA   GLU  84           HA       GLU  84   8.255   0.409 -23.419
  627    HB2  GLU  84           2HB      GLU  84   6.035   0.566 -24.344
  628    HB3  GLU  84           3HB      GLU  84   5.984  -0.166 -22.742
  629    HG2  GLU  84           2HG      GLU  84   5.223   2.014 -21.792
  630    HG3  GLU  84           3HG      GLU  84   5.271   2.726 -23.394
  631    H    LYS  85           H        LYS  85   8.220   1.395 -25.482
  632    HA   LYS  85           HA       LYS  85   9.355   4.023 -25.570
  633    HB2  LYS  85           2HB      LYS  85   8.241   2.231 -27.788
  634    HB3  LYS  85           3HB      LYS  85   9.156   3.719 -28.068
  635    HG2  LYS  85           2HG      LYS  85  11.111   2.751 -26.855
  636    HG3  LYS  85           3HG      LYS  85  10.213   1.232 -26.645
  637    HD2  LYS  85           2HD      LYS  85  10.008   1.037 -29.120
  638    HD3  LYS  85           3HD      LYS  85  10.972   2.503 -29.319
  639    HE2  LYS  85           2HE      LYS  85  11.914  -0.048 -27.914
  640    HE3  LYS  85           3HE      LYS  85  12.241   0.337 -29.610
  641    HZ1  LYS  85           3HZ      LYS  85  13.444   2.295 -28.877
  642    HZ2  LYS  85           1HZ      LYS  85  13.143   1.944 -27.304
  643    HZ3  LYS  85           2HZ      LYS  85  14.093   0.941 -28.203
  644    H    LYS  86           H        LYS  86   8.541   5.838 -26.828
  645    HA   LYS  86           HA       LYS  86   5.658   6.013 -27.299
  646    HB2  LYS  86           2HB      LYS  86   5.495   8.168 -26.135
  647    HB3  LYS  86           3HB      LYS  86   5.901   6.860 -25.026
  648    HG2  LYS  86           2HG      LYS  86   8.271   7.578 -25.004
  649    HG3  LYS  86           3HG      LYS  86   7.908   8.858 -26.174
  650    HD2  LYS  86           2HD      LYS  86   6.354   9.904 -24.549
  651    HD3  LYS  86           3HD      LYS  86   6.733   8.621 -23.369
  652    HE2  LYS  86           2HE      LYS  86   9.126   9.290 -23.426
  653    HE3  LYS  86           3HE      LYS  86   8.747  10.564 -24.599
  654    HZ1  LYS  86           3HZ      LYS  86   7.347  11.603 -22.915
  655    HZ2  LYS  86           1HZ      LYS  86   7.694  10.412 -21.835
  656    HZ3  LYS  86           2HZ      LYS  86   8.876  11.426 -22.355
  657    H    GLU  87           H        GLU  87   5.207   8.085 -28.568
  658    HA   GLU  87           HA       GLU  87   6.922   8.344 -30.803
  659    HB2  GLU  87           2HB      GLU  87   4.481   8.828 -30.744
  660    HB3  GLU  87           3HB      GLU  87   4.777  10.226 -29.720
  661    HG2  GLU  87           2HG      GLU  87   4.389  10.856 -32.068
  662    HG3  GLU  87           3HG      GLU  87   5.979  11.347 -31.525
  663    H    SER  88           H        SER  88   8.388   9.950 -31.426
  664    HA   SER  88           HA       SER  88  10.012  10.979 -29.264
  665    HB2  SER  88           2HB      SER  88  10.214  11.462 -32.261
  666    HB3  SER  88           3HB      SER  88  11.501  11.654 -31.055
  667    HG   SER  88           HG       SER  88  11.607   9.637 -32.190
  668    H    LYS  89           H        LYS  89   7.648  12.373 -31.489
  669    HA   LYS  89           HA       LYS  89   7.670  14.920 -30.018
  670    HB2  LYS  89           2HB      LYS  89   7.845  16.231 -32.140
  671    HB3  LYS  89           3HB      LYS  89   9.320  15.472 -31.565
  672    HG2  LYS  89           2HG      LYS  89   9.133  13.692 -33.262
  673    HG3  LYS  89           3HG      LYS  89   7.596  14.359 -33.823
  674    HD2  LYS  89           2HD      LYS  89   8.736  16.464 -34.462
  675    HD3  LYS  89           3HD      LYS  89  10.286  15.793 -33.897
  676    HE2  LYS  89           2HE      LYS  89  10.080  13.945 -35.547
  677    HE3  LYS  89           3HE      LYS  89   8.536  14.604 -36.102
  678    HZ1  LYS  89           3HZ      LYS  89   9.712  16.599 -36.816
  679    HZ2  LYS  89           1HZ      LYS  89  11.151  15.980 -36.298
  680    HZ3  LYS  89           2HZ      LYS  89  10.344  15.269 -37.539
  681    HA   PRO  90           HA       PRO  90   3.516  13.311 -31.401
  682    HB2  PRO  90           2HB      PRO  90   2.248  13.479 -28.940
  683    HB3  PRO  90           3HB      PRO  90   3.134  12.036 -29.512
  684    HG2  PRO  90           2HG      PRO  90   4.101  14.229 -27.678
  685    HG3  PRO  90           3HG      PRO  90   4.331  12.465 -27.490
  686    HD2  PRO  90           2HD      PRO  90   6.276  14.116 -28.510
  687    HD3  PRO  90           3HD      PRO  90   6.055  12.442 -29.100
  688    H    ARG  91           H        ARG  91   1.596  14.583 -31.590
  689    HA   ARG  91           HA       ARG  91   1.336  17.170 -30.278
  690    HB2  ARG  91           2HB      ARG  91   2.943  17.366 -32.398
  691    HB3  ARG  91           3HB      ARG  91   1.470  17.204 -33.325
  692    HG2  ARG  91           2HG      ARG  91   2.195  19.541 -32.998
  693    HG3  ARG  91           3HG      ARG  91   0.574  19.253 -32.393
  694    HD2  ARG  91           2HD      ARG  91   2.211  20.733 -31.009
  695    HD3  ARG  91           3HD      ARG  91   1.193  19.556 -30.168
  696    HE   ARG  91           HE       ARG  91   3.371  18.054 -30.576
  697   HH11  ARG  91          1HH1      ARG  91   3.301  21.396 -29.368
  698   HH12  ARG  91          2HH1      ARG  91   4.625  21.164 -28.293
  699   HH21  ARG  91          1HH2      ARG  91   4.974  17.716 -29.121
  700   HH22  ARG  91          2HH2      ARG  91   5.629  19.000 -28.145
  701    H    LYS  92           H        LYS  92   0.112  14.758 -32.554
  702    HA   LYS  92           HA       LYS  92  -2.639  15.420 -31.755
  703    HB2  LYS  92           2HB      LYS  92  -1.518  15.112 -34.575
  704    HB3  LYS  92           3HB      LYS  92  -3.195  14.692 -34.213
  705    HG2  LYS  92           2HG      LYS  92  -3.661  16.973 -33.424
  706    HG3  LYS  92           3HG      LYS  92  -1.975  17.430 -33.686
  707    HD2  LYS  92           2HD      LYS  92  -3.485  18.215 -35.497
  708    HD3  LYS  92           3HD      LYS  92  -2.162  17.208 -36.056
  709    HE2  LYS  92           2HE      LYS  92  -4.151  16.589 -37.268
  710    HE3  LYS  92           3HE      LYS  92  -3.679  15.253 -36.224
  711    HZ1  LYS  92           3HZ      LYS  92  -5.387  15.928 -34.681
  712    HZ2  LYS  92           1HZ      LYS  92  -5.847  17.188 -35.655
  713    HZ3  LYS  92           2HZ      LYS  92  -6.009  15.590 -36.111
  714    HA   PRO  93           HA       PRO  93  -2.886  10.923 -31.356
  715    HB2  PRO  93           2HB      PRO  93  -5.416  11.125 -32.989
  716    HB3  PRO  93           3HB      PRO  93  -5.139  10.251 -31.452
  717    HG2  PRO  93           2HG      PRO  93  -6.458  12.639 -31.494
  718    HG3  PRO  93           3HG      PRO  93  -5.264  12.293 -30.203
  719    HD2  PRO  93           2HD      PRO  93  -4.882  13.930 -32.719
  720    HD3  PRO  93           3HD      PRO  93  -4.334  14.280 -31.048
  721    H    LYS  94           H        LYS  94  -2.798   8.970 -32.703
  722    HA   LYS  94           HA       LYS  94  -2.060   9.515 -35.544
  723    HB2  LYS  94           2HB      LYS  94  -1.086   7.333 -33.656
  724    HB3  LYS  94           3HB      LYS  94  -0.606   7.532 -35.348
  725    HG2  LYS  94           2HG      LYS  94   0.311   9.807 -34.800
  726    HG3  LYS  94           3HG      LYS  94  -0.105   9.540 -33.107
  727    HD2  LYS  94           2HD      LYS  94   2.222   9.092 -33.330
  728    HD3  LYS  94           3HD      LYS  94   1.406   7.539 -33.072
  729    HE2  LYS  94           2HE      LYS  94   1.517   7.062 -35.495
  730    HE3  LYS  94           3HE      LYS  94   2.240   8.656 -35.791
  731    HZ1  LYS  94           3HZ      LYS  94   4.159   7.985 -34.474
  732    HZ2  LYS  94           1HZ      LYS  94   3.495   6.510 -34.193
  733    HZ3  LYS  94           2HZ      LYS  94   3.918   6.944 -35.716
  734    H    ALA  95           H        ALA  95  -4.707   8.501 -34.002
  735    HA   ALA  95           HA       ALA  95  -5.501   6.170 -35.439
  736    HB1  ALA  95           1HB      ALA  95  -7.144   8.504 -34.349
  737    HB2  ALA  95           2HB      ALA  95  -7.791   6.935 -34.852
  738    HB3  ALA  95           3HB      ALA  95  -6.707   7.025 -33.455
  739    H    ALA  96           H        ALA  96  -7.162   6.161 -37.185
  740    HA   ALA  96           HA       ALA  96  -6.426   7.563 -39.500
  741    HB1  ALA  96           1HB      ALA  96  -9.070   6.216 -38.833
  742    HB2  ALA  96           2HB      ALA  96  -8.521   6.680 -40.448
  743    HB3  ALA  96           3HB      ALA  96  -7.639   5.430 -39.553
  744    H    GLN  97           H        GLN  97  -6.780   9.523 -40.162
  745    HA   GLN  97           HA       GLN  97  -9.036  11.213 -39.246
  746    HB2  GLN  97           2HB      GLN  97  -6.046  11.798 -39.026
  747    HB3  GLN  97           3HB      GLN  97  -7.268  13.076 -38.987
  748    HG2  GLN  97           2HG      GLN  97  -8.186  12.369 -36.939
  749    HG3  GLN  97           3HG      GLN  97  -7.414  10.798 -37.008
  750   HE21  GLN  97          2HE2      GLN  97  -5.168  10.568 -36.574
  751   HE22  GLN  97          1HE2      GLN  97  -4.269  11.805 -35.721
  752    H    VAL  98           H        VAL  98  -7.145  13.305 -40.873
  753    HA   VAL  98           HA       VAL  98  -8.162  12.939 -43.474
  754    HB   VAL  98           HB       VAL  98  -6.342  14.489 -44.186
  755   HG11  VAL  98          1HG1      VAL  98  -7.753  15.274 -41.580
  756   HG12  VAL  98          2HG1      VAL  98  -7.043  16.387 -42.758
  757   HG13  VAL  98          3HG1      VAL  98  -8.417  15.386 -43.221
  758   HG21  VAL  98          3HG2      VAL  98  -5.354  14.288 -41.292
  759   HG22  VAL  98          1HG2      VAL  98  -4.495  13.729 -42.750
  760   HG23  VAL  98          2HG2      VAL  98  -4.810  15.443 -42.523
  761    H    SER  99           H        SER  99  -5.524  11.193 -41.954
  762    HA   SER  99           HA       SER  99  -4.255  10.042 -44.146
  763    HB2  SER  99           2HB      SER  99  -4.181   8.027 -42.451
  764    HB3  SER  99           3HB      SER  99  -3.334   9.542 -42.106
  765    HG   SER  99           HG       SER  99  -4.561   8.814 -40.325
  766    H    GLU 100           H        GLU 100  -7.589   9.418 -43.027
  767    HA   GLU 100           HA       GLU 100  -8.028   7.005 -44.459
  768    HB2  GLU 100           2HB      GLU 100  -9.380   8.046 -42.594
  769    HB3  GLU 100           3HB      GLU 100  -9.992   9.223 -43.768
  770    HG2  GLU 100           2HG      GLU 100 -11.055   7.444 -45.055
  771    HG3  GLU 100           3HG      GLU 100 -10.310   6.208 -44.052
  772    H    GLU 101           H        GLU 101  -7.603  10.257 -45.599
  773    HA   GLU 101           HA       GLU 101  -8.682   9.544 -48.286
  774    HB2  GLU 101           2HB      GLU 101  -8.340  12.250 -46.942
  775    HB3  GLU 101           3HB      GLU 101  -8.913  11.990 -48.595
  776    HG2  GLU 101           2HG      GLU 101 -10.835  10.660 -47.669
  777    HG3  GLU 101           3HG      GLU 101 -10.298  11.074 -46.046
  778    H    ALA 102           H        ALA 102  -5.820   9.568 -46.690
  779    HA   ALA 102           HA       ALA 102  -4.136  10.944 -48.601
  780    HB1  ALA 102           1HB      ALA 102  -3.440   8.860 -46.489
  781    HB2  ALA 102           2HB      ALA 102  -2.283   9.902 -47.333
  782    HB3  ALA 102           3HB      ALA 102  -3.478  10.625 -46.245
  783    H    SER 103           H        SER 103  -5.919   8.233 -49.076
  784    HA   SER 103           HA       SER 103  -4.167   6.325 -50.196
  785    HB2  SER 103           2HB      SER 103  -7.129   6.665 -50.714
  786    HB3  SER 103           3HB      SER 103  -6.187   5.162 -50.694
  787    HG   SER 103           HG       SER 103  -7.391   5.509 -48.742
  788    H    THR 104           H        THR 104  -4.117   9.175 -51.540
  789    HA   THR 104           HA       THR 104  -4.890   8.827 -54.233
  790    HB   THR 104           HB       THR 104  -3.082  10.644 -54.582
  791    HG1  THR 104           1HG      THR 104  -2.415  11.624 -52.692
  792   HG21  THR 104          1HG2      THR 104  -5.245  11.093 -52.470
  793   HG22  THR 104          2HG2      THR 104  -4.446  12.354 -53.432
  794   HG23  THR 104          3HG2      THR 104  -5.473  11.159 -54.222
  795    HA   PRO 105           HA       PRO 105  -2.221   6.017 -56.206
  796    HB2  PRO 105           2HB      PRO 105  -1.095   8.262 -57.886
  797    HB3  PRO 105           3HB      PRO 105  -1.615   6.621 -58.394
  798    HG2  PRO 105           2HG      PRO 105  -3.280   8.749 -58.738
  799    HG3  PRO 105           3HG      PRO 105  -3.921   7.196 -58.125
  800    HD2  PRO 105           2HD      PRO 105  -3.260   9.690 -56.571
  801    HD3  PRO 105           3HD      PRO 105  -4.635   8.559 -56.368
  802    H    GLN 106           H        GLN 106  -0.379   5.045 -55.526
  803    HA   GLN 106           HA       GLN 106   2.043   6.475 -54.798
  804    HB2  GLN 106           2HB      GLN 106   1.895   5.941 -52.423
  805    HB3  GLN 106           3HB      GLN 106   0.574   6.985 -52.911
  806    HG2  GLN 106           2HG      GLN 106  -0.898   4.876 -53.016
  807    HG3  GLN 106           3HG      GLN 106   0.440   4.018 -52.257
  808   HE21  GLN 106          2HE2      GLN 106  -1.836   6.748 -51.843
  809   HE22  GLN 106          1HE2      GLN 106  -1.811   6.721 -50.074
  810    H    GLY 107           H        GLY 107   3.623   4.905 -53.795
  811    HA2  GLY 107           2HA      GLY 107   3.053   2.099 -53.686
  812    HA3  GLY 107           3HA      GLY 107   4.088   2.517 -55.062
  813    H    PHE 108           H        PHE 108   5.010   0.932 -52.901
  814    HA   PHE 108           HA       PHE 108   7.187   2.545 -51.797
  815    HB2  PHE 108           2HB      PHE 108   5.153   1.016 -50.119
  816    HB3  PHE 108           3HB      PHE 108   6.740   1.449 -49.535
  817    HD1  PHE 108           HD1      PHE 108   3.411   2.786 -50.447
  818    HD2  PHE 108           HD2      PHE 108   7.324   3.724 -48.913
  819    HE1  PHE 108           HE1      PHE 108   2.585   4.975 -49.662
  820    HE2  PHE 108           HE2      PHE 108   6.491   5.888 -48.089
  821    HZ   PHE 108           HZ       PHE 108   4.116   6.540 -48.482
  822    H    ASN 109           H        ASN 109   8.856   1.048 -50.853
  823    HA   ASN 109           HA       ASN 109   8.618  -1.819 -51.423
  824    HB2  ASN 109           2HB      ASN 109   9.607  -1.015 -53.500
  825    HB3  ASN 109           3HB      ASN 109  10.757  -0.012 -52.607
  826   HD21  ASN 109          2HD2      ASN 109  12.590  -1.047 -53.543
  827   HD22  ASN 109          1HD2      ASN 109  13.013  -2.705 -53.086
  828    H    THR 110           H        THR 110   9.522  -2.883 -49.715
  829    HA   THR 110           HA       THR 110  11.642  -1.618 -48.102
  830    HB   THR 110           HB       THR 110  10.355  -2.552 -46.065
  831    HG1  THR 110           1HG      THR 110   8.106  -2.649 -46.388
  832   HG21  THR 110          1HG2      THR 110   9.123  -0.214 -47.572
  833   HG22  THR 110          2HG2      THR 110   8.936  -0.555 -45.846
  834   HG23  THR 110          3HG2      THR 110  10.528  -0.139 -46.504
  835    H    LEU 111           H        LEU 111  11.520  -3.794 -50.194
  836    HA   LEU 111           HA       LEU 111  11.517  -6.330 -48.912
  837    HB2  LEU 111           2HB      LEU 111  10.955  -5.913 -51.278
  838    HB3  LEU 111           3HB      LEU 111  12.623  -5.440 -51.601
  839    HG   LEU 111           HG       LEU 111  13.389  -7.749 -51.099
  840   HD11  LEU 111          1HD1      LEU 111  10.414  -8.405 -50.825
  841   HD12  LEU 111          2HD1      LEU 111  11.749  -9.579 -50.846
  842   HD13  LEU 111          3HD1      LEU 111  11.606  -8.455 -49.508
  843   HD21  LEU 111          3HD2      LEU 111  11.129  -7.593 -53.134
  844   HD22  LEU 111          1HD2      LEU 111  12.825  -7.135 -53.404
  845   HD23  LEU 111          2HD2      LEU 111  12.405  -8.822 -53.090
  846    H    LYS 112           H        LYS 112  14.224  -4.054 -49.523
  847    HA   LYS 112           HA       LYS 112  16.211  -6.199 -49.300
  848    HB2  LYS 112           2HB      LYS 112  16.418  -3.161 -49.366
  849    HB3  LYS 112           3HB      LYS 112  17.820  -4.208 -49.162
  850    HG2  LYS 112           2HG      LYS 112  17.302  -5.325 -51.324
  851    HG3  LYS 112           3HG      LYS 112  15.913  -4.237 -51.546
  852    HD2  LYS 112           2HD      LYS 112  17.384  -2.281 -51.592
  853    HD3  LYS 112           3HD      LYS 112  18.782  -3.280 -51.182
  854    HE2  LYS 112           2HE      LYS 112  18.932  -2.836 -53.512
  855    HE3  LYS 112           3HE      LYS 112  18.532  -4.541 -53.306
  856    HZ1  LYS 112           3HZ      LYS 112  16.234  -3.989 -53.805
  857    HZ2  LYS 112           1HZ      LYS 112  16.610  -2.401 -53.998
  858    HZ3  LYS 112           2HZ      LYS 112  17.211  -3.516 -55.050
  859    H    ASP 113           H        ASP 113  17.835  -6.352 -47.643
  860    HA   ASP 113           HA       ASP 113  16.908  -6.288 -44.971
  861    HB2  ASP 113           2HB      ASP 113  18.818  -7.661 -45.917
  862    HB3  ASP 113           3HB      ASP 113  19.804  -6.204 -45.874
  863    H    LYS 114           H        LYS 114  16.917  -4.663 -43.480
  864    HA   LYS 114           HA       LYS 114  17.120  -1.943 -44.296
  865    HB2  LYS 114           2HB      LYS 114  17.188  -3.066 -41.464
  866    HB3  LYS 114           3HB      LYS 114  16.750  -1.416 -41.919
  867    HG2  LYS 114           2HG      LYS 114  15.195  -3.911 -42.782
  868    HG3  LYS 114           3HG      LYS 114  14.806  -2.959 -41.371
  869    HD2  LYS 114           2HD      LYS 114  14.060  -1.130 -42.601
  870    HD3  LYS 114           3HD      LYS 114  14.968  -1.545 -44.053
  871    HE2  LYS 114           2HE      LYS 114  12.815  -3.437 -43.080
  872    HE3  LYS 114           3HE      LYS 114  12.355  -1.944 -43.934
  873    HZ1  LYS 114           3HZ      LYS 114  13.710  -2.631 -45.804
  874    HZ2  LYS 114           1HZ      LYS 114  14.191  -3.988 -45.085
  875    HZ3  LYS 114           2HZ      LYS 114  12.645  -3.761 -45.519
  876    H    LEU 115           H        LEU 115  19.586  -4.116 -43.001
  877    HA   LEU 115           HA       LEU 115  21.537  -2.191 -42.300
  878    HB2  LEU 115           2HB      LEU 115  21.450  -4.659 -41.794
  879    HB3  LEU 115           3HB      LEU 115  21.855  -4.980 -43.479
  880    HG   LEU 115           HG       LEU 115  24.077  -3.923 -43.164
  881   HD11  LEU 115          1HD1      LEU 115  23.245  -3.604 -40.241
  882   HD12  LEU 115          2HD1      LEU 115  24.859  -3.290 -40.916
  883   HD13  LEU 115          3HD1      LEU 115  23.508  -2.272 -41.387
  884   HD21  LEU 115          3HD2      LEU 115  23.396  -6.004 -41.057
  885   HD22  LEU 115          1HD2      LEU 115  23.816  -6.322 -42.744
  886   HD23  LEU 115          2HD2      LEU 115  25.024  -5.622 -41.659
  887    H    GLU 116           H        GLU 116  20.250  -2.804 -45.425
  888    HA   GLU 116           HA       GLU 116  22.479  -1.218 -46.622
  889    HB2  GLU 116           2HB      GLU 116  22.552  -3.630 -47.251
  890    HB3  GLU 116           3HB      GLU 116  20.915  -3.497 -47.910
  891    HG2  GLU 116           2HG      GLU 116  21.700  -1.886 -49.587
  892    HG3  GLU 116           3HG      GLU 116  23.300  -1.846 -48.858
  893    H    GLU 117           H        GLU 117  18.987  -1.960 -46.539
  894    HA   GLU 117           HA       GLU 117  18.246  -0.056 -48.538
  895    HB2  GLU 117           2HB      GLU 117  16.963  -2.090 -47.434
  896    HB3  GLU 117           3HB      GLU 117  16.423  -0.888 -46.264
  897    HG2  GLU 117           2HG      GLU 117  15.461   0.464 -48.103
  898    HG3  GLU 117           3HG      GLU 117  16.087  -0.668 -49.292
  899    H    TRP 118           H        TRP 118  18.833   0.249 -45.066
  900    HA   TRP 118           HA       TRP 118  18.619   1.959 -43.592
  901    HB2  TRP 118           2HB      TRP 118  20.139   3.276 -45.846
  902    HB3  TRP 118           3HB      TRP 118  20.059   3.878 -44.202
  903    HD1  TRP 118           HD1      TRP 118  22.154   1.879 -46.349
  904    HE1  TRP 118           HE1      TRP 118  23.933   0.628 -45.033
  905    HE3  TRP 118           HE3      TRP 118  20.175   2.369 -41.653
  906    HZ2  TRP 118           HZ2      TRP 118  24.474  -0.051 -42.264
  907    HZ3  TRP 118           HZ3      TRP 118  21.326   1.398 -39.697
  908    HH2  TRP 118           HH2      TRP 118  23.480   0.193 -39.982
  909    H    ILE 119           H        ILE 119  16.130   1.902 -44.335
  910    HA   ILE 119           HA       ILE 119  15.169   4.426 -45.329
  911    HB   ILE 119           HB       ILE 119  12.937   3.553 -44.807
  912   HG12  ILE 119          2HG1      ILE 119  14.363   1.085 -43.703
  913   HG13  ILE 119          3HG1      ILE 119  13.536   2.304 -42.723
  914   HG21  ILE 119          1HG2      ILE 119  14.784   1.565 -46.225
  915   HG22  ILE 119          2HG2      ILE 119  13.044   1.654 -46.428
  916   HG23  ILE 119          3HG2      ILE 119  14.020   2.999 -46.940
  917   HD11  ILE 119          3HD1      ILE 119  11.390   1.795 -43.851
  918   HD12  ILE 119          1HD1      ILE 119  12.189   0.531 -44.807
  919   HD13  ILE 119          2HD1      ILE 119  12.083   0.363 -43.070
  920    H    GLU 120           H        GLU 120  16.996   4.645 -43.052
  921    HA   GLU 120           HA       GLU 120  15.582   5.347 -40.682
  922    HB2  GLU 120           2HB      GLU 120  18.288   6.245 -41.751
  923    HB3  GLU 120           3HB      GLU 120  17.710   6.538 -40.115
  924    HG2  GLU 120           2HG      GLU 120  18.176   3.797 -41.369
  925    HG3  GLU 120           3HG      GLU 120  19.263   4.612 -40.273
  926    H    MET 121           H        MET 121  14.810   7.323 -39.978
  927    HA   MET 121           HA       MET 121  13.351   8.815 -41.731
  928    HB2  MET 121           2HB      MET 121  14.374   9.633 -38.990
  929    HB3  MET 121           3HB      MET 121  13.106  10.486 -39.885
  930    HG2  MET 121           2HG      MET 121  11.739   8.418 -39.920
  931    HG3  MET 121           3HG      MET 121  12.988   7.582 -38.995
  932    HE1  MET 121           3HE      MET 121   9.921   7.632 -38.159
  933    HE2  MET 121           1HE      MET 121  11.189   6.795 -37.232
  934    HE3  MET 121           2HE      MET 121  10.060   7.893 -36.407
  935    H    SER 122           H        SER 122  14.001   9.917 -43.408
  936    HA   SER 122           HA       SER 122  14.904  11.465 -44.745
  937    HB2  SER 122           2HB      SER 122  15.243  13.107 -42.221
  938    HB3  SER 122           3HB      SER 122  15.065  13.706 -43.873
  939    HG   SER 122           HG       SER 122  13.092  13.786 -42.686
  940    H    ASN 123           H        ASN 123  16.891   9.523 -43.364
  941    HA   ASN 123           HA       ASN 123  19.335  10.965 -43.194
  942    HB2  ASN 123           2HB      ASN 123  20.401   8.950 -42.896
  943    HB3  ASN 123           3HB      ASN 123  18.771   8.557 -42.373
  944   HD21  ASN 123          2HD2      ASN 123  17.378   7.376 -43.963
  945   HD22  ASN 123          1HD2      ASN 123  18.160   6.297 -45.092
  946    H    ARG 124           H        ARG 124  17.577  10.092 -46.017
  947    HA   ARG 124           HA       ARG 124  19.604  11.470 -47.604
  948    HB2  ARG 124           2HB      ARG 124  19.507   9.808 -49.432
  949    HB3  ARG 124           3HB      ARG 124  20.225   9.138 -47.966
  950    HG2  ARG 124           2HG      ARG 124  18.179   7.918 -47.437
  951    HG3  ARG 124           3HG      ARG 124  17.314   8.702 -48.765
  952    HD2  ARG 124           2HD      ARG 124  18.907   7.641 -50.382
  953    HD3  ARG 124           3HD      ARG 124  19.665   6.794 -49.042
  954    HE   ARG 124           HE       ARG 124  16.961   6.364 -50.218
  955   HH11  ARG 124          1HH1      ARG 124  19.375   5.332 -47.741
  956   HH12  ARG 124          2HH1      ARG 124  18.523   3.856 -47.427
  957   HH21  ARG 124          1HH2      ARG 124  15.941   4.379 -49.699
  958   HH22  ARG 124          2HH2      ARG 124  16.657   3.318 -48.495
  959    H    LYS 125           H        LYS 125  18.608  12.381 -49.597
  960    HA   LYS 125           HA       LYS 125  15.844  13.051 -49.327
  961    HB2  LYS 125           2HB      LYS 125  16.031  14.115 -51.486
  962    HB3  LYS 125           3HB      LYS 125  17.432  14.494 -50.488
  963    HG2  LYS 125           2HG      LYS 125  18.773  12.794 -51.753
  964    HG3  LYS 125           3HG      LYS 125  17.361  12.469 -52.776
  965    HD2  LYS 125           2HD      LYS 125  17.356  14.834 -53.527
  966    HD3  LYS 125           3HD      LYS 125  18.781  15.156 -52.509
  967    HE2  LYS 125           2HE      LYS 125  20.069  13.449 -53.782
  968    HE3  LYS 125           3HE      LYS 125  18.649  13.123 -54.791
  969    HZ1  LYS 125           3HZ      LYS 125  18.765  15.406 -55.572
  970    HZ2  LYS 125           1HZ      LYS 125  20.082  15.708 -54.633
  971    HZ3  LYS 125           2HZ      LYS 125  20.182  14.633 -55.867
  972    H    ASP 126           H        ASP 126  17.424  10.389 -51.045
  973    HA   ASP 126           HA       ASP 126  14.998   9.602 -52.435
  974    HB2  ASP 126           2HB      ASP 126  17.232   9.429 -53.432
  975    HB3  ASP 126           3HB      ASP 126  17.684   8.230 -52.234
  976    H    LEU 127           H        LEU 127  14.750   9.709 -49.539
  977    HA   LEU 127           HA       LEU 127  14.398   6.969 -48.655
  978    HB2  LEU 127           2HB      LEU 127  14.434   9.470 -47.416
  979    HB3  LEU 127           3HB      LEU 127  12.722   9.125 -47.445
  980    HG   LEU 127           HG       LEU 127  13.686   8.437 -45.335
  981   HD11  LEU 127          1HD1      LEU 127  13.134   5.916 -46.975
  982   HD12  LEU 127          2HD1      LEU 127  13.129   6.036 -45.228
  983   HD13  LEU 127          3HD1      LEU 127  11.919   6.919 -46.148
  984   HD21  LEU 127          3HD2      LEU 127  15.637   6.712 -46.942
  985   HD22  LEU 127          1HD2      LEU 127  16.003   8.183 -46.008
  986   HD23  LEU 127          2HD2      LEU 127  15.453   6.729 -45.185
  987    H    ILE 128           H        ILE 128  12.468   5.770 -48.743
  988    HA   ILE 128           HA       ILE 128  10.722   6.147 -50.891
  989    HB   ILE 128           HB       ILE 128   9.450   4.265 -49.964
  990   HG12  ILE 128          2HG1      ILE 128  11.209   4.556 -47.484
  991   HG13  ILE 128          3HG1      ILE 128   9.464   4.829 -47.586
  992   HG21  ILE 128          1HG2      ILE 128  12.491   3.933 -49.772
  993   HG22  ILE 128          2HG2      ILE 128  11.340   2.625 -50.011
  994   HG23  ILE 128          3HG2      ILE 128  11.507   3.843 -51.240
  995   HD11  ILE 128          3HD1      ILE 128   9.106   2.435 -48.126
  996   HD12  ILE 128          1HD1      ILE 128  10.848   2.145 -47.973
  997   HD13  ILE 128          2HD1      ILE 128   9.942   2.656 -46.576
  998    H    LYS 129           H        LYS 129   8.671   6.848 -51.153
  999    HA   LYS 129           HA       LYS 129   6.965   7.872 -49.113
 1000    HB2  LYS 129           2HB      LYS 129   6.999  10.232 -50.015
 1001    HB3  LYS 129           3HB      LYS 129   8.375   9.771 -49.026
 1002    HG2  LYS 129           2HG      LYS 129   9.741   9.433 -51.076
 1003    HG3  LYS 129           3HG      LYS 129   8.369   9.911 -52.077
 1004    HD2  LYS 129           2HD      LYS 129   8.492  12.141 -51.432
 1005    HD3  LYS 129           3HD      LYS 129   9.273  11.795 -49.886
 1006    HE2  LYS 129           2HE      LYS 129  10.657  11.398 -52.574
 1007    HE3  LYS 129           3HE      LYS 129  10.744  12.906 -51.644
 1008    HZ1  LYS 129           3HZ      LYS 129  11.712  11.658 -49.828
 1009    HZ2  LYS 129           1HZ      LYS 129  11.650  10.253 -50.678
 1010    HZ3  LYS 129           2HZ      LYS 129  12.630  11.454 -51.159
 1011    H    LYS 130           H        LYS 130   5.007   8.878 -50.247
 1012    HA   LYS 130           HA       LYS 130   4.038   7.227 -52.309
 1013    HB2  LYS 130           2HB      LYS 130   3.161  10.067 -51.605
 1014    HB3  LYS 130           3HB      LYS 130   2.266   8.913 -52.606
 1015    HG2  LYS 130           2HG      LYS 130   2.330   7.346 -50.526
 1016    HG3  LYS 130           3HG      LYS 130   2.805   8.780 -49.611
 1017    HD2  LYS 130           2HD      LYS 130   0.276   8.498 -51.290
 1018    HD3  LYS 130           3HD      LYS 130   0.355   8.289 -49.539
 1019    HE2  LYS 130           2HE      LYS 130   0.974  10.628 -49.235
 1020    HE3  LYS 130           3HE      LYS 130   1.112  10.862 -50.991
 1021    HZ1  LYS 130           3HZ      LYS 130  -1.262  10.388 -51.166
 1022    HZ2  LYS 130           1HZ      LYS 130  -1.398  10.159 -49.594
 1023    HZ3  LYS 130           2HZ      LYS 130  -1.000  11.664 -50.158
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1   4.774 -26.457   2.095
    2    H2   MET   1           H2       MET   1   4.168 -27.917   1.594
    3    H3   MET   1           H3       MET   1   3.346 -27.011   2.701
    4    HA   MET   1           HA       MET   1   3.119 -26.975  -0.056
    5    HB2  MET   1           2HB      MET   1   1.898 -25.269   2.156
    6    HB3  MET   1           3HB      MET   1   1.429 -25.152   0.454
    7    HG2  MET   1           2HG      MET   1   1.170 -27.600   2.238
    8    HG3  MET   1           3HG      MET   1  -0.134 -26.558   1.687
    9    HE1  MET   1           3HE      MET   1  -1.253 -26.630  -0.679
   10    HE2  MET   1           1HE      MET   1   0.283 -26.067  -1.374
   11    HE3  MET   1           2HE      MET   1  -0.551 -27.464  -2.076
   12    H    ALA   2           H        ALA   2   3.663 -25.491  -1.640
   13    HA   ALA   2           HA       ALA   2   4.643 -22.849  -0.963
   14    HB1  ALA   2           1HB      ALA   2   6.376 -24.902  -2.433
   15    HB2  ALA   2           2HB      ALA   2   6.727 -23.173  -2.315
   16    HB3  ALA   2           3HB      ALA   2   6.743 -24.168  -0.850
   17    H    ALA   3           H        ALA   3   4.885 -21.618  -3.044
   18    HA   ALA   3           HA       ALA   3   2.788 -22.059  -4.885
   19    HB1  ALA   3           1HB      ALA   3   5.317 -20.358  -5.147
   20    HB2  ALA   3           2HB      ALA   3   3.875 -20.224  -6.173
   21    HB3  ALA   3           3HB      ALA   3   3.767 -19.844  -4.443
   22    H    LYS   4           H        LYS   4   2.940 -22.566  -7.145
   23    HA   LYS   4           HA       LYS   4   4.842 -24.652  -7.818
   24    HB2  LYS   4           2HB      LYS   4   3.580 -24.868  -9.899
   25    HB3  LYS   4           3HB      LYS   4   2.561 -24.909  -8.469
   26    HG2  LYS   4           2HG      LYS   4   1.818 -22.574  -8.897
   27    HG3  LYS   4           3HG      LYS   4   2.855 -22.514 -10.339
   28    HD2  LYS   4           2HD      LYS   4   1.623 -24.401 -11.331
   29    HD3  LYS   4           3HD      LYS   4   0.597 -24.526  -9.899
   30    HE2  LYS   4           2HE      LYS   4   0.723 -22.096 -11.747
   31    HE3  LYS   4           3HE      LYS   4  -0.477 -23.377 -11.861
   32    HZ1  LYS   4           3HZ      LYS   4  -1.298 -22.811  -9.665
   33    HZ2  LYS   4           1HZ      LYS   4  -0.206 -21.595  -9.495
   34    HZ3  LYS   4           2HZ      LYS   4  -1.380 -21.542 -10.628
   35    H    PHE   5           H        PHE   5   5.568 -21.568  -7.647
   36    HA   PHE   5           HA       PHE   5   7.656 -21.829  -9.708
   37    HB2  PHE   5           2HB      PHE   5   5.746 -19.513  -9.329
   38    HB3  PHE   5           3HB      PHE   5   7.423 -19.161  -9.687
   39    HD1  PHE   5           HD2      PHE   5   4.477 -21.081 -10.979
   40    HD2  PHE   5           HD1      PHE   5   8.249 -19.231 -11.894
   41    HE1  PHE   5           HE2      PHE   5   4.123 -21.552 -13.396
   42    HE2  PHE   5           HE1      PHE   5   7.886 -19.674 -14.304
   43    HZ   PHE   5           HZ       PHE   5   5.832 -20.860 -15.054
   44    H    GLU   6           H        GLU   6   9.585 -20.444  -9.018
   45    HA   GLU   6           HA       GLU   6   9.797 -20.051  -6.116
   46    HB2  GLU   6           2HB      GLU   6  10.931 -22.308  -7.686
   47    HB3  GLU   6           3HB      GLU   6  12.132 -21.441  -6.746
   48    HG2  GLU   6           2HG      GLU   6   9.534 -22.506  -5.575
   49    HG3  GLU   6           3HG      GLU   6  11.059 -23.383  -5.571
   50    H    VAL   7           H        VAL   7  11.843 -19.108  -5.529
   51    HA   VAL   7           HA       VAL   7  12.274 -16.680  -6.862
   52    HB   VAL   7           HB       VAL   7  14.142 -18.150  -4.949
   53   HG11  VAL   7          1HG1      VAL   7  13.865 -15.171  -5.591
   54   HG12  VAL   7          2HG1      VAL   7  14.909 -15.873  -4.336
   55   HG13  VAL   7          3HG1      VAL   7  15.242 -16.205  -6.038
   56   HG21  VAL   7          3HG2      VAL   7  11.859 -16.196  -4.440
   57   HG22  VAL   7          1HG2      VAL   7  11.852 -17.915  -4.012
   58   HG23  VAL   7          2HG2      VAL   7  12.972 -16.845  -3.195
   59    H    GLY   8           H        GLY   8  13.472 -15.979  -8.457
   60    HA2  GLY   8           2HA      GLY   8  15.354 -15.856  -9.861
   61    HA3  GLY   8           3HA      GLY   8  15.777 -17.534  -9.480
   62    H    SER   9           H        SER   9  12.720 -18.240 -10.037
   63    HA   SER   9           HA       SER   9  12.917 -18.774 -12.835
   64    HB2  SER   9           2HB      SER   9  10.376 -18.496 -11.183
   65    HB3  SER   9           3HB      SER   9  10.618 -19.456 -12.656
   66    HG   SER   9           HG       SER   9  10.698 -20.706 -10.686
   67    H    VAL  10           H        VAL  10  11.602 -17.810 -14.556
   68    HA   VAL  10           HA       VAL  10  10.625 -15.051 -14.032
   69    HB   VAL  10           HB       VAL  10  11.836 -16.246 -16.549
   70   HG11  VAL  10          1HG1      VAL  10  10.716 -13.438 -16.126
   71   HG12  VAL  10          2HG1      VAL  10  11.580 -14.009 -17.563
   72   HG13  VAL  10          3HG1      VAL  10  10.000 -14.690 -17.161
   73   HG21  VAL  10          3HG2      VAL  10  12.757 -13.969 -14.742
   74   HG22  VAL  10          1HG2      VAL  10  13.525 -15.570 -14.860
   75   HG23  VAL  10          2HG2      VAL  10  13.549 -14.475 -16.246
   76    H    TYR  11           H        TYR  11   8.580 -14.595 -14.679
   77    HA   TYR  11           HA       TYR  11   6.909 -16.674 -15.936
   78    HB2  TYR  11           2HB      TYR  11   7.013 -16.736 -13.287
   79    HB3  TYR  11           3HB      TYR  11   6.041 -15.279 -13.392
   80    HD1  TYR  11           HD2      TYR  11   4.939 -17.474 -16.076
   81    HD2  TYR  11           HD1      TYR  11   4.816 -16.943 -11.788
   82    HE1  TYR  11           HE2      TYR  11   2.943 -18.888 -15.956
   83    HE2  TYR  11           HE1      TYR  11   2.798 -18.363 -11.682
   84    HH   TYR  11           HH       TYR  11   1.302 -19.679 -12.903
   85    H    THR  12           H        THR  12   4.513 -15.484 -16.021
   86    HA   THR  12           HA       THR  12   4.899 -12.645 -16.751
   87    HB   THR  12           HB       THR  12   3.661 -14.743 -18.574
   88    HG1  THR  12           1HG      THR  12   5.479 -14.492 -19.827
   89   HG21  THR  12          1HG2      THR  12   4.523 -11.862 -19.109
   90   HG22  THR  12          2HG2      THR  12   3.831 -12.981 -20.306
   91   HG23  THR  12          3HG2      THR  12   2.849 -12.423 -18.952
   92    H    GLY  13           H        GLY  13   2.953 -11.431 -16.596
   93    HA2  GLY  13           2HA      GLY  13   0.494 -12.745 -15.730
   94    HA3  GLY  13           3HA      GLY  13   1.386 -11.905 -14.455
   95    H    LYS  14           H        LYS  14  -0.771 -10.785 -14.507
   96    HA   LYS  14           HA       LYS  14  -0.723  -8.467 -16.387
   97    HB2  LYS  14           2HB      LYS  14  -2.397 -10.377 -16.833
   98    HB3  LYS  14           3HB      LYS  14  -3.234  -9.867 -15.381
   99    HG2  LYS  14           2HG      LYS  14  -2.650  -8.103 -17.817
  100    HG3  LYS  14           3HG      LYS  14  -4.128  -9.025 -17.601
  101    HD2  LYS  14           2HD      LYS  14  -3.198  -6.693 -15.894
  102    HD3  LYS  14           3HD      LYS  14  -4.513  -6.705 -17.061
  103    HE2  LYS  14           2HE      LYS  14  -5.714  -8.426 -15.690
  104    HE3  LYS  14           3HE      LYS  14  -4.410  -8.343 -14.487
  105    HZ1  LYS  14           3HZ      LYS  14  -4.929  -6.037 -14.138
  106    HZ2  LYS  14           1HZ      LYS  14  -6.153  -6.084 -15.237
  107    HZ3  LYS  14           2HZ      LYS  14  -6.266  -6.964 -13.851
  108    H    VAL  15           H        VAL  15  -0.698  -6.558 -15.316
  109    HA   VAL  15           HA       VAL  15  -0.373  -6.531 -12.499
  110    HB   VAL  15           HB       VAL  15  -0.897  -4.153 -14.305
  111   HG11  VAL  15          1HG1      VAL  15   0.763  -4.473 -11.752
  112   HG12  VAL  15          2HG1      VAL  15   0.595  -2.980 -12.690
  113   HG13  VAL  15          3HG1      VAL  15  -0.810  -3.657 -11.856
  114   HG21  VAL  15          3HG2      VAL  15   1.765  -5.570 -13.818
  115   HG22  VAL  15          1HG2      VAL  15   0.897  -5.488 -15.361
  116   HG23  VAL  15          2HG2      VAL  15   1.545  -4.027 -14.671
  117    H    THR  16           H        THR  16  -1.810  -6.349 -10.909
  118    HA   THR  16           HA       THR  16  -4.664  -5.883 -11.542
  119    HB   THR  16           HB       THR  16  -4.796  -7.190  -9.247
  120    HG1  THR  16           1HG      THR  16  -3.067  -8.667  -9.088
  121   HG21  THR  16          1HG2      THR  16  -3.991  -8.558 -11.854
  122   HG22  THR  16          2HG2      THR  16  -4.856  -9.300 -10.484
  123   HG23  THR  16          3HG2      THR  16  -5.636  -8.032 -11.414
  124    H    GLY  17           H        GLY  17  -2.013  -4.368  -9.845
  125    HA2  GLY  17           2HA      GLY  17  -3.714  -2.143  -9.352
  126    HA3  GLY  17           3HA      GLY  17  -3.437  -3.005  -7.831
  127    H    LEU  18           H        LEU  18  -2.537  -0.456  -7.997
  128    HA   LEU  18           HA       LEU  18   0.408  -0.777  -7.917
  129    HB2  LEU  18           2HB      LEU  18  -1.140   1.606  -9.025
  130    HB3  LEU  18           3HB      LEU  18   0.583   1.606  -8.676
  131    HG   LEU  18           HG       LEU  18  -0.791  -0.084 -10.793
  132   HD11  LEU  18          1HD1      LEU  18   1.042   2.344 -11.038
  133   HD12  LEU  18          2HD1      LEU  18   0.412   1.388 -12.386
  134   HD13  LEU  18          3HD1      LEU  18  -0.701   2.317 -11.367
  135   HD21  LEU  18          3HD2      LEU  18   2.177   0.206 -10.209
  136   HD22  LEU  18          1HD2      LEU  18   1.171  -1.243  -9.951
  137   HD23  LEU  18          2HD2      LEU  18   1.453  -0.665 -11.586
  138    H    GLN  19           H        GLN  19   1.333   0.381  -6.238
  139    HA   GLN  19           HA       GLN  19  -0.293   2.082  -4.465
  140    HB2  GLN  19           2HB      GLN  19   1.349  -0.308  -3.487
  141    HB3  GLN  19           3HB      GLN  19   0.507   0.875  -2.486
  142    HG2  GLN  19           2HG      GLN  19  -1.678   0.087  -3.487
  143    HG3  GLN  19           3HG      GLN  19  -0.776  -1.217  -4.280
  144   HE21  GLN  19          2HE2      GLN  19   0.406  -2.776  -2.866
  145   HE22  GLN  19          1HE2      GLN  19  -0.149  -3.016  -1.227
  146    H    ALA  20           H        ALA  20   1.218   3.245  -2.966
  147    HA   ALA  20           HA       ALA  20   3.469   4.302  -4.280
  148    HB1  ALA  20           1HB      ALA  20   2.774   4.390  -1.312
  149    HB2  ALA  20           2HB      ALA  20   3.863   5.495  -2.174
  150    HB3  ALA  20           3HB      ALA  20   2.136   5.491  -2.568
  151    H    TYR  21           H        TYR  21   3.374   1.252  -2.797
  152    HA   TYR  21           HA       TYR  21   6.343   1.234  -2.622
  153    HB2  TYR  21           2HB      TYR  21   6.284  -0.179  -0.731
  154    HB3  TYR  21           3HB      TYR  21   5.300   1.225  -0.382
  155    HD1  TYR  21           HD1      TYR  21   2.776   1.006  -0.279
  156    HD2  TYR  21           HD2      TYR  21   5.354  -2.411  -0.789
  157    HE1  TYR  21           HE1      TYR  21   0.924  -0.483   0.408
  158    HE2  TYR  21           HE2      TYR  21   3.511  -3.908  -0.061
  159    HH   TYR  21           HH       TYR  21   0.282  -2.642   0.843
  160    H    GLY  22           H        GLY  22   3.826   0.010  -4.522
  161    HA2  GLY  22           2HA      GLY  22   5.532  -1.621  -5.936
  162    HA3  GLY  22           3HA      GLY  22   4.820  -2.699  -4.744
  163    H    ALA  23           H        ALA  23   4.312  -3.552  -7.054
  164    HA   ALA  23           HA       ALA  23   1.624  -2.630  -7.967
  165    HB1  ALA  23           1HB      ALA  23   3.993  -3.651  -9.611
  166    HB2  ALA  23           2HB      ALA  23   2.368  -3.340 -10.234
  167    HB3  ALA  23           3HB      ALA  23   3.355  -1.998  -9.621
  168    H    PHE  24           H        PHE  24   0.139  -4.244  -7.755
  169    HA   PHE  24           HA       PHE  24   1.023  -6.987  -7.141
  170    HB2  PHE  24           2HB      PHE  24  -1.708  -5.685  -7.495
  171    HB3  PHE  24           3HB      PHE  24  -1.492  -7.403  -7.198
  172    HD1  PHE  24           HD1      PHE  24   0.271  -7.882  -5.130
  173    HD2  PHE  24           HD2      PHE  24  -2.311  -4.456  -5.594
  174    HE1  PHE  24           HE1      PHE  24   0.300  -7.521  -2.680
  175    HE2  PHE  24           HE2      PHE  24  -2.292  -4.109  -3.147
  176    HZ   PHE  24           HZ       PHE  24  -0.991  -5.629  -1.676
  177    H    VAL  25           H        VAL  25   0.880  -8.725  -8.524
  178    HA   VAL  25           HA       VAL  25  -0.128  -8.308 -11.281
  179    HB   VAL  25           HB       VAL  25   2.551  -9.598 -10.588
  180   HG11  VAL  25          1HG1      VAL  25   1.252  -8.879 -13.256
  181   HG12  VAL  25          2HG1      VAL  25   2.865  -9.583 -13.048
  182   HG13  VAL  25          3HG1      VAL  25   1.442 -10.520 -12.592
  183   HG21  VAL  25          3HG2      VAL  25   2.042  -6.884 -11.889
  184   HG22  VAL  25          1HG2      VAL  25   2.759  -7.153 -10.287
  185   HG23  VAL  25          2HG2      VAL  25   3.619  -7.687 -11.723
  186    H    ALA  26           H        ALA  26  -1.666  -9.780 -11.521
  187    HA   ALA  26           HA       ALA  26  -1.735 -12.345 -10.085
  188    HB1  ALA  26           1HB      ALA  26  -3.390 -11.197 -12.386
  189    HB2  ALA  26           2HB      ALA  26  -3.711 -12.731 -11.543
  190    HB3  ALA  26           3HB      ALA  26  -3.829 -11.211 -10.652
  191    H    LEU  27           H        LEU  27  -1.161 -14.319 -10.996
  192    HA   LEU  27           HA       LEU  27   0.473 -14.189 -13.512
  193    HB2  LEU  27           2HB      LEU  27   0.936 -15.732 -10.932
  194    HB3  LEU  27           3HB      LEU  27   1.913 -15.862 -12.382
  195    HG   LEU  27           HG       LEU  27   1.593 -13.212 -10.921
  196   HD11  LEU  27          1HD1      LEU  27   3.721 -15.324 -10.425
  197   HD12  LEU  27          2HD1      LEU  27   3.701 -13.682  -9.766
  198   HD13  LEU  27          3HD1      LEU  27   2.446 -14.814  -9.289
  199   HD21  LEU  27          3HD2      LEU  27   3.771 -14.272 -12.771
  200   HD22  LEU  27          1HD2      LEU  27   2.517 -13.116 -13.206
  201   HD23  LEU  27          2HD2      LEU  27   3.705 -12.661 -11.991
  202    H    ASP  28           H        ASP  28  -1.798 -16.013 -11.466
  203    HA   ASP  28           HA       ASP  28  -2.798 -17.572 -13.697
  204    HB2  ASP  28           2HB      ASP  28  -0.925 -19.001 -13.096
  205    HB3  ASP  28           3HB      ASP  28  -1.267 -18.813 -11.378
  206    H    GLU  29           H        GLU  29  -4.784 -18.799 -12.800
  207    HA   GLU  29           HA       GLU  29  -6.340 -17.210 -11.065
  208    HB2  GLU  29           2HB      GLU  29  -7.978 -18.969 -11.177
  209    HB3  GLU  29           3HB      GLU  29  -7.275 -18.667 -12.766
  210    HG2  GLU  29           2HG      GLU  29  -5.840 -20.684 -12.524
  211    HG3  GLU  29           3HG      GLU  29  -6.527 -20.982 -10.926
  212    H    GLU  30           H        GLU  30  -3.956 -19.587 -10.172
  213    HA   GLU  30           HA       GLU  30  -4.660 -19.055  -7.322
  214    HB2  GLU  30           2HB      GLU  30  -3.746 -21.663  -8.598
  215    HB3  GLU  30           3HB      GLU  30  -3.793 -21.372  -6.854
  216    HG2  GLU  30           2HG      GLU  30  -6.234 -20.915  -6.990
  217    HG3  GLU  30           3HG      GLU  30  -6.203 -21.359  -8.697
  218    H    THR  31           H        THR  31  -2.668 -17.696  -9.257
  219    HA   THR  31           HA       THR  31  -0.576 -17.682  -7.177
  220    HB   THR  31           HB       THR  31   0.247 -17.972 -10.090
  221    HG1  THR  31           1HG      THR  31   0.905 -20.063  -9.492
  222   HG21  THR  31          1HG2      THR  31   1.810 -18.350  -7.497
  223   HG22  THR  31          2HG2      THR  31   2.442 -18.592  -9.144
  224   HG23  THR  31          3HG2      THR  31   1.958 -16.981  -8.617
  225    H    GLN  32           H        GLN  32   0.196 -15.628  -6.795
  226    HA   GLN  32           HA       GLN  32  -0.134 -13.420  -8.681
  227    HB2  GLN  32           2HB      GLN  32  -2.369 -13.754  -7.643
  228    HB3  GLN  32           3HB      GLN  32  -1.668 -13.679  -6.034
  229    HG2  GLN  32           2HG      GLN  32  -1.323 -11.316  -7.901
  230    HG3  GLN  32           3HG      GLN  32  -2.902 -11.619  -7.212
  231   HE21  GLN  32          2HE2      GLN  32  -2.596  -9.426  -6.237
  232   HE22  GLN  32          1HE2      GLN  32  -1.672  -9.336  -4.751
  233    H    GLY  33           H        GLY  33   1.178 -11.583  -7.907
  234    HA2  GLY  33           2HA      GLY  33   2.530 -11.867  -5.325
  235    HA3  GLY  33           3HA      GLY  33   3.580 -12.008  -6.737
  236    H    LEU  34           H        LEU  34   4.495 -10.104  -5.536
  237    HA   LEU  34           HA       LEU  34   3.182  -7.509  -6.219
  238    HB2  LEU  34           2HB      LEU  34   2.700  -7.995  -3.904
  239    HB3  LEU  34           3HB      LEU  34   4.366  -8.498  -3.600
  240    HG   LEU  34           HG       LEU  34   5.143  -6.144  -3.972
  241   HD11  LEU  34          1HD1      LEU  34   2.157  -5.486  -4.092
  242   HD12  LEU  34          2HD1      LEU  34   3.492  -4.319  -4.004
  243   HD13  LEU  34          3HD1      LEU  34   3.313  -5.332  -5.432
  244   HD21  LEU  34          3HD2      LEU  34   2.956  -6.473  -1.875
  245   HD22  LEU  34          1HD2      LEU  34   4.667  -6.949  -1.716
  246   HD23  LEU  34          2HD2      LEU  34   4.244  -5.242  -1.875
  247    H    VAL  35           H        VAL  35   4.552  -6.624  -7.689
  248    HA   VAL  35           HA       VAL  35   7.468  -6.908  -7.503
  249    HB   VAL  35           HB       VAL  35   5.779  -4.901  -9.069
  250   HG11  VAL  35          1HG1      VAL  35   8.673  -5.807  -9.400
  251   HG12  VAL  35          2HG1      VAL  35   7.814  -4.675 -10.465
  252   HG13  VAL  35          3HG1      VAL  35   8.149  -4.234  -8.789
  253   HG21  VAL  35          3HG2      VAL  35   6.934  -7.544 -10.053
  254   HG22  VAL  35          1HG2      VAL  35   5.202  -7.182  -9.813
  255   HG23  VAL  35          2HG2      VAL  35   6.121  -6.321 -11.043
  256    H    HIS  36           H        HIS  36   8.587  -5.788  -5.892
  257    HA   HIS  36           HA       HIS  36   7.241  -3.656  -4.386
  258    HB2  HIS  36           2HB      HIS  36  10.074  -4.791  -4.339
  259    HB3  HIS  36           3HB      HIS  36   9.475  -3.554  -3.231
  260    HD1  HIS  36           HD1      HIS  36   8.060  -4.390  -1.181
  261    HD2  HIS  36           HD2      HIS  36   8.778  -7.315  -4.117
  262    HE1  HIS  36           HE1      HIS  36   7.232  -6.590  -0.227
  263    H    ILE  37           H        ILE  37   7.802  -1.397  -4.483
  264    HA   ILE  37           HA       ILE  37   8.177  -0.421  -7.067
  265    HB   ILE  37           HB       ILE  37   7.044   0.762  -5.234
  266   HG12  ILE  37          2HG1      ILE  37   9.207   2.316  -6.628
  267   HG13  ILE  37          3HG1      ILE  37   7.678   1.824  -7.346
  268   HG21  ILE  37          1HG2      ILE  37   9.854   1.448  -4.239
  269   HG22  ILE  37          2HG2      ILE  37   8.353   2.141  -3.629
  270   HG23  ILE  37          3HG2      ILE  37   8.663   0.430  -3.390
  271   HD11  ILE  37          3HD1      ILE  37   6.473   3.262  -5.716
  272   HD12  ILE  37          1HD1      ILE  37   8.032   3.790  -5.035
  273   HD13  ILE  37          2HD1      ILE  37   7.633   4.182  -6.704
  274    H    SER  38           H        SER  38  10.685  -0.904  -4.589
  275    HA   SER  38           HA       SER  38  12.839   0.300  -5.957
  276    HB2  SER  38           2HB      SER  38  12.983  -2.063  -4.057
  277    HB3  SER  38           3HB      SER  38  14.170  -0.763  -4.283
  278    HG   SER  38           HG       SER  38  12.891  -0.455  -2.400
  279    H    GLU  39           H        GLU  39  11.097  -2.380  -6.965
  280    HA   GLU  39           HA       GLU  39  13.380  -3.601  -8.416
  281    HB2  GLU  39           2HB      GLU  39  10.754  -4.865  -7.517
  282    HB3  GLU  39           3HB      GLU  39  12.055  -5.670  -8.363
  283    HG2  GLU  39           2HG      GLU  39  12.279  -4.468  -5.570
  284    HG3  GLU  39           3HG      GLU  39  11.989  -6.154  -5.923
  285    H    VAL  40           H        VAL  40  10.835  -1.485  -8.893
  286    HA   VAL  40           HA       VAL  40   9.794  -2.587 -11.378
  287    HB   VAL  40           HB       VAL  40   9.546   0.144 -10.061
  288   HG11  VAL  40          1HG1      VAL  40   7.977  -1.001 -12.408
  289   HG12  VAL  40          2HG1      VAL  40   7.628   0.529 -11.565
  290   HG13  VAL  40          3HG1      VAL  40   9.123   0.338 -12.492
  291   HG21  VAL  40          3HG2      VAL  40   7.615  -2.226 -10.251
  292   HG22  VAL  40          1HG2      VAL  40   8.485  -1.724  -8.793
  293   HG23  VAL  40          2HG2      VAL  40   7.266  -0.664  -9.491
  294    H    THR  41           H        THR  41  12.408  -0.307 -10.469
  295    HA   THR  41           HA       THR  41  13.641  -0.809 -13.053
  296    HB   THR  41           HB       THR  41  12.335   1.098 -13.675
  297    HG1  THR  41           1HG      THR  41  14.000   2.582 -14.102
  298   HG21  THR  41          1HG2      THR  41  13.443   2.578 -11.253
  299   HG22  THR  41          2HG2      THR  41  12.445   3.285 -12.545
  300   HG23  THR  41          3HG2      THR  41  11.762   2.060 -11.485
  301    H    HIS  42           H        HIS  42  15.911  -0.274 -12.980
  302    HA   HIS  42           HA       HIS  42  17.127  -0.198 -10.323
  303    HB2  HIS  42           2HB      HIS  42  19.227  -0.352 -11.613
  304    HB3  HIS  42           3HB      HIS  42  18.099  -1.630 -12.051
  305    HD1  HIS  42           HD1      HIS  42  19.513   1.660 -13.463
  306    HD2  HIS  42           HD2      HIS  42  17.416  -1.787 -14.655
  307    HE1  HIS  42           HE1      HIS  42  19.383   1.728 -16.016
  308    H    GLY  43           H        GLY  43  16.014   2.133 -12.636
  309    HA2  GLY  43           2HA      GLY  43  17.857   4.275 -11.871
  310    HA3  GLY  43           3HA      GLY  43  16.367   4.417 -12.814
  311    H    PHE  44           H        PHE  44  16.729   6.394 -11.066
  312    HA   PHE  44           HA       PHE  44  15.415   6.017  -8.545
  313    HB2  PHE  44           2HB      PHE  44  15.661   8.486 -10.319
  314    HB3  PHE  44           3HB      PHE  44  15.074   8.483  -8.663
  315    HD1  PHE  44           HD1      PHE  44  16.658   7.651  -6.796
  316    HD2  PHE  44           HD2      PHE  44  18.004   8.699 -10.762
  317    HE1  PHE  44           HE1      PHE  44  18.974   7.915  -5.951
  318    HE2  PHE  44           HE2      PHE  44  20.310   8.959  -9.908
  319    HZ   PHE  44           HZ       PHE  44  20.803   8.568  -7.503
  320    H    VAL  45           H        VAL  45  13.496   4.918  -8.643
  321    HA   VAL  45           HA       VAL  45  11.466   5.262 -10.615
  322    HB   VAL  45           HB       VAL  45  11.835   3.224  -9.397
  323   HG11  VAL  45          1HG1      VAL  45  10.867   4.575  -6.864
  324   HG12  VAL  45          2HG1      VAL  45  11.175   2.844  -7.093
  325   HG13  VAL  45          3HG1      VAL  45  12.508   3.965  -7.182
  326   HG21  VAL  45          3HG2      VAL  45   9.077   4.371  -8.931
  327   HG22  VAL  45          1HG2      VAL  45   9.689   3.523 -10.383
  328   HG23  VAL  45          2HG2      VAL  45   9.524   2.643  -8.873
  329    H    LYS  46           H        LYS  46  10.631   7.214 -10.959
  330    HA   LYS  46           HA       LYS  46  10.658   9.278  -8.951
  331    HB2  LYS  46           2HB      LYS  46   9.079   9.193 -11.575
  332    HB3  LYS  46           3HB      LYS  46   9.493  10.634 -10.648
  333    HG2  LYS  46           2HG      LYS  46  11.425   8.804 -12.147
  334    HG3  LYS  46           3HG      LYS  46  10.909  10.418 -12.625
  335    HD2  LYS  46           2HD      LYS  46  12.037  11.388 -10.629
  336    HD3  LYS  46           3HD      LYS  46  12.515   9.765 -10.115
  337    HE2  LYS  46           2HE      LYS  46  14.417  10.731 -11.156
  338    HE3  LYS  46           3HE      LYS  46  13.801   9.456 -12.214
  339    HZ1  LYS  46           3HZ      LYS  46  12.755  11.193 -13.551
  340    HZ2  LYS  46           1HZ      LYS  46  13.340  12.361 -12.553
  341    HZ3  LYS  46           2HZ      LYS  46  14.377  11.456 -13.453
  342    H    ASP  47           H        ASP  47   7.968   7.464 -10.439
  343    HA   ASP  47           HA       ASP  47   6.632   7.115  -7.909
  344    HB2  ASP  47           2HB      ASP  47   5.581   9.242  -8.480
  345    HB3  ASP  47           3HB      ASP  47   5.337   8.733 -10.153
  346    H    ILE  48           H        ILE  48   5.303   5.174  -8.204
  347    HA   ILE  48           HA       ILE  48   6.413   3.412 -10.081
  348    HB   ILE  48           HB       ILE  48   5.398   2.860  -7.879
  349   HG12  ILE  48          2HG1      ILE  48   4.353   1.164 -10.167
  350   HG13  ILE  48          3HG1      ILE  48   6.037   1.214  -9.624
  351   HG21  ILE  48          1HG2      ILE  48   2.729   3.046  -9.345
  352   HG22  ILE  48          2HG2      ILE  48   2.965   2.390  -7.726
  353   HG23  ILE  48          3HG2      ILE  48   3.274   4.091  -8.016
  354   HD11  ILE  48          3HD1      ILE  48   5.365   0.446  -7.367
  355   HD12  ILE  48          1HD1      ILE  48   3.672   0.354  -7.906
  356   HD13  ILE  48          2HD1      ILE  48   4.888  -0.702  -8.629
  357    H    ASN  49           H        ASN  49   3.466   5.403 -10.516
  358    HA   ASN  49           HA       ASN  49   2.569   3.926 -12.816
  359    HB2  ASN  49           2HB      ASN  49   0.848   5.349 -12.859
  360    HB3  ASN  49           3HB      ASN  49   1.415   5.858 -11.268
  361   HD21  ASN  49          2HD2      ASN  49   3.016   7.764 -11.284
  362   HD22  ASN  49          1HD2      ASN  49   2.849   8.954 -12.582
  363    H    GLU  50           H        GLU  50   5.218   6.151 -12.464
  364    HA   GLU  50           HA       GLU  50   5.266   6.905 -15.285
  365    HB2  GLU  50           2HB      GLU  50   7.442   7.101 -13.166
  366    HB3  GLU  50           3HB      GLU  50   7.424   7.919 -14.715
  367    HG2  GLU  50           2HG      GLU  50   5.557   8.407 -12.359
  368    HG3  GLU  50           3HG      GLU  50   6.855   9.446 -12.919
  369    H    HIS  51           H        HIS  51   6.044   4.038 -13.617
  370    HA   HIS  51           HA       HIS  51   8.026   3.194 -15.696
  371    HB2  HIS  51           2HB      HIS  51   8.272   2.686 -12.709
  372    HB3  HIS  51           3HB      HIS  51   9.391   2.164 -13.966
  373    HD1  HIS  51           HD1      HIS  51  10.870   4.158 -15.141
  374    HD2  HIS  51           HD2      HIS  51   8.601   5.179 -11.771
  375    HE1  HIS  51           HE1      HIS  51  11.806   6.367 -14.287
  376    H    LEU  52           H        LEU  52   5.155   2.368 -13.974
  377    HA   LEU  52           HA       LEU  52   4.982  -0.055 -15.597
  378    HB2  LEU  52           2HB      LEU  52   5.720  -0.487 -13.003
  379    HB3  LEU  52           3HB      LEU  52   3.992  -0.303 -12.765
  380    HG   LEU  52           HG       LEU  52   3.805  -2.065 -14.757
  381   HD11  LEU  52          1HD1      LEU  52   6.632  -2.582 -13.739
  382   HD12  LEU  52          2HD1      LEU  52   5.719  -3.619 -14.848
  383   HD13  LEU  52          3HD1      LEU  52   6.213  -2.001 -15.358
  384   HD21  LEU  52          3HD2      LEU  52   4.785  -2.881 -11.999
  385   HD22  LEU  52          1HD2      LEU  52   3.101  -2.536 -12.466
  386   HD23  LEU  52          2HD2      LEU  52   3.932  -3.930 -13.169
  387    H    SER  53           H        SER  53   2.523  -0.902 -15.235
  388    HA   SER  53           HA       SER  53   0.657   1.377 -14.968
  389    HB2  SER  53           2HB      SER  53   0.923  -0.379 -17.453
  390    HB3  SER  53           3HB      SER  53  -0.285   0.891 -17.177
  391    HG   SER  53           HG       SER  53   1.513   1.593 -18.444
  392    H    VAL  54           H        VAL  54  -1.275   0.625 -14.058
  393    HA   VAL  54           HA       VAL  54  -1.729  -2.200 -13.597
  394    HB   VAL  54           HB       VAL  54  -2.512  -0.412 -12.085
  395   HG11  VAL  54          1HG1      VAL  54  -4.520   0.297 -14.253
  396   HG12  VAL  54          2HG1      VAL  54  -4.533   0.898 -12.586
  397   HG13  VAL  54          3HG1      VAL  54  -3.202   1.328 -13.666
  398   HG21  VAL  54          3HG2      VAL  54  -4.747  -2.142 -13.177
  399   HG22  VAL  54          1HG2      VAL  54  -3.544  -2.579 -11.930
  400   HG23  VAL  54          2HG2      VAL  54  -4.739  -1.308 -11.622
  401    H    GLY  55           H        GLY  55  -3.341  -3.505 -14.551
  402    HA2  GLY  55           2HA      GLY  55  -4.706  -4.295 -16.205
  403    HA3  GLY  55           3HA      GLY  55  -4.985  -2.621 -16.729
  404    H    ASP  56           H        ASP  56  -1.735  -4.086 -16.546
  405    HA   ASP  56           HA       ASP  56  -1.645  -4.346 -19.511
  406    HB2  ASP  56           2HB      ASP  56  -0.564  -2.255 -18.701
  407    HB3  ASP  56           3HB      ASP  56   0.509  -3.222 -17.680
  408    H    GLU  57           H        GLU  57   0.121  -5.852 -20.178
  409    HA   GLU  57           HA       GLU  57   0.360  -8.142 -18.309
  410    HB2  GLU  57           2HB      GLU  57  -0.611  -8.512 -20.556
  411    HB3  GLU  57           3HB      GLU  57   0.881  -7.899 -21.292
  412    HG2  GLU  57           2HG      GLU  57   2.147  -9.775 -20.243
  413    HG3  GLU  57           3HG      GLU  57   0.659 -10.366 -19.505
  414    H    VAL  58           H        VAL  58   2.380  -8.812 -17.618
  415    HA   VAL  58           HA       VAL  58   4.799  -7.332 -18.471
  416    HB   VAL  58           HB       VAL  58   5.383  -6.962 -16.075
  417   HG11  VAL  58          1HG1      VAL  58   2.828  -5.551 -16.955
  418   HG12  VAL  58          2HG1      VAL  58   3.932  -4.997 -15.695
  419   HG13  VAL  58          3HG1      VAL  58   4.481  -5.091 -17.378
  420   HG21  VAL  58          3HG2      VAL  58   2.485  -7.691 -15.469
  421   HG22  VAL  58          1HG2      VAL  58   3.935  -8.589 -14.956
  422   HG23  VAL  58          2HG2      VAL  58   3.646  -6.963 -14.337
  423    H    GLN  59           H        GLN  59   6.726  -8.481 -18.060
  424    HA   GLN  59           HA       GLN  59   6.405 -11.315 -17.221
  425    HB2  GLN  59           2HB      GLN  59   7.102 -10.900 -19.567
  426    HB3  GLN  59           3HB      GLN  59   8.522 -10.019 -18.988
  427    HG2  GLN  59           2HG      GLN  59   9.529 -11.975 -18.119
  428    HG3  GLN  59           3HG      GLN  59   8.005 -12.864 -18.083
  429   HE21  GLN  59          2HE2      GLN  59   7.125 -13.724 -19.998
  430   HE22  GLN  59          1HE2      GLN  59   8.133 -13.939 -21.449
  431    H    VAL  60           H        VAL  60   7.449 -11.888 -15.372
  432    HA   VAL  60           HA       VAL  60   9.004  -9.804 -13.909
  433    HB   VAL  60           HB       VAL  60   7.844 -10.824 -11.876
  434   HG11  VAL  60          1HG1      VAL  60   6.068  -9.343 -13.851
  435   HG12  VAL  60          2HG1      VAL  60   5.772  -9.504 -12.110
  436   HG13  VAL  60          3HG1      VAL  60   7.203  -8.645 -12.657
  437   HG21  VAL  60          3HG2      VAL  60   5.885 -11.945 -13.941
  438   HG22  VAL  60          1HG2      VAL  60   6.944 -12.888 -12.859
  439   HG23  VAL  60          2HG2      VAL  60   5.673 -11.879 -12.184
  440    H    LYS  61           H        LYS  61  10.619 -10.572 -12.499
  441    HA   LYS  61           HA       LYS  61  11.237 -13.497 -12.677
  442    HB2  LYS  61           2HB      LYS  61  13.061 -11.874 -13.289
  443    HB3  LYS  61           3HB      LYS  61  12.955 -11.227 -11.656
  444    HG2  LYS  61           2HG      LYS  61  13.368 -13.695 -10.870
  445    HG3  LYS  61           3HG      LYS  61  13.786 -14.017 -12.547
  446    HD2  LYS  61           2HD      LYS  61  15.820 -13.648 -11.329
  447    HD3  LYS  61           3HD      LYS  61  15.574 -12.276 -12.398
  448    HE2  LYS  61           2HE      LYS  61  16.310 -11.384 -10.305
  449    HE3  LYS  61           3HE      LYS  61  14.591 -10.997 -10.458
  450    HZ1  LYS  61           3HZ      LYS  61  14.101 -12.883  -8.988
  451    HZ2  LYS  61           1HZ      LYS  61  15.700 -13.220  -8.851
  452    HZ3  LYS  61           2HZ      LYS  61  15.113 -11.823  -8.233
  453    H    VAL  62           H        VAL  62  10.818 -14.726 -10.890
  454    HA   VAL  62           HA       VAL  62   9.477 -13.616  -8.610
  455    HB   VAL  62           HB       VAL  62  10.863 -16.302  -8.918
  456   HG11  VAL  62          1HG1      VAL  62   8.525 -15.403  -7.164
  457   HG12  VAL  62          2HG1      VAL  62   9.157 -17.059  -7.265
  458   HG13  VAL  62          3HG1      VAL  62  10.157 -15.777  -6.585
  459   HG21  VAL  62          3HG2      VAL  62   7.989 -15.541  -9.638
  460   HG22  VAL  62          1HG2      VAL  62   9.258 -16.006 -10.792
  461   HG23  VAL  62          2HG2      VAL  62   8.669 -17.190  -9.638
  462    H    LEU  63           H        LEU  63  10.244 -13.004  -6.655
  463    HA   LEU  63           HA       LEU  63  13.200 -12.762  -6.325
  464    HB2  LEU  63           2HB      LEU  63  12.130 -10.666  -7.023
  465    HB3  LEU  63           3HB      LEU  63  10.962 -10.804  -5.712
  466    HG   LEU  63           HG       LEU  63  12.788 -10.559  -4.035
  467   HD11  LEU  63          1HD1      LEU  63  14.556  -9.981  -6.469
  468   HD12  LEU  63          2HD1      LEU  63  15.006  -9.785  -4.767
  469   HD13  LEU  63          3HD1      LEU  63  14.708 -11.404  -5.381
  470   HD21  LEU  63          3HD2      LEU  63  12.636  -8.369  -6.140
  471   HD22  LEU  63          1HD2      LEU  63  11.500  -8.606  -4.797
  472   HD23  LEU  63          2HD2      LEU  63  13.182  -8.162  -4.465
  473    H    ALA  64           H        ALA  64  10.061 -13.364  -4.671
  474    HA   ALA  64           HA       ALA  64  11.533 -14.934  -2.703
  475    HB1  ALA  64           1HB      ALA  64   9.773 -12.631  -1.786
  476    HB2  ALA  64           2HB      ALA  64  10.426 -13.890  -0.756
  477    HB3  ALA  64           3HB      ALA  64  11.536 -12.756  -1.555
  478    H    VAL  65           H        VAL  65  10.031 -16.436  -1.619
  479    HA   VAL  65           HA       VAL  65   7.176 -16.260  -2.366
  480    HB   VAL  65           HB       VAL  65   8.919 -18.770  -2.467
  481   HG11  VAL  65          1HG1      VAL  65   5.921 -18.446  -2.974
  482   HG12  VAL  65          2HG1      VAL  65   6.869 -19.935  -3.211
  483   HG13  VAL  65          3HG1      VAL  65   6.661 -19.274  -1.587
  484   HG21  VAL  65          3HG2      VAL  65   7.436 -17.346  -4.721
  485   HG22  VAL  65          1HG2      VAL  65   9.202 -17.433  -4.519
  486   HG23  VAL  65          2HG2      VAL  65   8.291 -18.901  -4.849
  487    H    ASP  66           H        ASP  66   5.936 -16.464  -0.520
  488    HA   ASP  66           HA       ASP  66   7.029 -17.861   1.846
  489    HB2  ASP  66           2HB      ASP  66   7.703 -15.468   2.076
  490    HB3  ASP  66           3HB      ASP  66   6.011 -14.999   1.977
  491    H    GLU  67           H        GLU  67   5.484 -19.419   1.495
  492    HA   GLU  67           HA       GLU  67   2.744 -18.862   0.830
  493    HB2  GLU  67           2HB      GLU  67   4.135 -20.913   0.260
  494    HB3  GLU  67           3HB      GLU  67   3.991 -21.403   1.944
  495    HG2  GLU  67           2HG      GLU  67   2.354 -22.602   0.650
  496    HG3  GLU  67           3HG      GLU  67   1.494 -21.478   1.682
  497    H    GLU  68           H        GLU  68   4.461 -19.000   3.935
  498    HA   GLU  68           HA       GLU  68   2.054 -19.458   5.505
  499    HB2  GLU  68           2HB      GLU  68   4.752 -18.249   6.255
  500    HB3  GLU  68           3HB      GLU  68   3.473 -18.648   7.395
  501    HG2  GLU  68           2HG      GLU  68   4.929 -20.637   5.592
  502    HG3  GLU  68           3HG      GLU  68   5.264 -20.370   7.292
  503    H    LYS  69           H        LYS  69   3.967 -16.576   4.498
  504    HA   LYS  69           HA       LYS  69   2.008 -14.663   5.452
  505    HB2  LYS  69           2HB      LYS  69   4.467 -14.290   4.842
  506    HB3  LYS  69           3HB      LYS  69   3.984 -14.342   3.140
  507    HG2  LYS  69           2HG      LYS  69   2.488 -12.406   3.506
  508    HG3  LYS  69           3HG      LYS  69   2.906 -12.381   5.223
  509    HD2  LYS  69           2HD      LYS  69   4.874 -11.953   2.928
  510    HD3  LYS  69           3HD      LYS  69   4.097 -10.662   3.866
  511    HE2  LYS  69           2HE      LYS  69   5.139 -11.577   5.950
  512    HE3  LYS  69           3HE      LYS  69   5.972 -12.805   4.979
  513    HZ1  LYS  69           3HZ      LYS  69   7.106 -11.050   3.817
  514    HZ2  LYS  69           1HZ      LYS  69   6.344  -9.886   4.715
  515    HZ3  LYS  69           2HZ      LYS  69   7.387 -10.948   5.426
  516    H    GLY  70           H        GLY  70   2.241 -16.682   2.605
  517    HA2  GLY  70           2HA      GLY  70   0.671 -17.216   1.024
  518    HA3  GLY  70           3HA      GLY  70  -0.448 -16.028   1.725
  519    H    LYS  71           H        LYS  71   2.925 -15.453   0.536
  520    HA   LYS  71           HA       LYS  71   1.852 -13.720  -1.628
  521    HB2  LYS  71           2HB      LYS  71   3.708 -12.793   0.611
  522    HB3  LYS  71           3HB      LYS  71   3.389 -11.875  -0.868
  523    HG2  LYS  71           2HG      LYS  71   0.919 -11.904  -0.264
  524    HG3  LYS  71           3HG      LYS  71   1.383 -12.592   1.305
  525    HD2  LYS  71           2HD      LYS  71   2.905 -10.584   1.621
  526    HD3  LYS  71           3HD      LYS  71   2.193  -9.880   0.169
  527    HE2  LYS  71           2HE      LYS  71   0.658 -10.711   2.685
  528    HE3  LYS  71           3HE      LYS  71   1.175  -9.058   2.319
  529    HZ1  LYS  71           3HZ      LYS  71  -0.238  -9.120   0.360
  530    HZ2  LYS  71           1HZ      LYS  71  -0.704 -10.665   0.708
  531    HZ3  LYS  71           2HZ      LYS  71  -1.120  -9.421   1.708
  532    H    ILE  72           H        ILE  72   3.555 -12.891  -3.035
  533    HA   ILE  72           HA       ILE  72   6.073 -14.417  -3.165
  534    HB   ILE  72           HB       ILE  72   4.038 -14.022  -5.420
  535   HG12  ILE  72          2HG1      ILE  72   5.066 -16.562  -4.095
  536   HG13  ILE  72          3HG1      ILE  72   3.435 -15.896  -3.962
  537   HG21  ILE  72          1HG2      ILE  72   6.825 -15.245  -5.533
  538   HG22  ILE  72          2HG2      ILE  72   5.678 -15.173  -6.889
  539   HG23  ILE  72          3HG2      ILE  72   6.338 -13.696  -6.245
  540   HD11  ILE  72          3HD1      ILE  72   3.045 -16.256  -6.366
  541   HD12  ILE  72          1HD1      ILE  72   4.654 -17.011  -6.519
  542   HD13  ILE  72          2HD1      ILE  72   3.431 -17.758  -5.508
  543    H    SER  73           H        SER  73   7.687 -12.865  -3.351
  544    HA   SER  73           HA       SER  73   6.970 -10.124  -4.214
  545    HB2  SER  73           2HB      SER  73   9.647 -11.275  -3.377
  546    HB3  SER  73           3HB      SER  73   9.279  -9.582  -3.657
  547    HG   SER  73           HG       SER  73   9.134 -10.030  -1.449
  548    H    LEU  74           H        LEU  74   7.863  -9.220  -6.087
  549    HA   LEU  74           HA       LEU  74   8.959 -11.086  -8.144
  550    HB2  LEU  74           2HB      LEU  74   6.708  -9.062  -8.394
  551    HB3  LEU  74           3HB      LEU  74   7.396  -9.968  -9.735
  552    HG   LEU  74           HG       LEU  74   5.865 -11.175  -7.391
  553   HD11  LEU  74          1HD1      LEU  74   4.995 -10.659 -10.264
  554   HD12  LEU  74          2HD1      LEU  74   4.048 -11.501  -9.028
  555   HD13  LEU  74          3HD1      LEU  74   4.430  -9.792  -8.822
  556   HD21  LEU  74          3HD2      LEU  74   6.821 -12.467  -9.987
  557   HD22  LEU  74          1HD2      LEU  74   7.474 -12.773  -8.355
  558   HD23  LEU  74          2HD2      LEU  74   5.819 -13.228  -8.732
  559    H    SER  75           H        SER  75   9.914  -9.825  -9.978
  560    HA   SER  75           HA       SER  75  10.616  -7.020  -9.367
  561    HB2  SER  75           2HB      SER  75  13.015  -7.613  -9.996
  562    HB3  SER  75           3HB      SER  75  12.451  -8.108  -8.401
  563    HG   SER  75           HG       SER  75  13.620  -9.730  -9.415
  564    H    ILE  76           H        ILE  76  11.229  -5.797 -11.143
  565    HA   ILE  76           HA       ILE  76  10.573  -6.887 -13.843
  566    HB   ILE  76           HB       ILE  76   9.644  -4.414 -12.377
  567   HG12  ILE  76          2HG1      ILE  76   8.211  -6.402 -12.235
  568   HG13  ILE  76          3HG1      ILE  76   7.430  -5.026 -13.007
  569   HG21  ILE  76          1HG2      ILE  76   9.527  -4.753 -15.399
  570   HG22  ILE  76          2HG2      ILE  76   8.682  -3.495 -14.456
  571   HG23  ILE  76          3HG2      ILE  76  10.435  -3.533 -14.502
  572   HD11  ILE  76          3HD1      ILE  76   7.773  -6.063 -15.250
  573   HD12  ILE  76          1HD1      ILE  76   8.574  -7.438 -14.447
  574   HD13  ILE  76          2HD1      ILE  76   6.855  -7.087 -14.173
  575    H    ARG  77           H        ARG  77  12.567  -4.571 -11.935
  576    HA   ARG  77           HA       ARG  77  14.151  -3.729 -14.130
  577    HB2  ARG  77           2HB      ARG  77  15.858  -3.180 -12.551
  578    HB3  ARG  77           3HB      ARG  77  14.281  -2.791 -11.856
  579    HG2  ARG  77           2HG      ARG  77  14.382  -4.739 -10.379
  580    HG3  ARG  77           3HG      ARG  77  15.911  -5.259 -11.117
  581    HD2  ARG  77           2HD      ARG  77  17.053  -3.272 -10.360
  582    HD3  ARG  77           3HD      ARG  77  15.542  -2.549  -9.772
  583    HE   ARG  77           HE       ARG  77  15.590  -4.825  -8.310
  584   HH11  ARG  77          1HH1      ARG  77  18.231  -2.517  -8.886
  585   HH12  ARG  77          2HH1      ARG  77  18.832  -2.627  -7.267
  586   HH21  ARG  77          1HH2      ARG  77  16.273  -4.827  -6.176
  587   HH22  ARG  77          2HH2      ARG  77  17.719  -4.009  -5.700
  588    H    ALA  78           H        ALA  78  14.014  -6.852 -12.607
  589    HA   ALA  78           HA       ALA  78  16.402  -7.960 -13.747
  590    HB1  ALA  78           1HB      ALA  78  13.780  -9.263 -12.868
  591    HB2  ALA  78           2HB      ALA  78  15.322 -10.092 -13.146
  592    HB3  ALA  78           3HB      ALA  78  15.177  -8.926 -11.809
  593    H    THR  79           H        THR  79  13.245  -7.247 -15.225
  594    HA   THR  79           HA       THR  79  13.828  -9.156 -17.438
  595    HB   THR  79           HB       THR  79  11.337  -9.147 -17.713
  596    HG1  THR  79           1HG      THR  79  10.120  -8.339 -16.020
  597   HG21  THR  79          1HG2      THR  79  12.255  -9.970 -14.919
  598   HG22  THR  79          2HG2      THR  79  10.809 -10.544 -15.766
  599   HG23  THR  79          3HG2      THR  79  12.402 -10.964 -16.388
  600    H    GLN  80           H        GLN  80  13.025  -5.804 -16.644
  601    HA   GLN  80           HA       GLN  80  12.590  -4.837 -19.293
  602    HB2  GLN  80           2HB      GLN  80  13.784  -3.553 -16.804
  603    HB3  GLN  80           3HB      GLN  80  13.421  -2.648 -18.270
  604    HG2  GLN  80           2HG      GLN  80  11.277  -4.244 -16.820
  605    HG3  GLN  80           3HG      GLN  80  11.714  -2.605 -16.344
  606   HE21  GLN  80          2HE2      GLN  80   9.404  -2.072 -16.817
  607   HE22  GLN  80          1HE2      GLN  80   8.956  -1.774 -18.482
  608    H    ALA  81           H        ALA  81  14.036  -3.591 -20.582
  609    HA   ALA  81           HA       ALA  81  16.921  -3.729 -20.173
  610    HB1  ALA  81           1HB      ALA  81  15.540  -4.843 -22.664
  611    HB2  ALA  81           2HB      ALA  81  17.286  -4.550 -22.510
  612    HB3  ALA  81           3HB      ALA  81  16.500  -5.774 -21.488
  613    H    ALA  82           H        ALA  82  17.973  -2.120 -21.546
  614    HA   ALA  82           HA       ALA  82  16.488   0.272 -21.987
  615    HB1  ALA  82           1HB      ALA  82  19.233  -0.580 -23.018
  616    HB2  ALA  82           2HB      ALA  82  18.595   1.072 -23.047
  617    HB3  ALA  82           3HB      ALA  82  18.902   0.277 -21.489
  618    HA   PRO  83           HA       PRO  83  15.067  -0.539 -26.186
  619    HB2  PRO  83           2HB      PRO  83  14.720   2.025 -27.131
  620    HB3  PRO  83           3HB      PRO  83  13.617   1.268 -25.943
  621    HG2  PRO  83           2HG      PRO  83  15.924   3.162 -25.435
  622    HG3  PRO  83           3HG      PRO  83  14.281   3.219 -24.730
  623    HD2  PRO  83           2HD      PRO  83  16.436   2.122 -23.420
  624    HD3  PRO  83           3HD      PRO  83  14.777   1.484 -23.215
  625    H    GLU  84           H        GLU  84  15.803  -0.189 -28.439
  626    HA   GLU  84           HA       GLU  84  18.609   0.090 -28.837
  627    HB2  GLU  84           2HB      GLU  84  17.058  -1.149 -30.326
  628    HB3  GLU  84           3HB      GLU  84  16.295   0.370 -30.820
  629    HG2  GLU  84           2HG      GLU  84  18.319   1.107 -31.922
  630    HG3  GLU  84           3HG      GLU  84  19.269  -0.181 -31.179
  631    H    LYS  85           H        LYS  85  19.785   1.828 -29.747
  632    HA   LYS  85           HA       LYS  85  18.967   4.472 -28.899
  633    HB2  LYS  85           2HB      LYS  85  21.435   3.486 -30.409
  634    HB3  LYS  85           3HB      LYS  85  21.211   5.133 -29.797
  635    HG2  LYS  85           2HG      LYS  85  21.010   4.246 -27.480
  636    HG3  LYS  85           3HG      LYS  85  21.297   2.605 -28.090
  637    HD2  LYS  85           2HD      LYS  85  23.518   3.305 -28.946
  638    HD3  LYS  85           3HD      LYS  85  23.235   4.948 -28.320
  639    HE2  LYS  85           2HE      LYS  85  23.019   4.028 -26.021
  640    HE3  LYS  85           3HE      LYS  85  23.293   2.393 -26.640
  641    HZ1  LYS  85           3HZ      LYS  85  25.499   3.082 -27.336
  642    HZ2  LYS  85           1HZ      LYS  85  25.241   4.617 -26.772
  643    HZ3  LYS  85           2HZ      LYS  85  25.294   3.347 -25.734
  644    H    LYS  86           H        LYS  86  16.975   4.082 -30.470
  645    HA   LYS  86           HA       LYS  86  17.167   4.375 -33.264
  646    HB2  LYS  86           2HB      LYS  86  15.065   5.552 -31.400
  647    HB3  LYS  86           3HB      LYS  86  14.879   5.335 -33.136
  648    HG2  LYS  86           2HG      LYS  86  15.165   3.101 -31.078
  649    HG3  LYS  86           3HG      LYS  86  13.685   3.621 -31.876
  650    HD2  LYS  86           2HD      LYS  86  14.780   3.001 -34.102
  651    HD3  LYS  86           3HD      LYS  86  16.087   2.250 -33.149
  652    HE2  LYS  86           2HE      LYS  86  14.378   0.846 -31.982
  653    HE3  LYS  86           3HE      LYS  86  13.118   1.556 -33.011
  654    HZ1  LYS  86           3HZ      LYS  86  14.284   0.604 -34.923
  655    HZ2  LYS  86           1HZ      LYS  86  15.430  -0.057 -33.938
  656    HZ3  LYS  86           2HZ      LYS  86  13.885  -0.585 -33.853
  657    H    GLU  87           H        GLU  87  17.620   6.921 -30.824
  658    HA   GLU  87           HA       GLU  87  17.231   9.121 -32.592
  659    HB2  GLU  87           2HB      GLU  87  18.771   8.846 -29.978
  660    HB3  GLU  87           3HB      GLU  87  18.405  10.384 -30.781
  661    HG2  GLU  87           2HG      GLU  87  15.958   9.870 -30.586
  662    HG3  GLU  87           3HG      GLU  87  16.360   8.398 -29.699
  663    H    SER  88           H        SER  88  19.934   6.920 -32.303
  664    HA   SER  88           HA       SER  88  21.649   8.819 -33.860
  665    HB2  SER  88           2HB      SER  88  22.573   7.288 -31.400
  666    HB3  SER  88           3HB      SER  88  23.509   8.450 -32.353
  667    HG   SER  88           HG       SER  88  22.634   9.403 -30.432
  668    H    LYS  89           H        LYS  89  20.869   5.438 -33.140
  669    HA   LYS  89           HA       LYS  89  23.126   4.300 -34.469
  670    HB2  LYS  89           2HB      LYS  89  21.762   3.120 -32.797
  671    HB3  LYS  89           3HB      LYS  89  20.381   3.101 -33.885
  672    HG2  LYS  89           2HG      LYS  89  21.627   1.705 -35.493
  673    HG3  LYS  89           3HG      LYS  89  23.077   1.796 -34.470
  674    HD2  LYS  89           2HD      LYS  89  21.875   0.634 -32.645
  675    HD3  LYS  89           3HD      LYS  89  20.405   0.578 -33.646
  676    HE2  LYS  89           2HE      LYS  89  21.598  -0.785 -35.336
  677    HE3  LYS  89           3HE      LYS  89  23.074  -0.719 -34.365
  678    HZ1  LYS  89           3HZ      LYS  89  21.878  -1.909 -32.622
  679    HZ2  LYS  89           1HZ      LYS  89  20.504  -1.952 -33.516
  680    HZ3  LYS  89           2HZ      LYS  89  21.861  -2.765 -34.017
  681    HA   PRO  90           HA       PRO  90  20.528   3.814 -38.420
  682    HB2  PRO  90           2HB      PRO  90  18.363   5.489 -38.871
  683    HB3  PRO  90           3HB      PRO  90  18.248   3.822 -38.220
  684    HG2  PRO  90           2HG      PRO  90  18.253   6.442 -36.706
  685    HG3  PRO  90           3HG      PRO  90  17.191   5.023 -36.455
  686    HD2  PRO  90           2HD      PRO  90  19.367   5.491 -34.900
  687    HD3  PRO  90           3HD      PRO  90  18.903   3.827 -35.362
  688    H    ARG  91           H        ARG  91  20.899   5.052 -40.367
  689    HA   ARG  91           HA       ARG  91  22.484   7.501 -39.792
  690    HB2  ARG  91           2HB      ARG  91  22.248   6.047 -42.448
  691    HB3  ARG  91           3HB      ARG  91  23.472   7.204 -41.941
  692    HG2  ARG  91           2HG      ARG  91  23.209   4.286 -41.306
  693    HG3  ARG  91           3HG      ARG  91  24.588   5.170 -41.924
  694    HD2  ARG  91           2HD      ARG  91  23.570   5.004 -39.081
  695    HD3  ARG  91           3HD      ARG  91  25.104   4.426 -39.704
  696    HE   ARG  91           HE       ARG  91  25.494   6.972 -40.195
  697   HH11  ARG  91          1HH1      ARG  91  23.891   5.600 -37.305
  698   HH12  ARG  91          2HH1      ARG  91  24.269   6.898 -36.288
  699   HH21  ARG  91          1HH2      ARG  91  26.025   8.757 -38.800
  700   HH22  ARG  91          2HH2      ARG  91  25.534   8.708 -37.145
  701    H    LYS  92           H        LYS  92  19.422   6.550 -41.254
  702    HA   LYS  92           HA       LYS  92  18.864   9.375 -41.793
  703    HB2  LYS  92           2HB      LYS  92  19.845   8.215 -43.901
  704    HB3  LYS  92           3HB      LYS  92  18.400   7.218 -43.897
  705    HG2  LYS  92           2HG      LYS  92  18.064   8.981 -45.472
  706    HG3  LYS  92           3HG      LYS  92  17.001   9.287 -44.109
  707    HD2  LYS  92           2HD      LYS  92  17.986  11.363 -44.891
  708    HD3  LYS  92           3HD      LYS  92  18.578  11.022 -43.263
  709    HE2  LYS  92           2HE      LYS  92  20.696  10.154 -44.180
  710    HE3  LYS  92           3HE      LYS  92  20.105  10.408 -45.832
  711    HZ1  LYS  92           3HZ      LYS  92  20.023  12.775 -45.362
  712    HZ2  LYS  92           1HZ      LYS  92  20.571  12.525 -43.825
  713    HZ3  LYS  92           2HZ      LYS  92  21.541  12.196 -45.108
  714    HA   PRO  93           HA       PRO  93  14.952   7.833 -40.103
  715    HB2  PRO  93           2HB      PRO  93  13.772  10.036 -41.792
  716    HB3  PRO  93           3HB      PRO  93  13.428   9.621 -40.084
  717    HG2  PRO  93           2HG      PRO  93  15.026  11.737 -40.704
  718    HG3  PRO  93           3HG      PRO  93  15.464  10.642 -39.355
  719    HD2  PRO  93           2HD      PRO  93  16.538  10.661 -42.181
  720    HD3  PRO  93           3HD      PRO  93  17.425  10.468 -40.633
  721    H    LYS  94           H        LYS  94  12.973   6.811 -40.889
  722    HA   LYS  94           HA       LYS  94  12.517   6.631 -43.775
  723    HB2  LYS  94           2HB      LYS  94  14.077   4.745 -43.103
  724    HB3  LYS  94           3HB      LYS  94  12.811   4.151 -42.015
  725    HG2  LYS  94           2HG      LYS  94  11.313   3.800 -43.969
  726    HG3  LYS  94           3HG      LYS  94  12.563   4.465 -45.045
  727    HD2  LYS  94           2HD      LYS  94  14.107   2.617 -44.334
  728    HD3  LYS  94           3HD      LYS  94  12.816   1.976 -43.303
  729    HE2  LYS  94           2HE      LYS  94  12.772   0.660 -45.282
  730    HE3  LYS  94           3HE      LYS  94  11.374   1.737 -45.372
  731    HZ1  LYS  94           3HZ      LYS  94  12.664   3.149 -46.838
  732    HZ2  LYS  94           1HZ      LYS  94  13.972   2.132 -46.742
  733    HZ3  LYS  94           2HZ      LYS  94  12.572   1.608 -47.431
  734    H    ALA  95           H        ALA  95  10.271   6.132 -44.173
  735    HA   ALA  95           HA       ALA  95   8.392   6.932 -42.202
  736    HB1  ALA  95           1HB      ALA  95   7.996   5.320 -44.767
  737    HB2  ALA  95           2HB      ALA  95   6.716   6.134 -43.850
  738    HB3  ALA  95           3HB      ALA  95   7.980   7.097 -44.635
  739    H    ALA  96           H        ALA  96   6.759   5.687 -41.122
  740    HA   ALA  96           HA       ALA  96   7.461   3.102 -40.101
  741    HB1  ALA  96           1HB      ALA  96   4.778   4.564 -40.191
  742    HB2  ALA  96           2HB      ALA  96   5.136   3.115 -39.232
  743    HB3  ALA  96           3HB      ALA  96   5.975   4.636 -38.871
  744    H    GLN  97           H        GLN  97   7.355   1.207 -41.140
  745    HA   GLN  97           HA       GLN  97   5.347   0.638 -43.206
  746    HB2  GLN  97           2HB      GLN  97   8.378   0.534 -43.627
  747    HB3  GLN  97           3HB      GLN  97   7.202  -0.254 -44.682
  748    HG2  GLN  97           2HG      GLN  97   6.183   1.985 -45.174
  749    HG3  GLN  97           3HG      GLN  97   7.461   2.745 -44.227
  750   HE21  GLN  97          2HE2      GLN  97   6.768   0.954 -47.211
  751   HE22  GLN  97          1HE2      GLN  97   8.295   1.312 -47.988
  752    H    VAL  98           H        VAL  98   5.563  -1.759 -43.782
  753    HA   VAL  98           HA       VAL  98   5.887  -3.519 -41.563
  754    HB   VAL  98           HB       VAL  98   5.709  -5.303 -43.287
  755   HG11  VAL  98          1HG1      VAL  98   3.696  -3.030 -43.629
  756   HG12  VAL  98          2HG1      VAL  98   3.442  -4.722 -44.080
  757   HG13  VAL  98          3HG1      VAL  98   3.668  -4.290 -42.380
  758   HG21  VAL  98          3HG2      VAL  98   5.679  -3.037 -45.339
  759   HG22  VAL  98          1HG2      VAL  98   6.940  -4.277 -45.154
  760   HG23  VAL  98          2HG2      VAL  98   5.308  -4.745 -45.645
  761    H    SER  99           H        SER  99   7.398  -5.438 -41.633
  762    HA   SER  99           HA       SER  99  10.008  -4.762 -41.183
  763    HB2  SER  99           2HB      SER  99   9.070  -7.448 -42.257
  764    HB3  SER  99           3HB      SER  99  10.429  -7.130 -41.165
  765    HG   SER  99           HG       SER  99   8.560  -7.871 -40.043
  766    H    GLU 100           H        GLU 100  11.956  -4.796 -42.327
  767    HA   GLU 100           HA       GLU 100  11.992  -5.144 -45.232
  768    HB2  GLU 100           2HB      GLU 100  11.049  -2.887 -44.882
  769    HB3  GLU 100           3HB      GLU 100  12.354  -2.482 -43.770
  770    HG2  GLU 100           2HG      GLU 100  12.672  -1.440 -45.957
  771    HG3  GLU 100           3HG      GLU 100  13.975  -2.538 -45.568
  772    H    GLU 101           H        GLU 101  14.188  -5.093 -45.985
  773    HA   GLU 101           HA       GLU 101  16.357  -5.277 -43.985
  774    HB2  GLU 101           2HB      GLU 101  16.991  -7.492 -44.687
  775    HB3  GLU 101           3HB      GLU 101  15.325  -7.499 -44.113
  776    HG2  GLU 101           2HG      GLU 101  14.551  -7.399 -46.524
  777    HG3  GLU 101           3HG      GLU 101  16.236  -7.562 -47.026
  778    H    ALA 102           H        ALA 102  15.352  -4.012 -46.910
  779    HA   ALA 102           HA       ALA 102  18.180  -3.362 -47.552
  780    HB1  ALA 102           1HB      ALA 102  16.020  -4.129 -49.558
  781    HB2  ALA 102           2HB      ALA 102  17.628  -3.478 -49.971
  782    HB3  ALA 102           3HB      ALA 102  17.490  -5.060 -49.180
  783    H    SER 103           H        SER 103  18.308  -1.275 -48.746
  784    HA   SER 103           HA       SER 103  18.051   0.981 -48.451
  785    HB2  SER 103           2HB      SER 103  15.178   0.362 -49.221
  786    HB3  SER 103           3HB      SER 103  16.023   1.912 -49.405
  787    HG   SER 103           HG       SER 103  16.000   0.628 -51.338
  788    H    THR 104           H        THR 104  17.974  -0.454 -46.059
  789    HA   THR 104           HA       THR 104  15.859   0.271 -44.332
  790    HB   THR 104           HB       THR 104  17.917  -0.607 -42.733
  791    HG1  THR 104           1HG      THR 104  19.085  -2.156 -43.954
  792   HG21  THR 104          1HG2      THR 104  16.250  -2.350 -44.611
  793   HG22  THR 104          2HG2      THR 104  17.039  -2.891 -43.113
  794   HG23  THR 104          3HG2      THR 104  15.706  -1.724 -43.040
  795    HA   PRO 105           HA       PRO 105  17.201   4.172 -42.785
  796    HB2  PRO 105           2HB      PRO 105  16.769   4.086 -40.072
  797    HB3  PRO 105           3HB      PRO 105  15.463   4.158 -41.273
  798    HG2  PRO 105           2HG      PRO 105  16.555   1.727 -39.841
  799    HG3  PRO 105           3HG      PRO 105  14.845   2.166 -40.126
  800    HD2  PRO 105           2HD      PRO 105  16.189   0.368 -41.698
  801    HD3  PRO 105           3HD      PRO 105  14.943   1.455 -42.370
  802    H    GLN 106           H        GLN 106  18.722   1.315 -41.375
  803    HA   GLN 106           HA       GLN 106  21.059   2.698 -40.321
  804    HB2  GLN 106           2HB      GLN 106  20.536  -0.226 -41.004
  805    HB3  GLN 106           3HB      GLN 106  21.975   0.382 -40.173
  806    HG2  GLN 106           2HG      GLN 106  20.532   1.262 -38.331
  807    HG3  GLN 106           3HG      GLN 106  19.117   0.569 -39.125
  808   HE21  GLN 106          2HE2      GLN 106  18.742  -1.715 -38.987
  809   HE22  GLN 106          1HE2      GLN 106  19.758  -2.732 -37.996
  810    H    GLY 107           H        GLY 107  20.056   2.582 -43.449
  811    HA2  GLY 107           2HA      GLY 107  21.511   3.439 -45.174
  812    HA3  GLY 107           3HA      GLY 107  22.807   2.388 -44.574
  813    H    PHE 108           H        PHE 108  22.172   2.192 -47.234
  814    HA   PHE 108           HA       PHE 108  20.324   0.109 -47.847
  815    HB2  PHE 108           2HB      PHE 108  21.473   1.613 -49.520
  816    HB3  PHE 108           3HB      PHE 108  22.974   0.743 -49.209
  817    HD1  PHE 108           HD2      PHE 108  19.451   0.325 -50.452
  818    HD2  PHE 108           HD1      PHE 108  23.451  -1.301 -50.346
  819    HE1  PHE 108           HE2      PHE 108  18.784  -1.423 -52.068
  820    HE2  PHE 108           HE1      PHE 108  22.782  -3.032 -51.987
  821    HZ   PHE 108           HZ       PHE 108  20.449  -3.107 -52.844
  822    H    ASN 109           H        ASN 109  20.726  -2.136 -48.294
  823    HA   ASN 109           HA       ASN 109  23.085  -3.426 -47.119
  824    HB2  ASN 109           2HB      ASN 109  21.541  -3.351 -45.226
  825    HB3  ASN 109           3HB      ASN 109  20.213  -3.921 -46.250
  826   HD21  ASN 109          2HD2      ASN 109  19.747  -6.036 -45.708
  827   HD22  ASN 109          1HD2      ASN 109  20.954  -7.275 -45.431
  828    H    THR 110           H        THR 110  23.645  -5.108 -48.404
  829    HA   THR 110           HA       THR 110  22.235  -5.654 -50.861
  830    HB   THR 110           HB       THR 110  24.219  -7.356 -50.981
  831    HG1  THR 110           1HG      THR 110  25.914  -6.787 -49.506
  832   HG21  THR 110          1HG2      THR 110  24.795  -4.375 -50.657
  833   HG22  THR 110          2HG2      THR 110  25.829  -5.552 -51.492
  834   HG23  THR 110          3HG2      THR 110  24.227  -5.174 -52.138
  835    H    LEU 111           H        LEU 111  22.077  -8.082 -51.526
  836    HA   LEU 111           HA       LEU 111  21.217  -9.857 -49.338
  837    HB2  LEU 111           2HB      LEU 111  19.173  -8.796 -50.179
  838    HB3  LEU 111           3HB      LEU 111  19.616  -9.206 -51.842
  839    HG   LEU 111           HG       LEU 111  19.400 -11.630 -51.302
  840   HD11  LEU 111          1HD1      LEU 111  18.379 -10.667 -48.585
  841   HD12  LEU 111          2HD1      LEU 111  18.334 -12.333 -49.182
  842   HD13  LEU 111          3HD1      LEU 111  19.882 -11.570 -48.851
  843   HD21  LEU 111          3HD2      LEU 111  16.966  -9.951 -50.587
  844   HD22  LEU 111          1HD2      LEU 111  17.481 -10.406 -52.231
  845   HD23  LEU 111          2HD2      LEU 111  16.940 -11.653 -51.084
  846    H    LYS 112           H        LYS 112  21.741 -12.018 -49.790
  847    HA   LYS 112           HA       LYS 112  22.734 -12.780 -52.455
  848    HB2  LYS 112           2HB      LYS 112  24.320 -13.179 -49.864
  849    HB3  LYS 112           3HB      LYS 112  24.704 -13.917 -51.420
  850    HG2  LYS 112           2HG      LYS 112  25.024 -11.631 -52.401
  851    HG3  LYS 112           3HG      LYS 112  24.747 -10.931 -50.793
  852    HD2  LYS 112           2HD      LYS 112  26.683 -12.191 -49.899
  853    HD3  LYS 112           3HD      LYS 112  26.974 -12.882 -51.515
  854    HE2  LYS 112           2HE      LYS 112  27.279 -10.589 -52.430
  855    HE3  LYS 112           3HE      LYS 112  27.004  -9.910 -50.818
  856    HZ1  LYS 112           3HZ      LYS 112  28.995 -11.072 -50.057
  857    HZ2  LYS 112           1HZ      LYS 112  29.241 -11.702 -51.561
  858    HZ3  LYS 112           2HZ      LYS 112  29.342 -10.086 -51.315
  859    H    ASP 113           H        ASP 113  22.859 -15.198 -52.564
  860    HA   ASP 113           HA       ASP 113  20.447 -16.372 -51.844
  861    HB2  ASP 113           2HB      ASP 113  21.890 -17.121 -53.688
  862    HB3  ASP 113           3HB      ASP 113  23.112 -17.661 -52.537
  863    H    LYS 114           H        LYS 114  23.433 -16.349 -49.968
  864    HA   LYS 114           HA       LYS 114  22.094 -17.994 -47.864
  865    HB2  LYS 114           2HB      LYS 114  25.031 -18.064 -48.705
  866    HB3  LYS 114           3HB      LYS 114  24.330 -18.958 -47.347
  867    HG2  LYS 114           2HG      LYS 114  22.795 -20.137 -48.919
  868    HG3  LYS 114           3HG      LYS 114  23.574 -19.293 -50.272
  869    HD2  LYS 114           2HD      LYS 114  25.723 -20.359 -49.769
  870    HD3  LYS 114           3HD      LYS 114  25.017 -21.143 -48.347
  871    HE2  LYS 114           2HE      LYS 114  25.111 -22.749 -50.160
  872    HE3  LYS 114           3HE      LYS 114  23.422 -22.371 -49.789
  873    HZ1  LYS 114           3HZ      LYS 114  23.357 -20.908 -51.721
  874    HZ2  LYS 114           1HZ      LYS 114  24.939 -21.239 -52.062
  875    HZ3  LYS 114           2HZ      LYS 114  23.784 -22.403 -52.159
  876    H    LEU 115           H        LEU 115  22.365 -14.976 -48.274
  877    HA   LEU 115           HA       LEU 115  23.859 -14.109 -45.923
  878    HB2  LEU 115           2HB      LEU 115  23.145 -12.680 -47.926
  879    HB3  LEU 115           3HB      LEU 115  21.516 -12.692 -47.259
  880    HG   LEU 115           HG       LEU 115  24.028 -11.663 -45.849
  881   HD11  LEU 115          1HD1      LEU 115  21.754 -10.149 -47.199
  882   HD12  LEU 115          2HD1      LEU 115  23.078  -9.410 -46.298
  883   HD13  LEU 115          3HD1      LEU 115  23.429 -10.276 -47.792
  884   HD21  LEU 115          3HD2      LEU 115  21.104 -11.335 -45.040
  885   HD22  LEU 115          1HD2      LEU 115  22.314 -12.313 -44.171
  886   HD23  LEU 115          2HD2      LEU 115  22.505 -10.574 -44.245
  887    H    GLU 116           H        GLU 116  23.305 -15.104 -44.053
  888    HA   GLU 116           HA       GLU 116  20.625 -14.827 -42.960
  889    HB2  GLU 116           2HB      GLU 116  21.381 -17.258 -44.276
  890    HB3  GLU 116           3HB      GLU 116  21.511 -17.586 -42.556
  891    HG2  GLU 116           2HG      GLU 116  19.038 -16.350 -43.847
  892    HG3  GLU 116           3HG      GLU 116  19.286 -18.084 -43.686
  893    H    GLU 117           H        GLU 117  20.798 -15.748 -40.617
  894    HA   GLU 117           HA       GLU 117  22.688 -14.192 -39.313
  895    HB2  GLU 117           2HB      GLU 117  20.390 -15.044 -38.603
  896    HB3  GLU 117           3HB      GLU 117  21.175 -16.555 -38.151
  897    HG2  GLU 117           2HG      GLU 117  20.822 -15.147 -36.195
  898    HG3  GLU 117           3HG      GLU 117  22.536 -15.353 -36.471
  899    H    TRP 118           H        TRP 118  23.285 -17.383 -40.507
  900    HA   TRP 118           HA       TRP 118  25.408 -18.096 -38.709
  901    HB2  TRP 118           2HB      TRP 118  26.048 -19.662 -40.576
  902    HB3  TRP 118           3HB      TRP 118  24.415 -19.817 -39.947
  903    HD1  TRP 118           HD1      TRP 118  25.924 -17.762 -42.861
  904    HE1  TRP 118           HE1      TRP 118  24.429 -18.002 -44.915
  905    HE3  TRP 118           HE3      TRP 118  22.460 -21.014 -40.954
  906    HZ2  TRP 118           HZ2      TRP 118  22.183 -19.643 -45.731
  907    HZ3  TRP 118           HZ3      TRP 118  20.666 -21.915 -42.402
  908    HH2  TRP 118           HH2      TRP 118  20.522 -21.239 -44.788
  909    H    ILE 119           H        ILE 119  25.379 -15.696 -41.271
  910    HA   ILE 119           HA       ILE 119  28.239 -15.745 -41.750
  911    HB   ILE 119           HB       ILE 119  27.936 -13.662 -42.912
  912   HG12  ILE 119          2HG1      ILE 119  25.277 -13.429 -41.484
  913   HG13  ILE 119          3HG1      ILE 119  26.661 -12.359 -41.423
  914   HG21  ILE 119          1HG2      ILE 119  25.578 -15.514 -43.465
  915   HG22  ILE 119          2HG2      ILE 119  26.225 -14.317 -44.583
  916   HG23  ILE 119          3HG2      ILE 119  27.230 -15.670 -44.098
  917   HD11  ILE 119          3HD1      ILE 119  26.309 -11.707 -43.785
  918   HD12  ILE 119          1HD1      ILE 119  24.870 -12.762 -43.850
  919   HD13  ILE 119          2HD1      ILE 119  24.883 -11.374 -42.772
  920    H    GLU 120           H        GLU 120  29.686 -13.869 -41.257
  921    HA   GLU 120           HA       GLU 120  28.953 -12.393 -38.840
  922    HB2  GLU 120           2HB      GLU 120  30.623 -14.562 -38.589
  923    HB3  GLU 120           3HB      GLU 120  31.800 -13.318 -39.002
  924    HG2  GLU 120           2HG      GLU 120  29.862 -13.424 -36.662
  925    HG3  GLU 120           3HG      GLU 120  31.619 -13.423 -36.590
  926    H    MET 121           H        MET 121  29.833 -10.285 -38.884
  927    HA   MET 121           HA       MET 121  31.700  -9.477 -41.011
  928    HB2  MET 121           2HB      MET 121  28.884  -8.316 -40.790
  929    HB3  MET 121           3HB      MET 121  30.185  -7.656 -41.785
  930    HG2  MET 121           2HG      MET 121  30.224  -9.774 -43.096
  931    HG3  MET 121           3HG      MET 121  28.852 -10.363 -42.158
  932    HE1  MET 121           3HE      MET 121  26.377  -9.487 -42.354
  933    HE2  MET 121           1HE      MET 121  26.925  -7.875 -41.839
  934    HE3  MET 121           2HE      MET 121  25.912  -8.047 -43.288
  935    H    SER 122           H        SER 122  32.875  -7.578 -40.199
  936    HA   SER 122           HA       SER 122  32.458  -6.845 -37.491
  937    HB2  SER 122           2HB      SER 122  33.995  -5.412 -39.672
  938    HB3  SER 122           3HB      SER 122  34.153  -5.133 -37.922
  939    HG   SER 122           HG       SER 122  35.692  -6.647 -38.756
  940    H    ASN 123           H        ASN 123  30.757  -5.633 -40.293
  941    HA   ASN 123           HA       ASN 123  29.626  -3.320 -38.975
  942    HB2  ASN 123           2HB      ASN 123  29.496  -3.675 -41.420
  943    HB3  ASN 123           3HB      ASN 123  28.510  -5.117 -41.171
  944   HD21  ASN 123          2HD2      ASN 123  26.276  -4.812 -41.177
  945   HD22  ASN 123          1HD2      ASN 123  25.510  -3.270 -40.965
  946    H    ARG 124           H        ARG 124  28.896  -6.778 -38.881
  947    HA   ARG 124           HA       ARG 124  26.305  -6.481 -37.541
  948    HB2  ARG 124           2HB      ARG 124  26.664  -8.251 -39.193
  949    HB3  ARG 124           3HB      ARG 124  28.073  -8.848 -38.319
  950    HG2  ARG 124           2HG      ARG 124  26.631  -9.530 -36.423
  951    HG3  ARG 124           3HG      ARG 124  25.205  -8.998 -37.343
  952    HD2  ARG 124           2HD      ARG 124  25.666 -10.636 -39.088
  953    HD3  ARG 124           3HD      ARG 124  27.231 -11.040 -38.372
  954    HE   ARG 124           HE       ARG 124  24.574 -11.991 -37.549
  955   HH11  ARG 124          1HH1      ARG 124  28.001 -11.638 -36.452
  956   HH12  ARG 124          2HH1      ARG 124  27.817 -12.906 -35.295
  957   HH21  ARG 124          1HH2      ARG 124  24.418 -13.530 -36.101
  958   HH22  ARG 124          2HH2      ARG 124  25.739 -14.040 -35.058
  959    H    LYS 125           H        LYS 125  29.691  -7.134 -36.606
  960    HA   LYS 125           HA       LYS 125  29.356  -8.139 -34.031
  961    HB2  LYS 125           2HB      LYS 125  31.328  -6.050 -35.051
  962    HB3  LYS 125           3HB      LYS 125  31.429  -6.768 -33.447
  963    HG2  LYS 125           2HG      LYS 125  31.711  -9.023 -34.425
  964    HG3  LYS 125           3HG      LYS 125  31.602  -8.330 -36.052
  965    HD2  LYS 125           2HD      LYS 125  33.608  -6.911 -35.575
  966    HD3  LYS 125           3HD      LYS 125  33.690  -7.585 -33.953
  967    HE2  LYS 125           2HE      LYS 125  35.344  -8.671 -35.340
  968    HE3  LYS 125           3HE      LYS 125  34.099  -9.840 -34.872
  969    HZ1  LYS 125           3HZ      LYS 125  33.105  -9.632 -37.027
  970    HZ2  LYS 125           1HZ      LYS 125  34.248  -8.497 -37.511
  971    HZ3  LYS 125           2HZ      LYS 125  34.657 -10.059 -37.185
  972    H    ASP 126           H        ASP 126  28.785  -7.348 -32.017
  973    HA   ASP 126           HA       ASP 126  27.388  -4.887 -31.665
  974    HB2  ASP 126           2HB      ASP 126  27.132  -6.734 -30.100
  975    HB3  ASP 126           3HB      ASP 126  28.838  -6.651 -29.655
  976    H    LEU 127           H        LEU 127  30.786  -5.799 -31.054
  977    HA   LEU 127           HA       LEU 127  31.612  -3.021 -30.727
  978    HB2  LEU 127           2HB      LEU 127  32.662  -5.092 -29.621
  979    HB3  LEU 127           3HB      LEU 127  33.408  -5.439 -31.169
  980    HG   LEU 127           HG       LEU 127  34.961  -4.346 -29.669
  981   HD11  LEU 127          1HD1      LEU 127  34.181  -2.343 -31.823
  982   HD12  LEU 127          2HD1      LEU 127  35.710  -2.375 -30.939
  983   HD13  LEU 127          3HD1      LEU 127  35.283  -3.723 -32.008
  984   HD21  LEU 127          3HD2      LEU 127  33.005  -2.026 -29.470
  985   HD22  LEU 127          1HD2      LEU 127  33.438  -3.181 -28.191
  986   HD23  LEU 127          2HD2      LEU 127  34.651  -2.053 -28.823
  987    H    ILE 128           H        ILE 128  30.361  -2.528 -32.682
  988    HA   ILE 128           HA       ILE 128  30.938  -3.467 -35.217
  989    HB   ILE 128           HB       ILE 128  28.928  -2.264 -34.667
  990   HG12  ILE 128          2HG1      ILE 128  30.462  -0.744 -36.808
  991   HG13  ILE 128          3HG1      ILE 128  29.785  -2.368 -36.999
  992   HG21  ILE 128          1HG2      ILE 128  30.634   0.257 -34.419
  993   HG22  ILE 128          2HG2      ILE 128  28.860   0.210 -34.380
  994   HG23  ILE 128          3HG2      ILE 128  29.768  -0.565 -33.101
  995   HD11  ILE 128          3HD1      ILE 128  27.508  -1.495 -36.611
  996   HD12  ILE 128          1HD1      ILE 128  28.160   0.151 -36.441
  997   HD13  ILE 128          2HD1      ILE 128  28.296  -0.692 -37.985
  998    H    LYS 129           H        LYS 129  32.354  -3.061 -36.795
  999    HA   LYS 129           HA       LYS 129  34.060  -0.682 -36.713
 1000    HB2  LYS 129           2HB      LYS 129  35.394  -2.252 -35.436
 1001    HB3  LYS 129           3HB      LYS 129  35.108  -3.536 -36.605
 1002    HG2  LYS 129           2HG      LYS 129  37.377  -2.698 -36.806
 1003    HG3  LYS 129           3HG      LYS 129  36.470  -2.390 -38.282
 1004    HD2  LYS 129           2HD      LYS 129  36.111  -0.006 -37.466
 1005    HD3  LYS 129           3HD      LYS 129  37.202  -0.360 -36.118
 1006    HE2  LYS 129           2HE      LYS 129  39.076  -0.507 -37.499
 1007    HE3  LYS 129           3HE      LYS 129  38.127  -1.021 -38.907
 1008    HZ1  LYS 129           3HZ      LYS 129  37.287   1.181 -39.164
 1009    HZ2  LYS 129           1HZ      LYS 129  38.142   1.732 -37.851
 1010    HZ3  LYS 129           2HZ      LYS 129  38.909   1.199 -39.215
 1011    H    LYS 130           H        LYS 130  34.588  -0.014 -38.790
 1012    HA   LYS 130           HA       LYS 130  34.587  -1.730 -41.076
 1013    HB2  LYS 130           2HB      LYS 130  32.997  -0.363 -42.355
 1014    HB3  LYS 130           3HB      LYS 130  32.218  -1.217 -41.019
 1015    HG2  LYS 130           2HG      LYS 130  32.286   0.920 -39.666
 1016    HG3  LYS 130           3HG      LYS 130  33.003   1.737 -41.060
 1017    HD2  LYS 130           2HD      LYS 130  30.643   2.229 -40.975
 1018    HD3  LYS 130           3HD      LYS 130  30.959   1.209 -42.391
 1019    HE2  LYS 130           2HE      LYS 130  30.189  -0.783 -41.119
 1020    HE3  LYS 130           3HE      LYS 130  29.916   0.215 -39.688
 1021    HZ1  LYS 130           3HZ      LYS 130  28.195   1.391 -40.922
 1022    HZ2  LYS 130           1HZ      LYS 130  28.479   0.459 -42.258
 1023    HZ3  LYS 130           2HZ      LYS 130  27.895  -0.236 -40.898
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1   6.482 -25.007  -0.681
    2    H2   MET   1           H2       MET   1   7.913 -25.400   0.033
    3    H3   MET   1           H3       MET   1   6.468 -25.216   0.932
    4    HA   MET   1           HA       MET   1   7.581 -27.491  -0.158
    5    HB2  MET   1           2HB      MET   1   4.960 -26.915   1.261
    6    HB3  MET   1           3HB      MET   1   5.530 -28.544   0.840
    7    HG2  MET   1           2HG      MET   1   7.562 -28.164   2.217
    8    HG3  MET   1           3HG      MET   1   6.926 -26.573   2.682
    9    HE1  MET   1           3HE      MET   1   7.930 -28.775   4.774
   10    HE2  MET   1           1HE      MET   1   7.299 -27.178   5.243
   11    HE3  MET   1           2HE      MET   1   6.664 -28.649   6.017
   12    H    ALA   2           H        ALA   2   7.602 -27.786  -2.276
   13    HA   ALA   2           HA       ALA   2   6.984 -28.074  -4.401
   14    HB1  ALA   2           1HB      ALA   2   4.491 -29.302  -3.149
   15    HB2  ALA   2           2HB      ALA   2   5.111 -29.629  -4.781
   16    HB3  ALA   2           3HB      ALA   2   6.058 -30.120  -3.359
   17    H    ALA   3           H        ALA   3   6.479 -25.465  -3.566
   18    HA   ALA   3           HA       ALA   3   3.915 -24.488  -4.386
   19    HB1  ALA   3           1HB      ALA   3   6.619 -23.085  -4.221
   20    HB2  ALA   3           2HB      ALA   3   5.036 -22.284  -4.345
   21    HB3  ALA   3           3HB      ALA   3   5.436 -23.231  -2.896
   22    H    LYS   4           H        LYS   4   3.376 -23.267  -6.251
   23    HA   LYS   4           HA       LYS   4   4.316 -24.348  -8.764
   24    HB2  LYS   4           2HB      LYS   4   2.561 -21.946  -8.131
   25    HB3  LYS   4           3HB      LYS   4   2.815 -22.622  -9.755
   26    HG2  LYS   4           2HG      LYS   4   1.873 -24.790  -8.976
   27    HG3  LYS   4           3HG      LYS   4   1.557 -24.065  -7.386
   28    HD2  LYS   4           2HD      LYS   4   0.319 -23.179 -10.029
   29    HD3  LYS   4           3HD      LYS   4  -0.487 -24.151  -8.777
   30    HE2  LYS   4           2HE      LYS   4  -0.085 -22.248  -7.161
   31    HE3  LYS   4           3HE      LYS   4   0.497 -21.284  -8.540
   32    HZ1  LYS   4           3HZ      LYS   4  -1.691 -21.530  -9.556
   33    HZ2  LYS   4           1HZ      LYS   4  -2.221 -22.422  -8.277
   34    HZ3  LYS   4           2HZ      LYS   4  -1.830 -20.843  -8.062
   35    H    PHE   5           H        PHE   5   5.676 -21.937  -6.809
   36    HA   PHE   5           HA       PHE   5   7.325 -20.884  -9.046
   37    HB2  PHE   5           2HB      PHE   5   5.879 -19.211  -6.949
   38    HB3  PHE   5           3HB      PHE   5   7.079 -18.587  -8.088
   39    HD1  PHE   5           HD2      PHE   5   6.545 -18.317 -10.480
   40    HD2  PHE   5           HD1      PHE   5   3.618 -19.694  -7.629
   41    HE1  PHE   5           HE2      PHE   5   4.727 -17.907 -12.132
   42    HE2  PHE   5           HE1      PHE   5   1.810 -19.310  -9.302
   43    HZ   PHE   5           HZ       PHE   5   2.374 -18.447 -11.566
   44    H    GLU   6           H        GLU   6   9.388 -20.252  -8.319
   45    HA   GLU   6           HA       GLU   6  10.145 -20.592  -5.479
   46    HB2  GLU   6           2HB      GLU   6  11.372 -22.067  -7.833
   47    HB3  GLU   6           3HB      GLU   6  12.151 -21.898  -6.245
   48    HG2  GLU   6           2HG      GLU   6  10.189 -23.045  -5.204
   49    HG3  GLU   6           3HG      GLU   6   9.518 -23.327  -6.824
   50    H    VAL   7           H        VAL   7  12.055 -19.369  -5.017
   51    HA   VAL   7           HA       VAL   7  12.370 -16.940  -6.419
   52    HB   VAL   7           HB       VAL   7  14.251 -16.518  -4.942
   53   HG11  VAL   7          1HG1      VAL   7  12.098 -18.160  -3.522
   54   HG12  VAL   7          2HG1      VAL   7  13.182 -16.993  -2.747
   55   HG13  VAL   7          3HG1      VAL   7  11.989 -16.450  -3.949
   56   HG21  VAL   7          3HG2      VAL   7  14.224 -19.447  -4.167
   57   HG22  VAL   7          1HG2      VAL   7  15.493 -18.606  -5.087
   58   HG23  VAL   7          2HG2      VAL   7  15.178 -18.154  -3.401
   59    H    GLY   8           H        GLY   8  13.501 -16.124  -7.915
   60    HA2  GLY   8           2HA      GLY   8  15.192 -15.930  -9.488
   61    HA3  GLY   8           3HA      GLY   8  15.748 -17.575  -9.116
   62    H    SER   9           H        SER   9  12.636 -18.345  -9.524
   63    HA   SER   9           HA       SER   9  12.749 -18.984 -12.313
   64    HB2  SER   9           2HB      SER   9  10.236 -18.653 -10.650
   65    HB3  SER   9           3HB      SER   9  10.487 -19.686 -12.075
   66    HG   SER   9           HG       SER   9  10.579 -20.871 -10.089
   67    H    VAL  10           H        VAL  10  11.122 -18.184 -13.946
   68    HA   VAL  10           HA       VAL  10  10.389 -15.325 -13.661
   69    HB   VAL  10           HB       VAL  10  11.939 -16.411 -16.050
   70   HG11  VAL  10          1HG1      VAL  10  11.083 -13.574 -15.289
   71   HG12  VAL  10          2HG1      VAL  10  12.047 -14.017 -16.716
   72   HG13  VAL  10          3HG1      VAL  10  10.364 -14.562 -16.580
   73   HG21  VAL  10          3HG2      VAL  10  12.952 -14.541 -13.882
   74   HG22  VAL  10          1HG2      VAL  10  13.493 -16.212 -14.163
   75   HG23  VAL  10          2HG2      VAL  10  13.804 -14.966 -15.383
   76    H    TYR  11           H        TYR  11   8.433 -15.004 -14.424
   77    HA   TYR  11           HA       TYR  11   7.162 -16.870 -16.372
   78    HB2  TYR  11           2HB      TYR  11   6.250 -16.208 -13.567
   79    HB3  TYR  11           3HB      TYR  11   5.123 -16.783 -14.804
   80    HD1  TYR  11           HD1      TYR  11   5.339 -19.071 -15.764
   81    HD2  TYR  11           HD2      TYR  11   7.806 -17.748 -12.486
   82    HE1  TYR  11           HE1      TYR  11   5.877 -21.434 -15.228
   83    HE2  TYR  11           HE2      TYR  11   8.300 -20.120 -11.900
   84    HH   TYR  11           HH       TYR  11   6.986 -22.860 -13.831
   85    H    THR  12           H        THR  12   4.749 -15.867 -16.612
   86    HA   THR  12           HA       THR  12   5.017 -12.917 -17.004
   87    HB   THR  12           HB       THR  12   3.567 -14.872 -18.813
   88    HG1  THR  12           1HG      THR  12   5.368 -14.561 -20.209
   89   HG21  THR  12          1HG2      THR  12   4.474 -11.991 -19.251
   90   HG22  THR  12          2HG2      THR  12   3.652 -13.015 -20.451
   91   HG23  THR  12          3HG2      THR  12   2.804 -12.519 -18.975
   92    H    GLY  13           H        GLY  13   3.129 -11.709 -16.708
   93    HA2  GLY  13           2HA      GLY  13   0.774 -12.934 -15.476
   94    HA3  GLY  13           3HA      GLY  13   1.838 -12.055 -14.359
   95    H    LYS  14           H        LYS  14  -0.420 -10.904 -14.329
   96    HA   LYS  14           HA       LYS  14  -0.474  -8.708 -16.380
   97    HB2  LYS  14           2HB      LYS  14  -2.144 -10.683 -16.589
   98    HB3  LYS  14           3HB      LYS  14  -2.923  -9.982 -15.162
   99    HG2  LYS  14           2HG      LYS  14  -2.423  -8.517 -17.771
  100    HG3  LYS  14           3HG      LYS  14  -3.928  -9.369 -17.385
  101    HD2  LYS  14           2HD      LYS  14  -2.809  -6.902 -16.032
  102    HD3  LYS  14           3HD      LYS  14  -4.227  -6.987 -17.080
  103    HE2  LYS  14           2HE      LYS  14  -3.990  -8.357 -14.370
  104    HE3  LYS  14           3HE      LYS  14  -4.754  -6.776 -14.629
  105    HZ1  LYS  14           3HZ      LYS  14  -6.361  -7.854 -16.064
  106    HZ2  LYS  14           1HZ      LYS  14  -5.650  -9.322 -15.830
  107    HZ3  LYS  14           2HZ      LYS  14  -6.383  -8.549 -14.572
  108    H    VAL  15           H        VAL  15  -0.264  -6.778 -15.444
  109    HA   VAL  15           HA       VAL  15  -0.048  -6.480 -12.603
  110    HB   VAL  15           HB       VAL  15  -0.536  -4.185 -14.517
  111   HG11  VAL  15          1HG1      VAL  15   1.222  -4.552 -12.045
  112   HG12  VAL  15          2HG1      VAL  15   1.050  -3.049 -12.972
  113   HG13  VAL  15          3HG1      VAL  15  -0.339  -3.707 -12.086
  114   HG21  VAL  15          3HG2      VAL  15   2.110  -5.615 -14.203
  115   HG22  VAL  15          1HG2      VAL  15   1.116  -5.550 -15.669
  116   HG23  VAL  15          2HG2      VAL  15   1.836  -4.069 -15.038
  117    H    THR  16           H        THR  16  -1.537  -6.295 -11.124
  118    HA   THR  16           HA       THR  16  -4.374  -5.861 -11.951
  119    HB   THR  16           HB       THR  16  -4.609  -6.982  -9.547
  120    HG1  THR  16           1HG      THR  16  -2.899  -8.489  -9.242
  121   HG21  THR  16          1HG2      THR  16  -3.747  -8.538 -12.026
  122   HG22  THR  16          2HG2      THR  16  -4.646  -9.196 -10.639
  123   HG23  THR  16          3HG2      THR  16  -5.398  -7.972 -11.675
  124    H    GLY  17           H        GLY  17  -1.848  -4.280 -10.112
  125    HA2  GLY  17           2HA      GLY  17  -3.537  -1.987  -9.901
  126    HA3  GLY  17           3HA      GLY  17  -3.408  -2.779  -8.318
  127    H    LEU  18           H        LEU  18  -2.454  -0.218  -8.729
  128    HA   LEU  18           HA       LEU  18   0.499  -0.585  -8.422
  129    HB2  LEU  18           2HB      LEU  18  -1.059   1.855  -9.260
  130    HB3  LEU  18           3HB      LEU  18   0.680   1.820  -8.953
  131    HG   LEU  18           HG       LEU  18  -0.815   0.556 -11.265
  132   HD11  LEU  18          1HD1      LEU  18   1.447   2.601 -11.121
  133   HD12  LEU  18          2HD1      LEU  18   0.710   1.985 -12.614
  134   HD13  LEU  18          3HD1      LEU  18  -0.255   2.960 -11.487
  135   HD21  LEU  18          3HD2      LEU  18   2.115   0.187 -10.625
  136   HD22  LEU  18          1HD2      LEU  18   0.857  -1.069 -10.579
  137   HD23  LEU  18          2HD2      LEU  18   1.293  -0.317 -12.119
  138    H    GLN  19           H        GLN  19   1.392   0.431  -6.634
  139    HA   GLN  19           HA       GLN  19  -0.440   1.302  -4.441
  140    HB2  GLN  19           2HB      GLN  19   1.789  -0.735  -4.213
  141    HB3  GLN  19           3HB      GLN  19   0.727  -0.164  -2.915
  142    HG2  GLN  19           2HG      GLN  19  -0.232  -1.785  -5.320
  143    HG3  GLN  19           3HG      GLN  19   0.211  -2.479  -3.753
  144   HE21  GLN  19          2HE2      GLN  19  -1.035  -1.609  -1.803
  145   HE22  GLN  19          1HE2      GLN  19  -2.734  -1.237  -2.065
  146    H    ALA  20           H        ALA  20   0.786   2.510  -2.779
  147    HA   ALA  20           HA       ALA  20   2.742   4.271  -3.769
  148    HB1  ALA  20           1HB      ALA  20   2.066   3.594  -0.872
  149    HB2  ALA  20           2HB      ALA  20   2.883   5.069  -1.440
  150    HB3  ALA  20           3HB      ALA  20   1.194   4.759  -1.901
  151    H    TYR  21           H        TYR  21   3.337   1.116  -3.147
  152    HA   TYR  21           HA       TYR  21   6.241   1.450  -2.581
  153    HB2  TYR  21           2HB      TYR  21   5.993  -0.516  -1.003
  154    HB3  TYR  21           3HB      TYR  21   5.332   1.033  -0.466
  155    HD1  TYR  21           HD2      TYR  21   4.223  -2.175  -2.166
  156    HD2  TYR  21           HD1      TYR  21   3.171   1.118   0.414
  157    HE1  TYR  21           HE2      TYR  21   1.981  -3.184  -1.799
  158    HE2  TYR  21           HE1      TYR  21   0.950   0.088   0.834
  159    HH   TYR  21           HH       TYR  21  -0.475  -1.668   0.331
  160    H    GLY  22           H        GLY  22   4.200   0.453  -4.968
  161    HA2  GLY  22           2HA      GLY  22   5.886  -1.134  -6.365
  162    HA3  GLY  22           3HA      GLY  22   5.201  -2.284  -5.205
  163    H    ALA  23           H        ALA  23   4.537  -3.288  -7.312
  164    HA   ALA  23           HA       ALA  23   1.760  -2.409  -8.020
  165    HB1  ALA  23           1HB      ALA  23   3.930  -3.329  -9.948
  166    HB2  ALA  23           2HB      ALA  23   2.228  -3.036 -10.358
  167    HB3  ALA  23           3HB      ALA  23   3.262  -1.685  -9.840
  168    H    PHE  24           H        PHE  24   0.320  -4.018  -7.983
  169    HA   PHE  24           HA       PHE  24   1.200  -6.715  -7.254
  170    HB2  PHE  24           2HB      PHE  24  -1.537  -5.444  -7.740
  171    HB3  PHE  24           3HB      PHE  24  -1.271  -7.165  -7.428
  172    HD1  PHE  24           HD2      PHE  24   0.466  -7.497  -5.283
  173    HD2  PHE  24           HD1      PHE  24  -2.362  -4.296  -5.905
  174    HE1  PHE  24           HE2      PHE  24   0.317  -7.147  -2.827
  175    HE2  PHE  24           HE1      PHE  24  -2.541  -3.984  -3.451
  176    HZ   PHE  24           HZ       PHE  24  -1.178  -5.382  -1.905
  177    H    VAL  25           H        VAL  25   1.191  -8.479  -8.610
  178    HA   VAL  25           HA       VAL  25   0.140  -8.204 -11.384
  179    HB   VAL  25           HB       VAL  25   2.848  -9.415 -10.698
  180   HG11  VAL  25          1HG1      VAL  25   1.492  -8.736 -13.344
  181   HG12  VAL  25          2HG1      VAL  25   3.117  -9.423 -13.164
  182   HG13  VAL  25          3HG1      VAL  25   1.702 -10.369 -12.673
  183   HG21  VAL  25          3HG2      VAL  25   2.323  -6.733 -12.012
  184   HG22  VAL  25          1HG2      VAL  25   3.035  -6.993 -10.403
  185   HG23  VAL  25          2HG2      VAL  25   3.901  -7.535 -11.848
  186    H    ALA  26           H        ALA  26  -1.416  -9.640 -11.475
  187    HA   ALA  26           HA       ALA  26  -1.500 -12.099  -9.945
  188    HB1  ALA  26           1HB      ALA  26  -2.987 -11.241 -12.456
  189    HB2  ALA  26           2HB      ALA  26  -3.381 -12.648 -11.437
  190    HB3  ALA  26           3HB      ALA  26  -3.536 -11.010 -10.778
  191    H    LEU  27           H        LEU  27  -1.027 -14.144 -10.564
  192    HA   LEU  27           HA       LEU  27   1.054 -14.376 -12.724
  193    HB2  LEU  27           2HB      LEU  27   0.847 -15.582  -9.962
  194    HB3  LEU  27           3HB      LEU  27   2.018 -16.124 -11.175
  195    HG   LEU  27           HG       LEU  27   1.936 -13.255 -10.156
  196   HD11  LEU  27          1HD1      LEU  27   3.627 -15.592  -9.162
  197   HD12  LEU  27          2HD1      LEU  27   3.800 -13.898  -8.658
  198   HD13  LEU  27          3HD1      LEU  27   2.326 -14.789  -8.252
  199   HD21  LEU  27          3HD2      LEU  27   4.113 -14.852 -11.556
  200   HD22  LEU  27          1HD2      LEU  27   3.106 -13.584 -12.293
  201   HD23  LEU  27          2HD2      LEU  27   4.239 -13.172 -10.989
  202    H    ASP  28           H        ASP  28  -1.641 -15.849 -10.994
  203    HA   ASP  28           HA       ASP  28  -2.257 -17.673 -13.207
  204    HB2  ASP  28           2HB      ASP  28  -0.604 -18.926 -11.801
  205    HB3  ASP  28           3HB      ASP  28  -1.693 -18.717 -10.417
  206    H    GLU  29           H        GLU  29  -4.419 -18.807 -12.572
  207    HA   GLU  29           HA       GLU  29  -6.277 -16.754 -11.903
  208    HB2  GLU  29           2HB      GLU  29  -7.970 -18.451 -12.149
  209    HB3  GLU  29           3HB      GLU  29  -6.753 -18.591 -13.433
  210    HG2  GLU  29           2HG      GLU  29  -5.716 -20.510 -12.239
  211    HG3  GLU  29           3HG      GLU  29  -6.925 -20.349 -10.954
  212    H    GLU  30           H        GLU  30  -4.591 -18.706  -9.686
  213    HA   GLU  30           HA       GLU  30  -6.201 -17.491  -7.479
  214    HB2  GLU  30           2HB      GLU  30  -5.187 -20.350  -7.679
  215    HB3  GLU  30           3HB      GLU  30  -5.824 -19.607  -6.197
  216    HG2  GLU  30           2HG      GLU  30  -7.988 -19.204  -7.366
  217    HG3  GLU  30           3HG      GLU  30  -7.373 -20.090  -8.773
  218    H    THR  31           H        THR  31  -3.469 -16.858  -8.863
  219    HA   THR  31           HA       THR  31  -1.971 -16.581  -6.292
  220    HB   THR  31           HB       THR  31  -0.648 -17.662  -8.796
  221    HG1  THR  31           1HG      THR  31  -0.701 -19.684  -7.723
  222   HG21  THR  31          1HG2      THR  31   0.186 -17.698  -5.859
  223   HG22  THR  31          2HG2      THR  31   1.114 -18.385  -7.211
  224   HG23  THR  31          3HG2      THR  31   0.856 -16.634  -7.117
  225    H    GLN  32           H        GLN  32  -0.763 -14.805  -6.131
  226    HA   GLN  32           HA       GLN  32  -0.375 -12.918  -8.366
  227    HB2  GLN  32           2HB      GLN  32  -2.712 -12.636  -7.674
  228    HB3  GLN  32           3HB      GLN  32  -2.197 -12.426  -5.989
  229    HG2  GLN  32           2HG      GLN  32  -1.014 -10.518  -7.934
  230    HG3  GLN  32           3HG      GLN  32  -2.762 -10.372  -7.725
  231   HE21  GLN  32          2HE2      GLN  32  -3.104  -8.610  -6.424
  232   HE22  GLN  32          1HE2      GLN  32  -2.266  -8.303  -4.925
  233    H    GLY  33           H        GLY  33   1.288 -11.488  -7.870
  234    HA2  GLY  33           2HA      GLY  33   2.418 -11.537  -5.110
  235    HA3  GLY  33           3HA      GLY  33   3.459 -11.820  -6.520
  236    H    LEU  34           H        LEU  34   4.417  -9.864  -5.292
  237    HA   LEU  34           HA       LEU  34   3.267  -7.270  -6.265
  238    HB2  LEU  34           2HB      LEU  34   2.553  -7.568  -4.021
  239    HB3  LEU  34           3HB      LEU  34   4.158  -8.120  -3.502
  240    HG   LEU  34           HG       LEU  34   5.074  -5.868  -3.805
  241   HD11  LEU  34          1HD1      LEU  34   2.232  -5.007  -4.522
  242   HD12  LEU  34          2HD1      LEU  34   3.615  -3.921  -4.253
  243   HD13  LEU  34          3HD1      LEU  34   3.623  -5.031  -5.624
  244   HD21  LEU  34          3HD2      LEU  34   2.499  -5.909  -2.171
  245   HD22  LEU  34          1HD2      LEU  34   4.100  -6.468  -1.632
  246   HD23  LEU  34          2HD2      LEU  34   3.830  -4.748  -1.966
  247    H    VAL  35           H        VAL  35   4.847  -6.552  -7.705
  248    HA   VAL  35           HA       VAL  35   7.693  -6.813  -6.932
  249    HB   VAL  35           HB       VAL  35   7.337  -6.944  -9.268
  250   HG11  VAL  35          1HG1      VAL  35   5.864  -4.278  -9.192
  251   HG12  VAL  35          2HG1      VAL  35   6.323  -5.167 -10.659
  252   HG13  VAL  35          3HG1      VAL  35   5.132  -5.860  -9.545
  253   HG21  VAL  35          3HG2      VAL  35   8.411  -4.208  -8.567
  254   HG22  VAL  35          1HG2      VAL  35   9.299  -5.730  -8.615
  255   HG23  VAL  35          2HG2      VAL  35   8.651  -5.038 -10.115
  256    H    HIS  36           H        HIS  36   8.519  -5.667  -5.349
  257    HA   HIS  36           HA       HIS  36   7.236  -3.216  -4.496
  258    HB2  HIS  36           2HB      HIS  36   9.689  -4.768  -3.670
  259    HB3  HIS  36           3HB      HIS  36   9.572  -3.059  -3.203
  260    HD1  HIS  36           HD1      HIS  36   6.906  -2.548  -2.109
  261    HD2  HIS  36           HD2      HIS  36   8.685  -6.376  -1.787
  262    HE1  HIS  36           HE1      HIS  36   5.759  -3.706  -0.224
  263    H    ILE  37           H        ILE  37   7.975  -1.165  -4.620
  264    HA   ILE  37           HA       ILE  37   8.620  -0.272  -7.237
  265    HB   ILE  37           HB       ILE  37   7.380   0.953  -5.396
  266   HG12  ILE  37          2HG1      ILE  37   9.524   2.579  -6.712
  267   HG13  ILE  37          3HG1      ILE  37   8.109   1.909  -7.552
  268   HG21  ILE  37          1HG2      ILE  37  10.210   1.616  -4.445
  269   HG22  ILE  37          2HG2      ILE  37   8.726   2.380  -3.859
  270   HG23  ILE  37          3HG2      ILE  37   9.007   0.663  -3.542
  271   HD11  ILE  37          3HD1      ILE  37   6.604   3.166  -6.032
  272   HD12  ILE  37          1HD1      ILE  37   8.014   3.851  -5.198
  273   HD13  ILE  37          2HD1      ILE  37   7.710   4.258  -6.890
  274    H    SER  38           H        SER  38  10.930  -0.890  -4.699
  275    HA   SER  38           HA       SER  38  13.187   0.313  -5.936
  276    HB2  SER  38           2HB      SER  38  13.216  -2.208  -4.260
  277    HB3  SER  38           3HB      SER  38  14.433  -0.914  -4.340
  278    HG   SER  38           HG       SER  38  13.109  -0.774  -2.447
  279    H    GLU  39           H        GLU  39  11.444  -2.465  -6.946
  280    HA   GLU  39           HA       GLU  39  13.718  -3.404  -8.651
  281    HB2  GLU  39           2HB      GLU  39  11.428  -4.951  -7.404
  282    HB3  GLU  39           3HB      GLU  39  12.636  -5.619  -8.516
  283    HG2  GLU  39           2HG      GLU  39  13.207  -4.444  -5.781
  284    HG3  GLU  39           3HG      GLU  39  13.100  -6.176  -6.124
  285    H    VAL  40           H        VAL  40  11.167  -1.485  -8.967
  286    HA   VAL  40           HA       VAL  40   9.845  -2.716 -11.276
  287    HB   VAL  40           HB       VAL  40   9.763   0.007  -9.955
  288   HG11  VAL  40          1HG1      VAL  40   7.964  -0.986 -12.209
  289   HG12  VAL  40          2HG1      VAL  40   7.740   0.515 -11.283
  290   HG13  VAL  40          3HG1      VAL  40   9.158   0.328 -12.328
  291   HG21  VAL  40          3HG2      VAL  40   7.779  -2.315 -10.088
  292   HG22  VAL  40          1HG2      VAL  40   8.756  -1.851  -8.682
  293   HG23  VAL  40          2HG2      VAL  40   7.493  -0.768  -9.270
  294    H    THR  41           H        THR  41  12.581  -0.513 -10.844
  295    HA   THR  41           HA       THR  41  13.533  -1.059 -13.550
  296    HB   THR  41           HB       THR  41  11.915   0.591 -14.179
  297    HG1  THR  41           1HG      THR  41  13.308   2.239 -14.927
  298   HG21  THR  41          1HG2      THR  41  13.068   2.442 -12.048
  299   HG22  THR  41          2HG2      THR  41  11.859   2.896 -13.270
  300   HG23  THR  41          3HG2      THR  41  11.452   1.710 -12.017
  301    H    HIS  42           H        HIS  42  15.641  -0.178 -13.901
  302    HA   HIS  42           HA       HIS  42  17.256   0.199 -11.500
  303    HB2  HIS  42           2HB      HIS  42  17.778   0.328 -14.483
  304    HB3  HIS  42           3HB      HIS  42  19.058   0.695 -13.312
  305    HD1  HIS  42           HD1      HIS  42  17.425  -2.213 -15.012
  306    HD2  HIS  42           HD2      HIS  42  19.869  -1.454 -11.645
  307    HE1  HIS  42           HE1      HIS  42  18.419  -4.397 -14.369
  308    H    GLY  43           H        GLY  43  15.459   2.267 -13.691
  309    HA2  GLY  43           2HA      GLY  43  16.927   4.709 -13.158
  310    HA3  GLY  43           3HA      GLY  43  15.330   4.560 -13.920
  311    H    PHE  44           H        PHE  44  15.680   6.655 -12.195
  312    HA   PHE  44           HA       PHE  44  14.632   6.090  -9.581
  313    HB2  PHE  44           2HB      PHE  44  14.050   8.466  -9.522
  314    HB3  PHE  44           3HB      PHE  44  15.700   8.251 -10.125
  315    HD1  PHE  44           HD2      PHE  44  12.262   9.299 -10.974
  316    HD2  PHE  44           HD1      PHE  44  16.307   8.853 -12.406
  317    HE1  PHE  44           HE2      PHE  44  11.724  10.724 -12.942
  318    HE2  PHE  44           HE1      PHE  44  15.765  10.273 -14.372
  319    HZ   PHE  44           HZ       PHE  44  13.472  11.208 -14.643
  320    H    VAL  45           H        VAL  45  12.570   6.048  -8.818
  321    HA   VAL  45           HA       VAL  45  10.127   6.477 -10.474
  322    HB   VAL  45           HB       VAL  45  10.704   4.234 -11.140
  323   HG11  VAL  45          1HG1      VAL  45  10.940   3.500  -8.188
  324   HG12  VAL  45          2HG1      VAL  45  10.957   2.352  -9.540
  325   HG13  VAL  45          3HG1      VAL  45  12.270   3.528  -9.363
  326   HG21  VAL  45          3HG2      VAL  45   8.475   4.214  -9.155
  327   HG22  VAL  45          1HG2      VAL  45   8.421   4.615 -10.885
  328   HG23  VAL  45          2HG2      VAL  45   8.806   2.959 -10.371
  329    H    LYS  46           H        LYS  46  10.438   8.303  -9.123
  330    HA   LYS  46           HA       LYS  46  10.334   8.106  -6.291
  331    HB2  LYS  46           2HB      LYS  46   9.733  10.460  -6.301
  332    HB3  LYS  46           3HB      LYS  46  11.047  10.131  -7.449
  333    HG2  LYS  46           2HG      LYS  46   9.471  10.242  -9.333
  334    HG3  LYS  46           3HG      LYS  46   8.111  10.479  -8.210
  335    HD2  LYS  46           2HD      LYS  46   9.112  12.613  -7.445
  336    HD3  LYS  46           3HD      LYS  46  10.476  12.376  -8.566
  337    HE2  LYS  46           2HE      LYS  46   8.905  12.380 -10.480
  338    HE3  LYS  46           3HE      LYS  46   7.541  12.609  -9.363
  339    HZ1  LYS  46           3HZ      LYS  46   8.501  14.720  -8.723
  340    HZ2  LYS  46           1HZ      LYS  46   9.768  14.508  -9.760
  341    HZ3  LYS  46           2HZ      LYS  46   8.237  14.679 -10.350
  342    H    ASP  47           H        ASP  47   7.730   7.758  -8.522
  343    HA   ASP  47           HA       ASP  47   6.068   6.793  -6.291
  344    HB2  ASP  47           2HB      ASP  47   5.143   9.020  -6.631
  345    HB3  ASP  47           3HB      ASP  47   5.178   8.794  -8.393
  346    H    ILE  48           H        ILE  48   4.761   5.014  -7.135
  347    HA   ILE  48           HA       ILE  48   6.049   3.437  -9.120
  348    HB   ILE  48           HB       ILE  48   4.596   2.595  -7.271
  349   HG12  ILE  48          2HG1      ILE  48   3.265   0.922  -8.657
  350   HG13  ILE  48          3HG1      ILE  48   4.014   1.688 -10.067
  351   HG21  ILE  48          1HG2      ILE  48   2.287   3.622  -8.977
  352   HG22  ILE  48          2HG2      ILE  48   2.141   2.585  -7.544
  353   HG23  ILE  48          3HG2      ILE  48   2.757   4.237  -7.377
  354   HD11  ILE  48          3HD1      ILE  48   6.258   1.275  -9.090
  355   HD12  ILE  48          1HD1      ILE  48   5.498   0.513  -7.682
  356   HD13  ILE  48          2HD1      ILE  48   5.345  -0.239  -9.285
  357    H    ASN  49           H        ASN  49   3.484   5.810  -9.661
  358    HA   ASN  49           HA       ASN  49   2.832   4.787 -12.262
  359    HB2  ASN  49           2HB      ASN  49   1.356   6.490 -12.410
  360    HB3  ASN  49           3HB      ASN  49   1.617   6.629 -10.661
  361   HD21  ASN  49          2HD2      ASN  49   3.434   8.172  -9.998
  362   HD22  ASN  49          1HD2      ASN  49   3.621   9.646 -10.971
  363    H    GLU  50           H        GLU  50   5.597   6.585 -11.240
  364    HA   GLU  50           HA       GLU  50   6.173   7.845 -13.776
  365    HB2  GLU  50           2HB      GLU  50   8.042   7.067 -11.517
  366    HB3  GLU  50           3HB      GLU  50   8.384   8.217 -12.820
  367    HG2  GLU  50           2HG      GLU  50   6.359   8.552 -10.567
  368    HG3  GLU  50           3HG      GLU  50   7.896   9.398 -10.788
  369    H    HIS  51           H        HIS  51   6.240   4.565 -12.917
  370    HA   HIS  51           HA       HIS  51   7.438   3.941 -15.555
  371    HB2  HIS  51           2HB      HIS  51   9.191   3.754 -13.652
  372    HB3  HIS  51           3HB      HIS  51   8.251   2.364 -13.080
  373    HD1  HIS  51           HD1      HIS  51   8.860   0.092 -14.243
  374    HD2  HIS  51           HD2      HIS  51  10.176   3.514 -16.354
  375    HE1  HIS  51           HE1      HIS  51  10.227  -0.743 -16.137
  376    H    LEU  52           H        LEU  52   7.158   1.369 -15.687
  377    HA   LEU  52           HA       LEU  52   5.699  -0.358 -16.106
  378    HB2  LEU  52           2HB      LEU  52   5.918  -0.141 -13.428
  379    HB3  LEU  52           3HB      LEU  52   4.179   0.151 -13.586
  380    HG   LEU  52           HG       LEU  52   4.040  -2.046 -14.881
  381   HD11  LEU  52          1HD1      LEU  52   6.845  -2.447 -13.759
  382   HD12  LEU  52          2HD1      LEU  52   5.856  -3.690 -14.554
  383   HD13  LEU  52          3HD1      LEU  52   6.435  -2.291 -15.479
  384   HD21  LEU  52          3HD2      LEU  52   5.036  -2.162 -12.011
  385   HD22  LEU  52          1HD2      LEU  52   3.359  -1.875 -12.536
  386   HD23  LEU  52          2HD2      LEU  52   4.126  -3.444 -12.848
  387    H    SER  53           H        SER  53   3.218  -0.901 -15.687
  388    HA   SER  53           HA       SER  53   1.393   1.257 -16.518
  389    HB2  SER  53           2HB      SER  53   1.551  -1.385 -18.002
  390    HB3  SER  53           3HB      SER  53   0.540   0.026 -18.387
  391    HG   SER  53           HG       SER  53   2.372  -0.107 -19.748
  392    H    VAL  54           H        VAL  54  -0.896   0.392 -16.115
  393    HA   VAL  54           HA       VAL  54  -1.101  -2.134 -14.464
  394    HB   VAL  54           HB       VAL  54  -1.271   0.117 -13.275
  395   HG11  VAL  54          1HG1      VAL  54  -3.940   0.235 -14.743
  396   HG12  VAL  54          2HG1      VAL  54  -3.465   1.268 -13.379
  397   HG13  VAL  54          3HG1      VAL  54  -2.599   1.386 -14.926
  398   HG21  VAL  54          3HG2      VAL  54  -3.551  -1.829 -13.079
  399   HG22  VAL  54          1HG2      VAL  54  -1.987  -1.883 -12.228
  400   HG23  VAL  54          2HG2      VAL  54  -3.144  -0.581 -11.883
  401    H    GLY  55           H        GLY  55  -2.944  -3.380 -14.674
  402    HA2  GLY  55           2HA      GLY  55  -4.416  -4.544 -15.991
  403    HA3  GLY  55           3HA      GLY  55  -4.867  -2.993 -16.733
  404    H    ASP  56           H        ASP  56  -1.649  -4.537 -16.734
  405    HA   ASP  56           HA       ASP  56  -1.794  -5.013 -19.683
  406    HB2  ASP  56           2HB      ASP  56  -0.801  -2.756 -19.233
  407    HB3  ASP  56           3HB      ASP  56   0.403  -3.552 -18.200
  408    H    GLU  57           H        GLU  57   0.056  -6.411 -20.383
  409    HA   GLU  57           HA       GLU  57   0.574  -8.530 -18.363
  410    HB2  GLU  57           2HB      GLU  57  -0.449  -9.048 -20.554
  411    HB3  GLU  57           3HB      GLU  57   0.998  -8.403 -21.361
  412    HG2  GLU  57           2HG      GLU  57   2.380 -10.147 -20.301
  413    HG3  GLU  57           3HG      GLU  57   0.957 -10.781 -19.451
  414    H    VAL  58           H        VAL  58   2.585  -9.058 -17.690
  415    HA   VAL  58           HA       VAL  58   5.029  -7.724 -18.757
  416    HB   VAL  58           HB       VAL  58   5.694  -7.186 -16.393
  417   HG11  VAL  58          1HG1      VAL  58   3.207  -5.702 -17.363
  418   HG12  VAL  58          2HG1      VAL  58   4.379  -5.094 -16.174
  419   HG13  VAL  58          3HG1      VAL  58   4.880  -5.366 -17.859
  420   HG21  VAL  58          3HG2      VAL  58   2.790  -7.661 -15.694
  421   HG22  VAL  58          1HG2      VAL  58   4.193  -8.593 -15.133
  422   HG23  VAL  58          2HG2      VAL  58   4.012  -6.898 -14.652
  423    H    GLN  59           H        GLN  59   6.875  -8.941 -18.521
  424    HA   GLN  59           HA       GLN  59   6.554 -11.624 -17.339
  425    HB2  GLN  59           2HB      GLN  59   8.951 -10.332 -18.693
  426    HB3  GLN  59           3HB      GLN  59   8.831 -12.023 -18.158
  427    HG2  GLN  59           2HG      GLN  59   6.635 -11.977 -19.683
  428    HG3  GLN  59           3HG      GLN  59   7.487 -10.643 -20.475
  429   HE21  GLN  59          2HE2      GLN  59   7.090 -14.019 -20.328
  430   HE22  GLN  59          1HE2      GLN  59   8.492 -14.469 -21.293
  431    H    VAL  60           H        VAL  60   7.526 -12.224 -15.431
  432    HA   VAL  60           HA       VAL  60   8.715 -10.083 -13.695
  433    HB   VAL  60           HB       VAL  60   7.181 -11.239 -11.911
  434   HG11  VAL  60          1HG1      VAL  60   6.022  -9.324 -13.971
  435   HG12  VAL  60          2HG1      VAL  60   5.393  -9.582 -12.330
  436   HG13  VAL  60          3HG1      VAL  60   7.003  -8.877 -12.552
  437   HG21  VAL  60          3HG2      VAL  60   5.501 -11.821 -14.361
  438   HG22  VAL  60          1HG2      VAL  60   6.224 -13.016 -13.257
  439   HG23  VAL  60          2HG2      VAL  60   4.971 -11.904 -12.675
  440    H    LYS  61           H        LYS  61  10.433 -10.736 -12.594
  441    HA   LYS  61           HA       LYS  61  11.091 -13.622 -12.485
  442    HB2  LYS  61           2HB      LYS  61  12.854 -12.020 -13.001
  443    HB3  LYS  61           3HB      LYS  61  12.510 -11.124 -11.510
  444    HG2  LYS  61           2HG      LYS  61  13.219 -13.029 -10.147
  445    HG3  LYS  61           3HG      LYS  61  13.445 -14.022 -11.604
  446    HD2  LYS  61           2HD      LYS  61  15.231 -12.485 -12.373
  447    HD3  LYS  61           3HD      LYS  61  15.005 -11.497 -10.908
  448    HE2  LYS  61           2HE      LYS  61  15.587 -13.459  -9.508
  449    HE3  LYS  61           3HE      LYS  61  15.831 -14.430 -10.979
  450    HZ1  LYS  61           3HZ      LYS  61  17.616 -12.940 -11.592
  451    HZ2  LYS  61           1HZ      LYS  61  17.392 -12.039 -10.230
  452    HZ3  LYS  61           2HZ      LYS  61  17.909 -13.596 -10.110
  453    H    VAL  62           H        VAL  62  10.724 -14.873 -10.701
  454    HA   VAL  62           HA       VAL  62   9.319 -13.865  -8.383
  455    HB   VAL  62           HB       VAL  62  10.859 -16.473  -8.722
  456   HG11  VAL  62          1HG1      VAL  62   8.605 -15.649  -6.829
  457   HG12  VAL  62          2HG1      VAL  62   9.330 -17.267  -6.927
  458   HG13  VAL  62          3HG1      VAL  62  10.300 -15.891  -6.368
  459   HG21  VAL  62          3HG2      VAL  62   7.915 -15.889  -9.253
  460   HG22  VAL  62          1HG2      VAL  62   9.143 -16.261 -10.484
  461   HG23  VAL  62          2HG2      VAL  62   8.691 -17.490  -9.291
  462    H    LEU  63           H        LEU  63  10.184 -12.524  -6.994
  463    HA   LEU  63           HA       LEU  63  13.108 -12.373  -6.578
  464    HB2  LEU  63           2HB      LEU  63  11.735 -10.376  -6.944
  465    HB3  LEU  63           3HB      LEU  63  10.776 -10.757  -5.502
  466    HG   LEU  63           HG       LEU  63  12.867 -10.526  -4.118
  467   HD11  LEU  63          1HD1      LEU  63  14.020  -9.352  -6.692
  468   HD12  LEU  63          2HD1      LEU  63  14.792  -9.305  -5.089
  469   HD13  LEU  63          3HD1      LEU  63  14.557 -10.860  -5.907
  470   HD21  LEU  63          3HD2      LEU  63  12.002  -8.113  -5.762
  471   HD22  LEU  63          1HD2      LEU  63  11.209  -8.725  -4.295
  472   HD23  LEU  63          2HD2      LEU  63  12.848  -8.044  -4.198
  473    H    ALA  64           H        ALA  64  10.135 -13.187  -4.768
  474    HA   ALA  64           HA       ALA  64  11.638 -14.838  -2.859
  475    HB1  ALA  64           1HB      ALA  64  10.076 -12.415  -1.912
  476    HB2  ALA  64           2HB      ALA  64  10.740 -13.688  -0.876
  477    HB3  ALA  64           3HB      ALA  64  11.835 -12.631  -1.792
  478    H    VAL  65           H        VAL  65  10.161 -16.140  -1.568
  479    HA   VAL  65           HA       VAL  65   7.220 -15.895  -2.054
  480    HB   VAL  65           HB       VAL  65   8.059 -17.597  -3.622
  481   HG11  VAL  65          1HG1      VAL  65   9.115 -19.060  -1.157
  482   HG12  VAL  65          2HG1      VAL  65   9.031 -19.729  -2.803
  483   HG13  VAL  65          3HG1      VAL  65  10.105 -18.361  -2.455
  484   HG21  VAL  65          3HG2      VAL  65   6.502 -18.774  -1.322
  485   HG22  VAL  65          1HG2      VAL  65   5.860 -17.914  -2.736
  486   HG23  VAL  65          2HG2      VAL  65   6.663 -19.483  -2.944
  487    H    ASP  66           H        ASP  66   5.963 -16.567  -0.405
  488    HA   ASP  66           HA       ASP  66   7.272 -16.739   2.269
  489    HB2  ASP  66           2HB      ASP  66   6.950 -14.407   1.823
  490    HB3  ASP  66           3HB      ASP  66   5.243 -14.632   1.390
  491    H    GLU  67           H        GLU  67   6.633 -18.881   2.100
  492    HA   GLU  67           HA       GLU  67   4.068 -19.916   1.473
  493    HB2  GLU  67           2HB      GLU  67   6.284 -21.091   1.629
  494    HB3  GLU  67           3HB      GLU  67   6.143 -21.000   3.395
  495    HG2  GLU  67           2HG      GLU  67   5.474 -23.184   2.811
  496    HG3  GLU  67           3HG      GLU  67   3.968 -22.328   3.174
  497    H    GLU  68           H        GLU  68   5.268 -18.533   4.517
  498    HA   GLU  68           HA       GLU  68   3.157 -19.507   6.197
  499    HB2  GLU  68           2HB      GLU  68   4.920 -17.044   6.443
  500    HB3  GLU  68           3HB      GLU  68   3.878 -17.696   7.726
  501    HG2  GLU  68           2HG      GLU  68   5.149 -19.836   7.628
  502    HG3  GLU  68           3HG      GLU  68   6.260 -19.116   6.446
  503    H    LYS  69           H        LYS  69   3.082 -17.065   3.763
  504    HA   LYS  69           HA       LYS  69   0.266 -16.415   4.596
  505    HB2  LYS  69           2HB      LYS  69   2.126 -14.600   4.821
  506    HB3  LYS  69           3HB      LYS  69   2.070 -14.549   3.046
  507    HG2  LYS  69           2HG      LYS  69  -0.301 -13.922   3.104
  508    HG3  LYS  69           3HG      LYS  69  -0.338 -14.107   4.870
  509    HD2  LYS  69           2HD      LYS  69   1.298 -12.263   5.105
  510    HD3  LYS  69           3HD      LYS  69   1.360 -12.086   3.335
  511    HE2  LYS  69           2HE      LYS  69  -1.051 -11.552   3.296
  512    HE3  LYS  69           3HE      LYS  69  -1.134 -11.758   5.059
  513    HZ1  LYS  69           3HZ      LYS  69   0.384  -9.908   5.284
  514    HZ2  LYS  69           1HZ      LYS  69   0.464  -9.713   3.650
  515    HZ3  LYS  69           2HZ      LYS  69  -0.955  -9.445   4.444
  516    H    GLY  70           H        GLY  70   2.172 -17.954   2.274
  517    HA2  GLY  70           2HA      GLY  70   1.697 -18.805   0.194
  518    HA3  GLY  70           3HA      GLY  70  -0.004 -18.356   0.447
  519    H    LYS  71           H        LYS  71   2.888 -16.230   0.418
  520    HA   LYS  71           HA       LYS  71   1.729 -14.748  -1.924
  521    HB2  LYS  71           2HB      LYS  71   2.993 -13.702   0.630
  522    HB3  LYS  71           3HB      LYS  71   2.697 -12.703  -0.802
  523    HG2  LYS  71           2HG      LYS  71   0.619 -14.105   0.902
  524    HG3  LYS  71           3HG      LYS  71   0.956 -12.366   0.869
  525    HD2  LYS  71           2HD      LYS  71  -0.200 -14.015  -1.415
  526    HD3  LYS  71           3HD      LYS  71  -1.115 -12.931  -0.355
  527    HE2  LYS  71           2HE      LYS  71  -0.043 -10.984  -1.239
  528    HE3  LYS  71           3HE      LYS  71   1.210 -11.948  -2.046
  529    HZ1  LYS  71           3HZ      LYS  71  -0.472 -12.814  -3.520
  530    HZ2  LYS  71           1HZ      LYS  71  -1.648 -11.923  -2.770
  531    HZ3  LYS  71           2HZ      LYS  71  -0.440 -11.176  -3.610
  532    H    ILE  72           H        ILE  72   3.316 -13.299  -2.949
  533    HA   ILE  72           HA       ILE  72   6.039 -14.475  -3.217
  534    HB   ILE  72           HB       ILE  72   3.874 -14.235  -5.358
  535   HG12  ILE  72          2HG1      ILE  72   5.615 -16.577  -4.564
  536   HG13  ILE  72          3HG1      ILE  72   3.953 -16.312  -4.005
  537   HG21  ILE  72          1HG2      ILE  72   6.853 -14.769  -5.763
  538   HG22  ILE  72          2HG2      ILE  72   5.611 -14.855  -7.028
  539   HG23  ILE  72          3HG2      ILE  72   5.987 -13.308  -6.273
  540   HD11  ILE  72          3HD1      ILE  72   3.125 -16.490  -6.327
  541   HD12  ILE  72          1HD1      ILE  72   4.783 -16.778  -6.897
  542   HD13  ILE  72          2HD1      ILE  72   4.001 -17.957  -5.835
  543    H    SER  73           H        SER  73   7.533 -12.960  -3.659
  544    HA   SER  73           HA       SER  73   6.612 -10.194  -4.319
  545    HB2  SER  73           2HB      SER  73   9.323 -11.025  -3.258
  546    HB3  SER  73           3HB      SER  73   8.668  -9.383  -3.405
  547    HG   SER  73           HG       SER  73   8.516 -10.207  -1.243
  548    H    LEU  74           H        LEU  74   7.762  -9.133  -6.042
  549    HA   LEU  74           HA       LEU  74   8.943 -11.014  -8.055
  550    HB2  LEU  74           2HB      LEU  74   6.751  -8.976  -8.407
  551    HB3  LEU  74           3HB      LEU  74   7.481  -9.888  -9.741
  552    HG   LEU  74           HG       LEU  74   5.913 -11.142  -7.436
  553   HD11  LEU  74          1HD1      LEU  74   5.059 -10.595 -10.309
  554   HD12  LEU  74          2HD1      LEU  74   4.114 -11.490  -9.102
  555   HD13  LEU  74          3HD1      LEU  74   4.447  -9.761  -8.865
  556   HD21  LEU  74          3HD2      LEU  74   6.927 -12.364 -10.017
  557   HD22  LEU  74          1HD2      LEU  74   7.549 -12.670  -8.383
  558   HD23  LEU  74          2HD2      LEU  74   5.907 -13.164  -8.809
  559    H    SER  75           H        SER  75  10.003  -9.845  -9.856
  560    HA   SER  75           HA       SER  75  10.635  -6.983  -9.393
  561    HB2  SER  75           2HB      SER  75  13.031  -7.573 -10.045
  562    HB3  SER  75           3HB      SER  75  12.514  -7.911  -8.380
  563    HG   SER  75           HG       SER  75  13.688  -9.656  -9.304
  564    H    ILE  76           H        ILE  76  11.217  -5.836 -11.178
  565    HA   ILE  76           HA       ILE  76  10.520  -7.011 -13.870
  566    HB   ILE  76           HB       ILE  76   9.704  -4.401 -12.546
  567   HG12  ILE  76          2HG1      ILE  76   8.251  -6.278 -12.084
  568   HG13  ILE  76          3HG1      ILE  76   7.471  -4.951 -12.961
  569   HG21  ILE  76          1HG2      ILE  76   9.414  -5.144 -15.492
  570   HG22  ILE  76          2HG2      ILE  76   8.696  -3.714 -14.708
  571   HG23  ILE  76          3HG2      ILE  76  10.455  -3.868 -14.840
  572   HD11  ILE  76          3HD1      ILE  76   7.615  -6.254 -15.070
  573   HD12  ILE  76          1HD1      ILE  76   8.408  -7.577 -14.187
  574   HD13  ILE  76          2HD1      ILE  76   6.725  -7.132 -13.829
  575    H    ARG  77           H        ARG  77  12.570  -4.628 -12.086
  576    HA   ARG  77           HA       ARG  77  14.133  -3.931 -14.338
  577    HB2  ARG  77           2HB      ARG  77  15.911  -3.447 -12.794
  578    HB3  ARG  77           3HB      ARG  77  14.358  -2.875 -12.157
  579    HG2  ARG  77           2HG      ARG  77  14.282  -4.654 -10.520
  580    HG3  ARG  77           3HG      ARG  77  15.662  -5.481 -11.258
  581    HD2  ARG  77           2HD      ARG  77  16.015  -2.627 -10.326
  582    HD3  ARG  77           3HD      ARG  77  16.000  -3.918  -9.116
  583    HE   ARG  77           HE       ARG  77  18.012  -3.408 -11.181
  584   HH11  ARG  77          1HH2      ARG  77  16.848  -5.690  -8.678
  585   HH12  ARG  77          2HH2      ARG  77  18.354  -6.565  -8.654
  586   HH21  ARG  77          1HH1      ARG  77  19.896  -4.591 -11.155
  587   HH22  ARG  77          2HH1      ARG  77  20.107  -5.943 -10.069
  588    H    ALA  78           H        ALA  78  13.996  -6.986 -12.728
  589    HA   ALA  78           HA       ALA  78  16.355  -8.123 -13.940
  590    HB1  ALA  78           1HB      ALA  78  13.849  -9.430 -12.793
  591    HB2  ALA  78           2HB      ALA  78  15.391 -10.245 -13.137
  592    HB3  ALA  78           3HB      ALA  78  15.310  -8.997 -11.870
  593    H    THR  79           H        THR  79  13.157  -7.478 -15.246
  594    HA   THR  79           HA       THR  79  13.537  -9.568 -17.359
  595    HB   THR  79           HB       THR  79  11.072  -9.611 -17.469
  596    HG1  THR  79           1HG      THR  79   9.922  -8.565 -15.773
  597   HG21  THR  79          1HG2      THR  79  12.109 -10.040 -14.628
  598   HG22  THR  79          2HG2      THR  79  10.616 -10.719 -15.306
  599   HG23  THR  79          3HG2      THR  79  12.187 -11.226 -15.952
  600    H    GLN  80           H        GLN  80  12.992  -6.139 -16.815
  601    HA   GLN  80           HA       GLN  80  12.256  -5.366 -19.430
  602    HB2  GLN  80           2HB      GLN  80  14.010  -4.048 -17.336
  603    HB3  GLN  80           3HB      GLN  80  13.603  -3.268 -18.876
  604    HG2  GLN  80           2HG      GLN  80  11.593  -4.179 -16.780
  605    HG3  GLN  80           3HG      GLN  80  12.148  -2.515 -17.024
  606   HE21  GLN  80          2HE2      GLN  80   9.391  -3.696 -17.198
  607   HE22  GLN  80          1HE2      GLN  80   8.827  -3.287 -18.810
  608    H    ALA  81           H        ALA  81  13.342  -4.757 -21.170
  609    HA   ALA  81           HA       ALA  81  16.177  -5.605 -21.567
  610    HB1  ALA  81           1HB      ALA  81  13.808  -6.127 -23.416
  611    HB2  ALA  81           2HB      ALA  81  15.507  -6.533 -23.757
  612    HB3  ALA  81           3HB      ALA  81  14.648  -7.348 -22.429
  613    H    ALA  82           H        ALA  82  14.654  -3.015 -21.139
  614    HA   ALA  82           HA       ALA  82  16.132  -1.354 -23.103
  615    HB1  ALA  82           1HB      ALA  82  13.130  -1.168 -22.597
  616    HB2  ALA  82           2HB      ALA  82  14.098   0.021 -23.493
  617    HB3  ALA  82           3HB      ALA  82  13.904  -1.625 -24.133
  618    HA   PRO  83           HA       PRO  83  17.059   0.987 -19.539
  619    HB2  PRO  83           2HB      PRO  83  16.009   3.469 -20.893
  620    HB3  PRO  83           3HB      PRO  83  17.555   3.214 -20.039
  621    HG2  PRO  83           2HG      PRO  83  17.501   3.152 -22.761
  622    HG3  PRO  83           3HG      PRO  83  18.497   1.980 -21.853
  623    HD2  PRO  83           2HD      PRO  83  15.759   1.551 -23.117
  624    HD3  PRO  83           3HD      PRO  83  17.153   0.441 -23.058
  625    H    GLU  84           H        GLU  84  13.876   1.700 -20.911
  626    HA   GLU  84           HA       GLU  84  12.605   1.526 -18.252
  627    HB2  GLU  84           2HB      GLU  84  12.243   3.828 -20.200
  628    HB3  GLU  84           3HB      GLU  84  11.120   3.457 -18.877
  629    HG2  GLU  84           2HG      GLU  84  12.949   3.806 -17.238
  630    HG3  GLU  84           3HG      GLU  84  14.049   4.248 -18.561
  631    H    LYS  85           H        LYS  85  10.265   1.105 -18.571
  632    HA   LYS  85           HA       LYS  85   9.509  -0.497 -20.861
  633    HB2  LYS  85           2HB      LYS  85   8.727  -0.552 -18.391
  634    HB3  LYS  85           3HB      LYS  85   7.640   0.769 -18.845
  635    HG2  LYS  85           2HG      LYS  85   7.687  -1.964 -20.177
  636    HG3  LYS  85           3HG      LYS  85   6.624  -1.538 -18.819
  637    HD2  LYS  85           2HD      LYS  85   5.614   0.268 -20.243
  638    HD3  LYS  85           3HD      LYS  85   6.601  -0.312 -21.600
  639    HE2  LYS  85           2HE      LYS  85   4.428  -1.251 -21.892
  640    HE3  LYS  85           3HE      LYS  85   5.499  -2.563 -21.359
  641    HZ1  LYS  85           3HZ      LYS  85   4.600  -2.298 -19.143
  642    HZ2  LYS  85           1HZ      LYS  85   3.625  -1.088 -19.635
  643    HZ3  LYS  85           2HZ      LYS  85   3.378  -2.614 -20.212
  644    H    LYS  86           H        LYS  86  10.277   1.187 -22.452
  645    HA   LYS  86           HA       LYS  86   8.626   3.413 -23.134
  646    HB2  LYS  86           2HB      LYS  86  10.397   1.531 -24.688
  647    HB3  LYS  86           3HB      LYS  86   9.334   2.655 -25.555
  648    HG2  LYS  86           2HG      LYS  86  11.457   3.704 -25.419
  649    HG3  LYS  86           3HG      LYS  86  10.381   4.548 -24.286
  650    HD2  LYS  86           2HD      LYS  86  11.395   3.302 -22.404
  651    HD3  LYS  86           3HD      LYS  86  12.470   2.457 -23.535
  652    HE2  LYS  86           2HE      LYS  86  12.398   5.466 -23.056
  653    HE3  LYS  86           3HE      LYS  86  13.573   4.347 -22.333
  654    HZ1  LYS  86           3HZ      LYS  86  14.357   3.833 -24.554
  655    HZ2  LYS  86           1HZ      LYS  86  13.264   4.873 -25.227
  656    HZ3  LYS  86           2HZ      LYS  86  14.477   5.454 -24.265
  657    H    GLU  87           H        GLU  87   6.759   3.592 -24.391
  658    HA   GLU  87           HA       GLU  87   4.907   1.419 -24.504
  659    HB2  GLU  87           2HB      GLU  87   5.023   4.060 -26.002
  660    HB3  GLU  87           3HB      GLU  87   3.638   2.946 -26.025
  661    HG2  GLU  87           2HG      GLU  87   3.448   3.184 -23.536
  662    HG3  GLU  87           3HG      GLU  87   4.782   4.353 -23.583
  663    H    SER  88           H        SER  88   4.032   0.393 -26.398
  664    HA   SER  88           HA       SER  88   5.880  -0.789 -28.183
  665    HB2  SER  88           2HB      SER  88   2.907  -0.394 -28.657
  666    HB3  SER  88           3HB      SER  88   3.945  -1.708 -29.255
  667    HG   SER  88           HG       SER  88   2.693  -2.334 -27.410
  668    H    LYS  89           H        LYS  89   6.336  -0.500 -30.372
  669    HA   LYS  89           HA       LYS  89   6.428   2.138 -31.439
  670    HB2  LYS  89           2HB      LYS  89   6.553  -0.579 -32.808
  671    HB3  LYS  89           3HB      LYS  89   6.899   0.965 -33.615
  672    HG2  LYS  89           2HG      LYS  89   8.742   1.388 -31.992
  673    HG3  LYS  89           3HG      LYS  89   8.417  -0.187 -31.233
  674    HD2  LYS  89           2HD      LYS  89   8.930  -1.328 -33.376
  675    HD3  LYS  89           3HD      LYS  89   9.263   0.250 -34.134
  676    HE2  LYS  89           2HE      LYS  89  11.068   0.657 -32.492
  677    HE3  LYS  89           3HE      LYS  89  10.736  -0.918 -31.735
  678    HZ1  LYS  89           3HZ      LYS  89  11.360  -1.973 -33.806
  679    HZ2  LYS  89           1HZ      LYS  89  11.667  -0.511 -34.508
  680    HZ3  LYS  89           2HZ      LYS  89  12.593  -1.035 -33.253
  681    HA   PRO  90           HA       PRO  90   2.315   2.550 -33.205
  682    HB2  PRO  90           2HB      PRO  90   2.861   4.124 -35.407
  683    HB3  PRO  90           3HB      PRO  90   2.721   4.765 -33.747
  684    HG2  PRO  90           2HG      PRO  90   5.205   4.000 -35.374
  685    HG3  PRO  90           3HG      PRO  90   4.977   5.439 -34.343
  686    HD2  PRO  90           2HD      PRO  90   6.318   3.188 -33.455
  687    HD3  PRO  90           3HD      PRO  90   5.349   4.198 -32.349
  688    H    ARG  91           H        ARG  91   1.163   1.837 -35.180
  689    HA   ARG  91           HA       ARG  91   2.740   0.036 -36.980
  690    HB2  ARG  91           2HB      ARG  91   1.387  -0.907 -34.798
  691    HB3  ARG  91           3HB      ARG  91   0.091  -0.912 -36.009
  692    HG2  ARG  91           2HG      ARG  91   0.923  -3.026 -36.335
  693    HG3  ARG  91           3HG      ARG  91   1.922  -2.133 -37.495
  694    HD2  ARG  91           2HD      ARG  91   2.736  -3.028 -34.692
  695    HD3  ARG  91           3HD      ARG  91   3.314  -3.702 -36.229
  696    HE   ARG  91           HE       ARG  91   3.797  -0.890 -35.378
  697   HH11  ARG  91          1HH1      ARG  91   5.176  -3.941 -36.574
  698   HH12  ARG  91          2HH1      ARG  91   6.733  -3.243 -36.900
  699   HH21  ARG  91          1HH2      ARG  91   5.755   0.007 -35.876
  700   HH22  ARG  91          2HH2      ARG  91   7.077  -0.966 -36.501
  701    H    LYS  92           H        LYS  92   0.712   2.659 -36.988
  702    HA   LYS  92           HA       LYS  92  -0.909   2.064 -39.269
  703    HB2  LYS  92           2HB      LYS  92   0.457   4.665 -38.515
  704    HB3  LYS  92           3HB      LYS  92  -0.875   4.477 -39.670
  705    HG2  LYS  92           2HG      LYS  92  -1.033   3.932 -36.681
  706    HG3  LYS  92           3HG      LYS  92  -1.608   5.402 -37.490
  707    HD2  LYS  92           2HD      LYS  92  -3.238   4.006 -38.798
  708    HD3  LYS  92           3HD      LYS  92  -2.706   2.576 -37.879
  709    HE2  LYS  92           2HE      LYS  92  -3.364   3.677 -35.769
  710    HE3  LYS  92           3HE      LYS  92  -3.878   5.119 -36.676
  711    HZ1  LYS  92           3HZ      LYS  92  -5.529   3.735 -37.780
  712    HZ2  LYS  92           1HZ      LYS  92  -5.058   2.422 -36.956
  713    HZ3  LYS  92           2HZ      LYS  92  -5.740   3.696 -36.136
  714    HA   PRO  93           HA       PRO  93   2.533   1.911 -42.253
  715    HB2  PRO  93           2HB      PRO  93   1.100   2.401 -44.578
  716    HB3  PRO  93           3HB      PRO  93   1.297   0.792 -43.833
  717    HG2  PRO  93           2HG      PRO  93  -1.011   2.785 -43.695
  718    HG3  PRO  93           3HG      PRO  93  -1.107   1.008 -43.782
  719    HD2  PRO  93           2HD      PRO  93  -1.399   2.429 -41.404
  720    HD3  PRO  93           3HD      PRO  93  -0.749   0.768 -41.459
  721    H    LYS  94           H        LYS  94   3.844   3.566 -43.076
  722    HA   LYS  94           HA       LYS  94   3.137   6.286 -42.389
  723    HB2  LYS  94           2HB      LYS  94   5.431   5.298 -42.317
  724    HB3  LYS  94           3HB      LYS  94   5.415   5.217 -44.090
  725    HG2  LYS  94           2HG      LYS  94   6.705   7.150 -43.337
  726    HG3  LYS  94           3HG      LYS  94   5.254   7.673 -44.215
  727    HD2  LYS  94           2HD      LYS  94   4.128   8.254 -42.145
  728    HD3  LYS  94           3HD      LYS  94   5.436   7.535 -41.182
  729    HE2  LYS  94           2HE      LYS  94   5.714   9.913 -41.107
  730    HE3  LYS  94           3HE      LYS  94   7.004   9.245 -42.131
  731    HZ1  LYS  94           3HZ      LYS  94   5.724   9.909 -44.057
  732    HZ2  LYS  94           1HZ      LYS  94   4.527  10.527 -43.109
  733    HZ3  LYS  94           2HZ      LYS  94   6.029  11.214 -43.099
  734    H    ALA  95           H        ALA  95   3.227   4.485 -45.454
  735    HA   ALA  95           HA       ALA  95   2.457   6.721 -47.131
  736    HB1  ALA  95           1HB      ALA  95   2.198   3.702 -47.498
  737    HB2  ALA  95           2HB      ALA  95   2.003   4.922 -48.773
  738    HB3  ALA  95           3HB      ALA  95   3.586   4.698 -48.001
  739    H    ALA  96           H        ALA  96   0.421   6.985 -48.164
  740    HA   ALA  96           HA       ALA  96  -2.011   6.429 -46.640
  741    HB1  ALA  96           1HB      ALA  96  -1.596   7.498 -49.464
  742    HB2  ALA  96           2HB      ALA  96  -3.131   7.488 -48.573
  743    HB3  ALA  96           3HB      ALA  96  -1.778   8.482 -48.001
  744    H    GLN  97           H        GLN  97  -1.056   4.087 -46.673
  745    HA   GLN  97           HA       GLN  97  -1.741   2.448 -49.012
  746    HB2  GLN  97           2HB      GLN  97   0.147   2.220 -47.208
  747    HB3  GLN  97           3HB      GLN  97  -1.127   1.463 -46.233
  748    HG2  GLN  97           2HG      GLN  97  -1.449  -0.263 -48.000
  749    HG3  GLN  97           3HG      GLN  97  -0.217   0.537 -48.996
  750   HE21  GLN  97          2HE2      GLN  97  -0.638  -0.986 -45.780
  751   HE22  GLN  97          1HE2      GLN  97   0.969  -1.624 -45.659
  752    H    VAL  98           H        VAL  98  -3.408   3.602 -46.253
  753    HA   VAL  98           HA       VAL  98  -5.531   3.243 -45.357
  754    HB   VAL  98           HB       VAL  98  -7.359   3.374 -46.965
  755   HG11  VAL  98          1HG1      VAL  98  -4.960   5.055 -47.854
  756   HG12  VAL  98          2HG1      VAL  98  -6.663   5.420 -48.194
  757   HG13  VAL  98          3HG1      VAL  98  -6.062   5.447 -46.523
  758   HG21  VAL  98          3HG2      VAL  98  -5.370   2.889 -49.193
  759   HG22  VAL  98          1HG2      VAL  98  -6.677   1.799 -48.679
  760   HG23  VAL  98          2HG2      VAL  98  -7.066   3.385 -49.371
  761    H    SER  99           H        SER  99  -3.931   1.168 -45.057
  762    HA   SER  99           HA       SER  99  -5.278  -1.345 -45.586
  763    HB2  SER  99           2HB      SER  99  -3.062  -0.768 -43.594
  764    HB3  SER  99           3HB      SER  99  -3.401  -2.286 -44.456
  765    HG   SER  99           HG       SER  99  -1.701  -1.114 -45.384
  766    H    GLU 100           H        GLU 100  -6.966   0.550 -44.124
  767    HA   GLU 100           HA       GLU 100  -7.657  -1.126 -41.765
  768    HB2  GLU 100           2HB      GLU 100  -7.405   1.906 -41.783
  769    HB3  GLU 100           3HB      GLU 100  -8.083   0.931 -40.462
  770    HG2  GLU 100           2HG      GLU 100  -5.802  -0.267 -40.408
  771    HG3  GLU 100           3HG      GLU 100  -5.202   1.077 -41.403
  772    H    GLU 101           H        GLU 101  -9.880  -0.176 -40.916
  773    HA   GLU 101           HA       GLU 101 -11.831  -0.498 -43.006
  774    HB2  GLU 101           2HB      GLU 101 -12.079   0.448 -40.125
  775    HB3  GLU 101           3HB      GLU 101 -13.441   0.013 -41.180
  776    HG2  GLU 101           2HG      GLU 101 -12.518  -2.281 -41.400
  777    HG3  GLU 101           3HG      GLU 101 -11.212  -1.867 -40.272
  778    H    ALA 102           H        ALA 102 -10.027   2.213 -42.280
  779    HA   ALA 102           HA       ALA 102 -11.769   3.980 -43.911
  780    HB1  ALA 102           1HB      ALA 102 -10.656   4.699 -41.160
  781    HB2  ALA 102           2HB      ALA 102 -11.444   5.827 -42.289
  782    HB3  ALA 102           3HB      ALA 102 -12.378   4.497 -41.568
  783    H    SER 103           H        SER 103 -10.510   5.927 -44.534
  784    HA   SER 103           HA       SER 103  -7.787   5.318 -45.339
  785    HB2  SER 103           2HB      SER 103  -9.347   7.915 -45.577
  786    HB3  SER 103           3HB      SER 103  -7.937   7.412 -46.536
  787    HG   SER 103           HG       SER 103  -9.935   7.058 -47.645
  788    H    THR 104           H        THR 104  -8.152   5.395 -42.462
  789    HA   THR 104           HA       THR 104  -7.308   7.746 -41.219
  790    HB   THR 104           HB       THR 104  -6.265   5.775 -39.605
  791    HG1  THR 104           1HG      THR 104  -7.704   4.002 -39.815
  792   HG21  THR 104          1HG2      THR 104  -9.216   6.488 -39.951
  793   HG22  THR 104          2HG2      THR 104  -8.485   5.765 -38.498
  794   HG23  THR 104          3HG2      THR 104  -8.031   7.410 -38.996
  795    HA   PRO 105           HA       PRO 105  -2.719   6.943 -41.686
  796    HB2  PRO 105           2HB      PRO 105  -1.761   5.066 -43.464
  797    HB3  PRO 105           3HB      PRO 105  -2.005   4.741 -41.729
  798    HG2  PRO 105           2HG      PRO 105  -3.785   4.107 -44.137
  799    HG3  PRO 105           3HG      PRO 105  -3.436   3.058 -42.738
  800    HD2  PRO 105           2HD      PRO 105  -5.759   4.553 -42.930
  801    HD3  PRO 105           3HD      PRO 105  -4.990   4.201 -41.362
  802    H    GLN 106           H        GLN 106  -1.786   8.435 -42.986
  803    HA   GLN 106           HA       GLN 106  -2.480   8.666 -45.862
  804    HB2  GLN 106           2HB      GLN 106  -2.784  10.830 -43.763
  805    HB3  GLN 106           3HB      GLN 106  -2.734  11.142 -45.509
  806    HG2  GLN 106           2HG      GLN 106  -4.832   9.384 -44.161
  807    HG3  GLN 106           3HG      GLN 106  -5.051  11.104 -44.510
  808   HE21  GLN 106          2HE2      GLN 106  -4.874   7.857 -45.915
  809   HE22  GLN 106          1HE2      GLN 106  -5.427   8.338 -47.520
  810    H    GLY 107           H        GLY 107  -0.930   9.944 -47.004
  811    HA2  GLY 107           2HA      GLY 107   1.462  11.079 -46.291
  812    HA3  GLY 107           3HA      GLY 107   1.780   9.336 -46.149
  813    H    PHE 108           H        PHE 108   3.303   9.765 -47.970
  814    HA   PHE 108           HA       PHE 108   2.445  10.192 -50.647
  815    HB2  PHE 108           2HB      PHE 108   4.673   8.406 -49.577
  816    HB3  PHE 108           3HB      PHE 108   4.497   8.937 -51.258
  817    HD1  PHE 108           HD1      PHE 108   4.467  11.512 -51.684
  818    HD2  PHE 108           HD2      PHE 108   5.982   9.655 -48.095
  819    HE1  PHE 108           HE1      PHE 108   5.801  13.549 -51.192
  820    HE2  PHE 108           HE2      PHE 108   7.317  11.698 -47.608
  821    HZ   PHE 108           HZ       PHE 108   7.227  13.646 -49.152
  822    H    ASN 109           H        ASN 109   2.309   8.516 -52.367
  823    HA   ASN 109           HA       ASN 109   1.321   5.839 -51.615
  824    HB2  ASN 109           2HB      ASN 109  -0.697   7.262 -51.442
  825    HB3  ASN 109           3HB      ASN 109  -0.400   7.884 -53.073
  826   HD21  ASN 109          2HD2      ASN 109  -1.682   5.162 -51.193
  827   HD22  ASN 109          1HD2      ASN 109  -2.262   4.274 -52.575
  828    H    THR 110           H        THR 110   1.356   4.446 -53.552
  829    HA   THR 110           HA       THR 110   3.414   4.963 -55.383
  830    HB   THR 110           HB       THR 110   2.194   3.024 -56.660
  831    HG1  THR 110           1HG      THR 110   0.730   1.914 -55.249
  832   HG21  THR 110          1HG2      THR 110   3.077   2.686 -53.754
  833   HG22  THR 110          2HG2      THR 110   2.982   1.390 -54.967
  834   HG23  THR 110          3HG2      THR 110   4.153   2.710 -55.170
  835    H    LEU 111           H        LEU 111  -0.070   5.776 -55.800
  836    HA   LEU 111           HA       LEU 111   0.265   6.643 -58.530
  837    HB2  LEU 111           2HB      LEU 111  -1.908   6.169 -57.561
  838    HB3  LEU 111           3HB      LEU 111  -1.718   7.481 -56.379
  839    HG   LEU 111           HG       LEU 111  -1.705   9.147 -58.201
  840   HD11  LEU 111          1HD1      LEU 111  -2.270   6.793 -60.067
  841   HD12  LEU 111          2HD1      LEU 111  -2.317   8.512 -60.517
  842   HD13  LEU 111          3HD1      LEU 111  -0.779   7.768 -60.051
  843   HD21  LEU 111          3HD2      LEU 111  -4.068   7.233 -58.310
  844   HD22  LEU 111          1HD2      LEU 111  -3.829   8.557 -57.148
  845   HD23  LEU 111          2HD2      LEU 111  -4.083   8.923 -58.868
  846    H    LYS 112           H        LYS 112   0.465   8.434 -55.410
  847    HA   LYS 112           HA       LYS 112   1.013  10.979 -56.549
  848    HB2  LYS 112           2HB      LYS 112   1.924   9.811 -53.903
  849    HB3  LYS 112           3HB      LYS 112   2.054  11.519 -54.359
  850    HG2  LYS 112           2HG      LYS 112  -0.406  11.681 -54.537
  851    HG3  LYS 112           3HG      LYS 112  -0.561   9.959 -54.126
  852    HD2  LYS 112           2HD      LYS 112   0.535  10.402 -51.935
  853    HD3  LYS 112           3HD      LYS 112   0.623  12.131 -52.345
  854    HE2  LYS 112           2HE      LYS 112  -1.855  12.196 -52.521
  855    HE3  LYS 112           3HE      LYS 112  -1.925  10.477 -52.076
  856    HZ1  LYS 112           3HZ      LYS 112  -0.922  11.050 -49.955
  857    HZ2  LYS 112           1HZ      LYS 112  -0.865  12.643 -50.377
  858    HZ3  LYS 112           2HZ      LYS 112  -2.322  11.903 -50.184
  859    H    ASP 113           H        ASP 113   3.140   8.221 -55.999
  860    HA   ASP 113           HA       ASP 113   5.613   9.631 -56.520
  861    HB2  ASP 113           2HB      ASP 113   5.416   7.555 -55.236
  862    HB3  ASP 113           3HB      ASP 113   4.934   6.660 -56.690
  863    H    LYS 114           H        LYS 114   3.130   8.591 -58.753
  864    HA   LYS 114           HA       LYS 114   5.090   8.843 -61.007
  865    HB2  LYS 114           2HB      LYS 114   4.443   6.792 -61.952
  866    HB3  LYS 114           3HB      LYS 114   4.732   6.449 -60.234
  867    HG2  LYS 114           2HG      LYS 114   2.214   6.681 -59.880
  868    HG3  LYS 114           3HG      LYS 114   2.043   6.740 -61.644
  869    HD2  LYS 114           2HD      LYS 114   3.113   4.517 -61.832
  870    HD3  LYS 114           3HD      LYS 114   3.304   4.457 -60.061
  871    HE2  LYS 114           2HE      LYS 114   0.870   4.559 -59.768
  872    HE3  LYS 114           3HE      LYS 114   0.644   4.704 -61.526
  873    HZ1  LYS 114           3HZ      LYS 114   1.596   2.508 -61.766
  874    HZ2  LYS 114           1HZ      LYS 114   1.806   2.376 -60.135
  875    HZ3  LYS 114           2HZ      LYS 114   0.286   2.457 -60.766
  876    H    LEU 115           H        LEU 115   1.987   9.825 -59.947
  877    HA   LEU 115           HA       LEU 115   0.757  10.089 -62.496
  878    HB2  LEU 115           2HB      LEU 115  -0.820  11.359 -61.503
  879    HB3  LEU 115           3HB      LEU 115  -0.202  10.463 -60.109
  880    HG   LEU 115           HG       LEU 115   0.439  13.377 -60.809
  881   HD11  LEU 115          1HD1      LEU 115  -1.172  12.128 -58.540
  882   HD12  LEU 115          2HD1      LEU 115  -0.828  13.863 -58.735
  883   HD13  LEU 115          3HD1      LEU 115  -1.844  13.018 -59.923
  884   HD21  LEU 115          3HD2      LEU 115   1.339  11.772 -58.411
  885   HD22  LEU 115          1HD2      LEU 115   2.376  12.335 -59.724
  886   HD23  LEU 115          2HD2      LEU 115   1.589  13.509 -58.661
  887    H    GLU 116           H        GLU 116   0.208  12.181 -63.562
  888    HA   GLU 116           HA       GLU 116   2.662  13.866 -63.913
  889    HB2  GLU 116           2HB      GLU 116   0.834  12.688 -66.032
  890    HB3  GLU 116           3HB      GLU 116   2.116  13.880 -66.334
  891    HG2  GLU 116           2HG      GLU 116   3.792  12.272 -65.449
  892    HG3  GLU 116           3HG      GLU 116   2.515  11.055 -65.254
  893    H    GLU 117           H        GLU 117  -0.503  13.982 -62.895
  894    HA   GLU 117           HA       GLU 117  -1.659  16.045 -64.480
  895    HB2  GLU 117           2HB      GLU 117  -2.163  15.287 -61.578
  896    HB3  GLU 117           3HB      GLU 117  -3.211  16.326 -62.569
  897    HG2  GLU 117           2HG      GLU 117  -3.476  14.415 -64.177
  898    HG3  GLU 117           3HG      GLU 117  -2.596  13.376 -63.039
  899    H    TRP 118           H        TRP 118   0.723  16.322 -61.973
  900    HA   TRP 118           HA       TRP 118   0.419  19.053 -61.249
  901    HB2  TRP 118           2HB      TRP 118   2.885  18.818 -60.679
  902    HB3  TRP 118           3HB      TRP 118   1.811  17.609 -59.959
  903    HD1  TRP 118           HD1      TRP 118   2.194  15.235 -60.468
  904    HE1  TRP 118           HE1      TRP 118   3.978  13.819 -61.787
  905    HE3  TRP 118           HE3      TRP 118   4.637  19.064 -62.825
  906    HZ2  TRP 118           HZ2      TRP 118   6.116  14.367 -63.602
  907    HZ3  TRP 118           HZ3      TRP 118   6.526  18.639 -64.277
  908    HH2  TRP 118           HH2      TRP 118   7.310  16.316 -64.731
  909    H    ILE 119           H        ILE 119   1.473  17.826 -64.350
  910    HA   ILE 119           HA       ILE 119   2.758  20.308 -65.214
  911    HB   ILE 119           HB       ILE 119   2.498  19.382 -67.462
  912   HG12  ILE 119          2HG1      ILE 119   1.421  16.949 -67.485
  913   HG13  ILE 119          3HG1      ILE 119   0.361  17.740 -66.302
  914   HG21  ILE 119          1HG2      ILE 119   3.232  17.193 -65.465
  915   HG22  ILE 119          2HG2      ILE 119   3.672  17.211 -67.182
  916   HG23  ILE 119          3HG2      ILE 119   4.321  18.450 -66.086
  917   HD11  ILE 119          3HD1      ILE 119  -0.120  19.542 -67.947
  918   HD12  ILE 119          1HD1      ILE 119   0.945  18.747 -69.126
  919   HD13  ILE 119          2HD1      ILE 119  -0.549  17.947 -68.593
  920    H    GLU 120           H        GLU 120  -0.541  19.719 -64.525
  921    HA   GLU 120           HA       GLU 120  -1.745  21.533 -66.350
  922    HB2  GLU 120           2HB      GLU 120  -2.947  19.969 -64.878
  923    HB3  GLU 120           3HB      GLU 120  -2.423  20.900 -63.457
  924    HG2  GLU 120           2HG      GLU 120  -3.696  22.834 -64.184
  925    HG3  GLU 120           3HG      GLU 120  -4.119  22.048 -65.718
  926    H    MET 121           H        MET 121  -1.980  23.732 -66.388
  927    HA   MET 121           HA       MET 121   0.174  25.293 -65.501
  928    HB2  MET 121           2HB      MET 121  -2.614  26.166 -66.321
  929    HB3  MET 121           3HB      MET 121  -1.213  27.247 -66.163
  930    HG2  MET 121           2HG      MET 121  -1.444  24.889 -68.063
  931    HG3  MET 121           3HG      MET 121  -1.635  26.595 -68.505
  932    HE1  MET 121           3HE      MET 121   0.343  24.351 -69.871
  933    HE2  MET 121           1HE      MET 121   0.120  25.997 -70.511
  934    HE3  MET 121           2HE      MET 121   1.759  25.372 -70.215
  935    H    SER 122           H        SER 122  -2.908  24.817 -63.876
  936    HA   SER 122           HA       SER 122  -2.756  26.750 -61.845
  937    HB2  SER 122           2HB      SER 122  -3.796  23.921 -61.512
  938    HB3  SER 122           3HB      SER 122  -4.380  25.413 -60.737
  939    HG   SER 122           HG       SER 122  -5.714  24.731 -62.512
  940    H    ASN 123           H        ASN 123  -0.783  23.882 -62.152
  941    HA   ASN 123           HA       ASN 123   0.508  24.543 -59.516
  942    HB2  ASN 123           2HB      ASN 123  -0.417  22.301 -59.465
  943    HB3  ASN 123           3HB      ASN 123   0.327  21.896 -61.026
  944   HD21  ASN 123          2HD2      ASN 123   2.489  21.242 -61.088
  945   HD22  ASN 123          1HD2      ASN 123   3.487  21.128 -59.640
  946    H    ARG 124           H        ARG 124   1.027  23.796 -62.961
  947    HA   ARG 124           HA       ARG 124   3.834  23.683 -63.080
  948    HB2  ARG 124           2HB      ARG 124   1.892  23.470 -64.870
  949    HB3  ARG 124           3HB      ARG 124   2.277  25.179 -65.160
  950    HG2  ARG 124           2HG      ARG 124   4.702  24.445 -65.545
  951    HG3  ARG 124           3HG      ARG 124   4.110  22.766 -65.508
  952    HD2  ARG 124           2HD      ARG 124   2.377  23.539 -67.266
  953    HD3  ARG 124           3HD      ARG 124   3.378  24.988 -67.448
  954    HE   ARG 124           HE       ARG 124   5.242  23.508 -68.100
  955   HH11  ARG 124          1HH1      ARG 124   2.025  21.997 -68.185
  956   HH12  ARG 124          2HH1      ARG 124   2.425  20.939 -69.504
  957   HH21  ARG 124          1HH2      ARG 124   5.693  22.187 -69.915
  958   HH22  ARG 124          2HH2      ARG 124   4.516  21.047 -70.489
  959    H    LYS 125           H        LYS 125   1.817  26.560 -62.760
  960    HA   LYS 125           HA       LYS 125   3.578  28.664 -63.198
  961    HB2  LYS 125           2HB      LYS 125   2.208  29.929 -61.723
  962    HB3  LYS 125           3HB      LYS 125   1.149  28.726 -62.490
  963    HG2  LYS 125           2HG      LYS 125   1.583  27.271 -60.394
  964    HG3  LYS 125           3HG      LYS 125   2.251  28.744 -59.659
  965    HD2  LYS 125           2HD      LYS 125   0.044  29.889 -60.092
  966    HD3  LYS 125           3HD      LYS 125  -0.595  28.334 -60.680
  967    HE2  LYS 125           2HE      LYS 125   0.327  27.410 -58.391
  968    HE3  LYS 125           3HE      LYS 125   0.291  29.118 -57.894
  969    HZ1  LYS 125           3HZ      LYS 125  -2.053  29.150 -58.430
  970    HZ2  LYS 125           1HZ      LYS 125  -2.004  27.555 -58.888
  971    HZ3  LYS 125           2HZ      LYS 125  -1.737  27.973 -57.317
  972    H    ASP 126           H        ASP 126   3.949  26.335 -60.613
  973    HA   ASP 126           HA       ASP 126   5.715  27.810 -58.922
  974    HB2  ASP 126           2HB      ASP 126   4.562  25.741 -58.347
  975    HB3  ASP 126           3HB      ASP 126   5.546  24.819 -59.501
  976    H    LEU 127           H        LEU 127   6.315  26.583 -62.115
  977    HA   LEU 127           HA       LEU 127   9.052  25.986 -61.958
  978    HB2  LEU 127           2HB      LEU 127   9.086  25.930 -64.197
  979    HB3  LEU 127           3HB      LEU 127   7.345  25.767 -63.926
  980    HG   LEU 127           HG       LEU 127   8.762  28.361 -64.746
  981   HD11  LEU 127          1HD1      LEU 127   7.043  26.426 -66.360
  982   HD12  LEU 127          2HD1      LEU 127   7.683  27.978 -66.945
  983   HD13  LEU 127          3HD1      LEU 127   8.798  26.655 -66.536
  984   HD21  LEU 127          3HD2      LEU 127   5.793  27.784 -64.608
  985   HD22  LEU 127          1HD2      LEU 127   6.703  28.844 -63.513
  986   HD23  LEU 127          2HD2      LEU 127   6.554  29.260 -65.231
  987    H    ILE 128           H        ILE 128  10.920  26.963 -62.604
  988    HA   ILE 128           HA       ILE 128  11.191  29.911 -62.792
  989    HB   ILE 128           HB       ILE 128  11.178  29.437 -60.339
  990   HG12  ILE 128          2HG1      ILE 128  13.929  30.164 -61.288
  991   HG13  ILE 128          3HG1      ILE 128  12.507  31.226 -61.378
  992   HG21  ILE 128          1HG2      ILE 128  13.583  27.639 -60.935
  993   HG22  ILE 128          2HG2      ILE 128  13.027  28.113 -59.318
  994   HG23  ILE 128          3HG2      ILE 128  11.999  27.097 -60.333
  995   HD11  ILE 128          3HD1      ILE 128  12.269  31.128 -58.911
  996   HD12  ILE 128          1HD1      ILE 128  13.696  30.072 -58.814
  997   HD13  ILE 128          2HD1      ILE 128  13.871  31.741 -59.380
  998    H    LYS 129           H        LYS 129  13.131  30.542 -63.684
  999    HA   LYS 129           HA       LYS 129  15.096  28.521 -64.508
 1000    HB2  LYS 129           2HB      LYS 129  14.988  28.947 -66.804
 1001    HB3  LYS 129           3HB      LYS 129  13.350  28.530 -66.277
 1002    HG2  LYS 129           2HG      LYS 129  14.337  31.346 -66.857
 1003    HG3  LYS 129           3HG      LYS 129  13.465  30.324 -68.013
 1004    HD2  LYS 129           2HD      LYS 129  11.515  30.283 -66.387
 1005    HD3  LYS 129           3HD      LYS 129  12.387  31.494 -65.413
 1006    HE2  LYS 129           2HE      LYS 129  12.469  33.008 -67.365
 1007    HE3  LYS 129           3HE      LYS 129  11.589  31.804 -68.334
 1008    HZ1  LYS 129           3HZ      LYS 129   9.723  32.048 -66.830
 1009    HZ2  LYS 129           1HZ      LYS 129  10.545  33.166 -65.933
 1010    HZ3  LYS 129           2HZ      LYS 129  10.124  33.506 -67.488
 1011    H    LYS 130           H        LYS 130  17.047  29.514 -65.382
 1012    HA   LYS 130           HA       LYS 130  17.960  31.734 -63.878
 1013    HB2  LYS 130           2HB      LYS 130  19.387  29.956 -64.924
 1014    HB3  LYS 130           3HB      LYS 130  19.045  30.674 -66.516
 1015    HG2  LYS 130           2HG      LYS 130  20.108  32.785 -65.814
 1016    HG3  LYS 130           3HG      LYS 130  20.393  32.119 -64.189
 1017    HD2  LYS 130           2HD      LYS 130  21.860  30.386 -65.133
 1018    HD3  LYS 130           3HD      LYS 130  21.529  30.979 -66.774
 1019    HE2  LYS 130           2HE      LYS 130  23.677  31.822 -66.129
 1020    HE3  LYS 130           3HE      LYS 130  22.531  33.182 -66.131
 1021    HZ1  LYS 130           3HZ      LYS 130  22.393  32.983 -63.738
 1022    HZ2  LYS 130           1HZ      LYS 130  23.456  31.722 -63.736
 1023    HZ3  LYS 130           2HZ      LYS 130  23.957  33.222 -64.199
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1  11.738 -27.705  -4.436
    2    H2   MET   1           H2       MET   1  12.225 -26.119  -4.299
    3    H3   MET   1           H3       MET   1  12.567 -26.967  -5.654
    4    HA   MET   1           HA       MET   1  10.418 -25.382  -5.136
    5    HB2  MET   1           2HB      MET   1  11.661 -25.698  -7.283
    6    HB3  MET   1           3HB      MET   1  10.879 -27.275  -7.470
    7    HG2  MET   1           2HG      MET   1   8.690 -26.231  -7.588
    8    HG3  MET   1           3HG      MET   1   9.372 -24.648  -7.185
    9    HE1  MET   1           3HE      MET   1   7.396 -25.079  -9.632
   10    HE2  MET   1           1HE      MET   1   8.132 -23.511  -9.220
   11    HE3  MET   1           2HE      MET   1   8.201 -24.118 -10.891
   12    H    ALA   2           H        ALA   2   8.632 -25.793  -4.047
   13    HA   ALA   2           HA       ALA   2   7.205 -28.369  -4.413
   14    HB1  ALA   2           1HB      ALA   2   7.784 -26.997  -1.751
   15    HB2  ALA   2           2HB      ALA   2   6.768 -28.431  -1.984
   16    HB3  ALA   2           3HB      ALA   2   8.507 -28.527  -2.318
   17    H    ALA   3           H        ALA   3   6.965 -25.567  -5.459
   18    HA   ALA   3           HA       ALA   3   4.085 -25.170  -5.067
   19    HB1  ALA   3           1HB      ALA   3   6.176 -23.012  -4.507
   20    HB2  ALA   3           2HB      ALA   3   4.424 -22.735  -4.648
   21    HB3  ALA   3           3HB      ALA   3   5.051 -23.724  -3.325
   22    H    LYS   4           H        LYS   4   3.431 -23.398  -6.721
   23    HA   LYS   4           HA       LYS   4   4.395 -24.171  -9.311
   24    HB2  LYS   4           2HB      LYS   4   2.635 -21.838  -8.446
   25    HB3  LYS   4           3HB      LYS   4   2.898 -22.337 -10.129
   26    HG2  LYS   4           2HG      LYS   4   1.998 -24.607  -9.556
   27    HG3  LYS   4           3HG      LYS   4   1.617 -24.018  -7.931
   28    HD2  LYS   4           2HD      LYS   4   0.449 -22.942 -10.537
   29    HD3  LYS   4           3HD      LYS   4  -0.362 -24.037  -9.403
   30    HE2  LYS   4           2HE      LYS   4  -0.078 -22.260  -7.612
   31    HE3  LYS   4           3HE      LYS   4   0.504 -21.166  -8.893
   32    HZ1  LYS   4           3HZ      LYS   4  -1.650 -21.434 -10.012
   33    HZ2  LYS   4           1HZ      LYS   4  -2.182 -22.439  -8.842
   34    HZ3  LYS   4           2HZ      LYS   4  -1.908 -20.887  -8.504
   35    H    PHE   5           H        PHE   5   5.836 -21.981  -7.143
   36    HA   PHE   5           HA       PHE   5   7.492 -20.825  -9.302
   37    HB2  PHE   5           2HB      PHE   5   6.197 -19.252  -7.035
   38    HB3  PHE   5           3HB      PHE   5   7.331 -18.592  -8.204
   39    HD1  PHE   5           HD2      PHE   5   6.632 -18.250 -10.595
   40    HD2  PHE   5           HD1      PHE   5   3.884 -19.556  -7.552
   41    HE1  PHE   5           HE2      PHE   5   4.724 -17.831 -12.128
   42    HE2  PHE   5           HE1      PHE   5   1.979 -19.132  -9.096
   43    HZ   PHE   5           HZ       PHE   5   2.408 -18.315 -11.403
   44    H    GLU   6           H        GLU   6   9.564 -20.126  -8.492
   45    HA   GLU   6           HA       GLU   6  10.277 -20.512  -5.689
   46    HB2  GLU   6           2HB      GLU   6  10.727 -22.710  -6.805
   47    HB3  GLU   6           3HB      GLU   6  11.774 -21.872  -7.967
   48    HG2  GLU   6           2HG      GLU   6  13.292 -21.208  -6.159
   49    HG3  GLU   6           3HG      GLU   6  12.222 -21.914  -4.949
   50    H    VAL   7           H        VAL   7  12.071 -19.145  -5.194
   51    HA   VAL   7           HA       VAL   7  12.510 -16.777  -6.558
   52    HB   VAL   7           HB       VAL   7  14.568 -16.597  -5.175
   53   HG11  VAL   7          1HG1      VAL   7  12.116 -17.742  -3.742
   54   HG12  VAL   7          2HG1      VAL   7  13.387 -16.762  -2.996
   55   HG13  VAL   7          3HG1      VAL   7  12.358 -16.064  -4.264
   56   HG21  VAL   7          3HG2      VAL   7  13.966 -19.451  -4.275
   57   HG22  VAL   7          1HG2      VAL   7  15.376 -18.925  -5.212
   58   HG23  VAL   7          2HG2      VAL   7  15.154 -18.342  -3.558
   59    H    GLY   8           H        GLY   8  13.602 -16.030  -8.165
   60    HA2  GLY   8           2HA      GLY   8  15.300 -15.895  -9.729
   61    HA3  GLY   8           3HA      GLY   8  15.797 -17.560  -9.382
   62    H    SER   9           H        SER   9  12.666 -18.234  -9.740
   63    HA   SER   9           HA       SER   9  12.742 -18.898 -12.513
   64    HB2  SER   9           2HB      SER   9  10.268 -18.520 -10.784
   65    HB3  SER   9           3HB      SER   9  10.449 -19.533 -12.234
   66    HG   SER   9           HG       SER   9  10.606 -20.744 -10.267
   67    H    VAL  10           H        VAL  10  11.120 -18.090 -14.153
   68    HA   VAL  10           HA       VAL  10  10.477 -15.214 -13.906
   69    HB   VAL  10           HB       VAL  10  11.925 -16.480 -16.271
   70   HG11  VAL  10          1HG1      VAL  10  11.119 -13.580 -15.747
   71   HG12  VAL  10          2HG1      VAL  10  12.057 -14.156 -17.135
   72   HG13  VAL  10          3HG1      VAL  10  10.374 -14.658 -16.940
   73   HG21  VAL  10          3HG2      VAL  10  12.971 -14.448 -14.264
   74   HG22  VAL  10          1HG2      VAL  10  13.511 -16.137 -14.416
   75   HG23  VAL  10          2HG2      VAL  10  13.811 -14.996 -15.729
   76    H    TYR  11           H        TYR  11   8.458 -14.865 -14.559
   77    HA   TYR  11           HA       TYR  11   7.068 -16.734 -16.402
   78    HB2  TYR  11           2HB      TYR  11   6.347 -16.132 -13.520
   79    HB3  TYR  11           3HB      TYR  11   5.116 -16.596 -14.680
   80    HD1  TYR  11           HD1      TYR  11   5.126 -18.841 -15.758
   81    HD2  TYR  11           HD2      TYR  11   7.901 -17.800 -12.634
   82    HE1  TYR  11           HE1      TYR  11   5.582 -21.238 -15.383
   83    HE2  TYR  11           HE2      TYR  11   8.331 -20.224 -12.214
   84    HH   TYR  11           HH       TYR  11   6.753 -22.790 -14.165
   85    H    THR  12           H        THR  12   4.755 -15.769 -16.781
   86    HA   THR  12           HA       THR  12   4.940 -12.810 -16.961
   87    HB   THR  12           HB       THR  12   3.544 -14.647 -18.918
   88    HG1  THR  12           1HG      THR  12   5.392 -14.274 -20.232
   89   HG21  THR  12          1HG2      THR  12   4.527 -11.768 -19.172
   90   HG22  THR  12          2HG2      THR  12   3.712 -12.700 -20.441
   91   HG23  THR  12          3HG2      THR  12   2.837 -12.265 -18.969
   92    H    GLY  13           H        GLY  13   3.092 -11.642 -16.517
   93    HA2  GLY  13           2HA      GLY  13   0.669 -12.991 -15.554
   94    HA3  GLY  13           3HA      GLY  13   1.651 -12.152 -14.339
   95    H    LYS  14           H        LYS  14  -0.581 -10.994 -14.325
   96    HA   LYS  14           HA       LYS  14  -0.478  -8.653 -16.180
   97    HB2  LYS  14           2HB      LYS  14  -2.824 -10.384 -15.376
   98    HB3  LYS  14           3HB      LYS  14  -3.069  -8.671 -15.783
   99    HG2  LYS  14           2HG      LYS  14  -1.994  -8.990 -17.964
  100    HG3  LYS  14           3HG      LYS  14  -1.687 -10.696 -17.595
  101    HD2  LYS  14           2HD      LYS  14  -4.439  -9.403 -17.827
  102    HD3  LYS  14           3HD      LYS  14  -3.639 -10.359 -19.093
  103    HE2  LYS  14           2HE      LYS  14  -3.586 -12.329 -17.575
  104    HE3  LYS  14           3HE      LYS  14  -4.410 -11.383 -16.321
  105    HZ1  LYS  14           3HZ      LYS  14  -6.296 -11.192 -17.776
  106    HZ2  LYS  14           1HZ      LYS  14  -5.535 -12.079 -18.948
  107    HZ3  LYS  14           2HZ      LYS  14  -5.959 -12.772 -17.513
  108    H    VAL  15           H        VAL  15  -0.684  -6.710 -15.272
  109    HA   VAL  15           HA       VAL  15  -0.170  -6.569 -12.440
  110    HB   VAL  15           HB       VAL  15  -0.743  -4.282 -14.343
  111   HG11  VAL  15          1HG1      VAL  15   0.991  -4.521 -11.833
  112   HG12  VAL  15          2HG1      VAL  15   0.798  -3.054 -12.820
  113   HG13  VAL  15          3HG1      VAL  15  -0.583  -3.704 -11.925
  114   HG21  VAL  15          3HG2      VAL  15   1.927  -5.681 -13.911
  115   HG22  VAL  15          1HG2      VAL  15   0.984  -5.664 -15.408
  116   HG23  VAL  15          2HG2      VAL  15   1.672  -4.173 -14.819
  117    H    THR  16           H        THR  16  -1.584  -6.341 -10.846
  118    HA   THR  16           HA       THR  16  -4.459  -5.906 -11.505
  119    HB   THR  16           HB       THR  16  -4.648  -7.428  -9.364
  120    HG1  THR  16           1HG      THR  16  -2.929  -8.890  -9.216
  121   HG21  THR  16          1HG2      THR  16  -3.723  -8.546 -12.049
  122   HG22  THR  16          2HG2      THR  16  -4.626  -9.427 -10.796
  123   HG23  THR  16          3HG2      THR  16  -5.386  -8.079 -11.631
  124    H    GLY  17           H        GLY  17  -1.862  -4.482  -9.753
  125    HA2  GLY  17           2HA      GLY  17  -3.655  -2.382  -9.003
  126    HA3  GLY  17           3HA      GLY  17  -3.199  -3.324  -7.572
  127    H    LEU  18           H        LEU  18  -2.473  -0.707  -7.649
  128    HA   LEU  18           HA       LEU  18   0.483  -0.803  -7.881
  129    HB2  LEU  18           2HB      LEU  18  -1.349   1.415  -8.851
  130    HB3  LEU  18           3HB      LEU  18   0.390   1.589  -8.646
  131    HG   LEU  18           HG       LEU  18  -0.959  -0.287 -10.624
  132   HD11  LEU  18          1HD1      LEU  18   0.532   2.341 -11.057
  133   HD12  LEU  18          2HD1      LEU  18  -0.088   1.281 -12.335
  134   HD13  LEU  18          3HD1      LEU  18  -1.215   2.093 -11.238
  135   HD21  LEU  18          3HD2      LEU  18   1.990   0.372 -10.306
  136   HD22  LEU  18          1HD2      LEU  18   1.200  -1.179  -9.929
  137   HD23  LEU  18          2HD2      LEU  18   1.263  -0.618 -11.597
  138    H    GLN  19           H        GLN  19   1.472   0.439  -6.334
  139    HA   GLN  19           HA       GLN  19  -0.042   1.896  -4.256
  140    HB2  GLN  19           2HB      GLN  19   1.744  -0.533  -3.830
  141    HB3  GLN  19           3HB      GLN  19   1.356   0.620  -2.555
  142    HG2  GLN  19           2HG      GLN  19  -0.892  -0.766  -4.025
  143    HG3  GLN  19           3HG      GLN  19   0.004  -1.628  -2.785
  144   HE21  GLN  19          2HE2      GLN  19  -1.205  -1.661  -0.953
  145   HE22  GLN  19          1HE2      GLN  19  -2.059  -0.281  -0.261
  146    H    ALA  20           H        ALA  20   1.511   3.338  -3.129
  147    HA   ALA  20           HA       ALA  20   3.825   4.137  -4.560
  148    HB1  ALA  20           1HB      ALA  20   3.060   4.672  -1.660
  149    HB2  ALA  20           2HB      ALA  20   4.235   5.591  -2.629
  150    HB3  ALA  20           3HB      ALA  20   2.529   5.622  -3.077
  151    H    TYR  21           H        TYR  21   3.532   1.289  -2.908
  152    HA   TYR  21           HA       TYR  21   6.474   1.091  -2.531
  153    HB2  TYR  21           2HB      TYR  21   6.123  -0.404  -0.695
  154    HB3  TYR  21           3HB      TYR  21   5.323   1.127  -0.371
  155    HD1  TYR  21           HD2      TYR  21   4.782  -2.456  -1.248
  156    HD2  TYR  21           HD1      TYR  21   2.909   1.242  -0.038
  157    HE1  TYR  21           HE2      TYR  21   2.670  -3.674  -0.747
  158    HE2  TYR  21           HE1      TYR  21   0.814   0.023   0.466
  159    HH   TYR  21           HH       TYR  21  -0.244  -2.027   0.500
  160    H    GLY  22           H        GLY  22   4.011   0.046  -4.609
  161    HA2  GLY  22           2HA      GLY  22   5.717  -1.597  -5.993
  162    HA3  GLY  22           3HA      GLY  22   4.953  -2.687  -4.835
  163    H    ALA  23           H        ALA  23   4.559  -3.441  -7.233
  164    HA   ALA  23           HA       ALA  23   1.817  -2.608  -8.100
  165    HB1  ALA  23           1HB      ALA  23   4.180  -3.540  -9.791
  166    HB2  ALA  23           2HB      ALA  23   2.529  -3.275 -10.376
  167    HB3  ALA  23           3HB      ALA  23   3.480  -1.907  -9.781
  168    H    PHE  24           H        PHE  24   0.416  -4.223  -7.711
  169    HA   PHE  24           HA       PHE  24   1.344  -6.927  -7.126
  170    HB2  PHE  24           2HB      PHE  24  -1.396  -5.643  -7.425
  171    HB3  PHE  24           3HB      PHE  24  -1.184  -7.369  -7.177
  172    HD1  PHE  24           HD2      PHE  24   0.223  -8.124  -5.119
  173    HD2  PHE  24           HD1      PHE  24  -1.496  -4.198  -5.559
  174    HE1  PHE  24           HE2      PHE  24   0.337  -7.797  -2.658
  175    HE2  PHE  24           HE1      PHE  24  -1.364  -3.869  -3.101
  176    HZ   PHE  24           HZ       PHE  24  -0.451  -5.657  -1.646
  177    H    VAL  25           H        VAL  25   1.341  -8.660  -8.512
  178    HA   VAL  25           HA       VAL  25   0.173  -8.333 -11.219
  179    HB   VAL  25           HB       VAL  25   2.933  -9.493 -10.670
  180   HG11  VAL  25          1HG1      VAL  25   1.455  -8.859 -13.256
  181   HG12  VAL  25          2HG1      VAL  25   3.105  -9.491 -13.144
  182   HG13  VAL  25          3HG1      VAL  25   1.743 -10.481 -12.601
  183   HG21  VAL  25          3HG2      VAL  25   2.235  -6.822 -11.946
  184   HG22  VAL  25          1HG2      VAL  25   3.035  -7.052 -10.381
  185   HG23  VAL  25          2HG2      VAL  25   3.856  -7.552 -11.856
  186    H    ALA  26           H        ALA  26  -1.378  -9.781 -11.245
  187    HA   ALA  26           HA       ALA  26  -1.332 -12.300  -9.814
  188    HB1  ALA  26           1HB      ALA  26  -3.072 -11.291 -12.096
  189    HB2  ALA  26           2HB      ALA  26  -3.354 -12.770 -11.141
  190    HB3  ALA  26           3HB      ALA  26  -3.429 -11.192 -10.351
  191    H    LEU  27           H        LEU  27  -0.595 -14.218 -10.488
  192    HA   LEU  27           HA       LEU  27   1.229 -14.169 -12.853
  193    HB2  LEU  27           2HB      LEU  27   1.147 -15.846 -10.322
  194    HB3  LEU  27           3HB      LEU  27   2.351 -16.013 -11.602
  195    HG   LEU  27           HG       LEU  27   1.981 -13.459  -9.989
  196   HD11  LEU  27          1HD1      LEU  27   3.980 -15.713  -9.584
  197   HD12  LEU  27          2HD1      LEU  27   3.966 -14.168  -8.719
  198   HD13  LEU  27          3HD1      LEU  27   2.636 -15.304  -8.498
  199   HD21  LEU  27          3HD2      LEU  27   4.255 -14.398 -11.782
  200   HD22  LEU  27          1HD2      LEU  27   3.073 -13.125 -12.175
  201   HD23  LEU  27          2HD2      LEU  27   4.204 -12.891 -10.839
  202    H    ASP  28           H        ASP  28  -1.476 -15.887 -11.376
  203    HA   ASP  28           HA       ASP  28  -1.686 -17.691 -13.738
  204    HB2  ASP  28           2HB      ASP  28  -0.293 -18.790 -11.896
  205    HB3  ASP  28           3HB      ASP  28  -1.712 -18.645 -10.863
  206    H    GLU  29           H        GLU  29  -3.032 -15.369 -12.516
  207    HA   GLU  29           HA       GLU  29  -5.039 -14.419 -12.141
  208    HB2  GLU  29           2HB      GLU  29  -6.204 -16.818 -13.570
  209    HB3  GLU  29           3HB      GLU  29  -6.998 -15.257 -13.300
  210    HG2  GLU  29           2HG      GLU  29  -5.065 -14.193 -14.606
  211    HG3  GLU  29           3HG      GLU  29  -4.567 -15.831 -15.027
  212    H    GLU  30           H        GLU  30  -4.537 -17.410 -10.683
  213    HA   GLU  30           HA       GLU  30  -6.317 -16.607  -8.420
  214    HB2  GLU  30           2HB      GLU  30  -5.759 -19.398  -9.491
  215    HB3  GLU  30           3HB      GLU  30  -6.645 -19.030  -7.999
  216    HG2  GLU  30           2HG      GLU  30  -8.332 -17.762  -9.372
  217    HG3  GLU  30           3HG      GLU  30  -7.486 -18.294 -10.826
  218    H    THR  31           H        THR  31  -3.310 -16.421  -9.274
  219    HA   THR  31           HA       THR  31  -2.309 -16.678  -6.521
  220    HB   THR  31           HB       THR  31  -0.768 -17.815  -8.897
  221    HG1  THR  31           1HG      THR  31  -1.178 -19.801  -7.888
  222   HG21  THR  31          1HG2      THR  31  -0.297 -18.067  -5.886
  223   HG22  THR  31          2HG2      THR  31   0.671 -18.835  -7.157
  224   HG23  THR  31          3HG2      THR  31   0.662 -17.077  -7.005
  225    H    GLN  32           H        GLN  32  -0.618 -15.056  -6.192
  226    HA   GLN  32           HA       GLN  32  -0.106 -13.114  -8.350
  227    HB2  GLN  32           2HB      GLN  32  -2.328 -12.545  -7.562
  228    HB3  GLN  32           3HB      GLN  32  -1.814 -12.644  -5.875
  229    HG2  GLN  32           2HG      GLN  32  -0.593 -10.626  -5.988
  230    HG3  GLN  32           3HG      GLN  32  -0.618 -10.577  -7.745
  231   HE21  GLN  32          2HE2      GLN  32  -1.967  -9.109  -5.078
  232   HE22  GLN  32          1HE2      GLN  32  -3.464  -8.593  -5.812
  233    H    GLY  33           H        GLY  33   1.500 -11.603  -7.805
  234    HA2  GLY  33           2HA      GLY  33   2.768 -11.803  -5.136
  235    HA3  GLY  33           3HA      GLY  33   3.779 -11.988  -6.581
  236    H    LEU  34           H        LEU  34   4.690 -10.016  -5.330
  237    HA   LEU  34           HA       LEU  34   3.365  -7.479  -6.195
  238    HB2  LEU  34           2HB      LEU  34   2.811  -7.914  -3.881
  239    HB3  LEU  34           3HB      LEU  34   4.507  -8.237  -3.486
  240    HG   LEU  34           HG       LEU  34   5.085  -5.874  -3.969
  241   HD11  LEU  34          1HD1      LEU  34   2.080  -5.468  -4.336
  242   HD12  LEU  34          2HD1      LEU  34   3.302  -4.191  -4.263
  243   HD13  LEU  34          3HD1      LEU  34   3.313  -5.326  -5.604
  244   HD21  LEU  34          3HD2      LEU  34   2.776  -6.225  -2.012
  245   HD22  LEU  34          1HD2      LEU  34   4.499  -6.532  -1.681
  246   HD23  LEU  34          2HD2      LEU  34   3.956  -4.893  -2.020
  247    H    VAL  35           H        VAL  35   4.743  -6.747  -7.740
  248    HA   VAL  35           HA       VAL  35   7.622  -6.882  -7.510
  249    HB   VAL  35           HB       VAL  35   5.903  -4.903  -9.073
  250   HG11  VAL  35          1HG1      VAL  35   8.815  -5.754  -9.379
  251   HG12  VAL  35          2HG1      VAL  35   7.952  -4.639 -10.452
  252   HG13  VAL  35          3HG1      VAL  35   8.263  -4.194  -8.768
  253   HG21  VAL  35          3HG2      VAL  35   7.126  -7.513 -10.054
  254   HG22  VAL  35          1HG2      VAL  35   5.387  -7.199  -9.812
  255   HG23  VAL  35          2HG2      VAL  35   6.286  -6.308 -11.042
  256    H    HIS  36           H        HIS  36   8.674  -5.846  -5.820
  257    HA   HIS  36           HA       HIS  36   7.355  -3.709  -4.324
  258    HB2  HIS  36           2HB      HIS  36  10.160  -4.906  -4.258
  259    HB3  HIS  36           3HB      HIS  36   9.609  -3.615  -3.181
  260    HD1  HIS  36           HD1      HIS  36   7.618  -6.856  -4.079
  261    HD2  HIS  36           HD2      HIS  36   9.447  -4.844  -0.846
  262    HE1  HIS  36           HE1      HIS  36   7.013  -8.130  -2.001
  263    H    ILE  37           H        ILE  37   7.852  -1.478  -4.440
  264    HA   ILE  37           HA       ILE  37   8.128  -0.524  -7.040
  265    HB   ILE  37           HB       ILE  37   7.013   0.641  -5.168
  266   HG12  ILE  37          2HG1      ILE  37   8.949   2.414  -6.627
  267   HG13  ILE  37          3HG1      ILE  37   7.572   1.614  -7.401
  268   HG21  ILE  37          1HG2      ILE  37   9.830   1.537  -4.404
  269   HG22  ILE  37          2HG2      ILE  37   8.338   2.188  -3.734
  270   HG23  ILE  37          3HG2      ILE  37   8.768   0.501  -3.424
  271   HD11  ILE  37          3HD1      ILE  37   6.015   2.773  -5.865
  272   HD12  ILE  37          1HD1      ILE  37   7.381   3.598  -5.099
  273   HD13  ILE  37          2HD1      ILE  37   7.003   3.925  -6.790
  274    H    SER  38           H        SER  38  10.835  -0.663  -4.702
  275    HA   SER  38           HA       SER  38  12.698   0.651  -6.362
  276    HB2  SER  38           2HB      SER  38  13.289  -1.642  -4.464
  277    HB3  SER  38           3HB      SER  38  14.334  -0.274  -4.887
  278    HG   SER  38           HG       SER  38  13.322  -0.021  -2.860
  279    H    GLU  39           H        GLU  39  11.408  -2.598  -6.551
  280    HA   GLU  39           HA       GLU  39  13.505  -3.570  -8.344
  281    HB2  GLU  39           2HB      GLU  39  10.965  -4.935  -7.410
  282    HB3  GLU  39           3HB      GLU  39  12.373  -5.688  -8.148
  283    HG2  GLU  39           2HG      GLU  39  12.266  -4.350  -5.418
  284    HG3  GLU  39           3HG      GLU  39  12.303  -6.071  -5.712
  285    H    VAL  40           H        VAL  40  10.824  -1.605  -8.831
  286    HA   VAL  40           HA       VAL  40   9.774  -2.807 -11.246
  287    HB   VAL  40           HB       VAL  40   9.638   0.003 -10.118
  288   HG11  VAL  40          1HG1      VAL  40   7.982  -1.190 -12.376
  289   HG12  VAL  40          2HG1      VAL  40   7.712   0.390 -11.605
  290   HG13  VAL  40          3HG1      VAL  40   9.180   0.099 -12.537
  291   HG21  VAL  40          3HG2      VAL  40   7.594  -2.265 -10.116
  292   HG22  VAL  40          1HG2      VAL  40   8.511  -1.693  -8.720
  293   HG23  VAL  40          2HG2      VAL  40   7.329  -0.629  -9.489
  294    H    THR  41           H        THR  41  12.513  -0.655 -10.542
  295    HA   THR  41           HA       THR  41  13.381  -0.772 -13.360
  296    HB   THR  41           HB       THR  41  12.522   1.744 -11.878
  297    HG1  THR  41           1HG      THR  41  11.266   1.954 -13.823
  298   HG21  THR  41          1HG2      THR  41  13.979   1.594 -14.559
  299   HG22  THR  41          2HG2      THR  41  13.274   3.052 -13.825
  300   HG23  THR  41          3HG2      THR  41  14.644   2.264 -13.051
  301    H    HIS  42           H        HIS  42  15.596  -0.303 -13.541
  302    HA   HIS  42           HA       HIS  42  17.220  -0.892 -11.212
  303    HB2  HIS  42           2HB      HIS  42  19.032  -0.964 -12.943
  304    HB3  HIS  42           3HB      HIS  42  17.637  -1.968 -13.333
  305    HD1  HIS  42           HD1      HIS  42  18.781   1.626 -14.223
  306    HD2  HIS  42           HD2      HIS  42  16.806  -1.732 -15.819
  307    HE1  HIS  42           HE1      HIS  42  18.170   2.226 -16.613
  308    H    GLY  43           H        GLY  43  15.904   1.586 -10.781
  309    HA2  GLY  43           2HA      GLY  43  17.930   3.456 -10.180
  310    HA3  GLY  43           3HA      GLY  43  17.258   3.854 -11.770
  311    H    PHE  44           H        PHE  44  16.463   5.804 -10.765
  312    HA   PHE  44           HA       PHE  44  14.661   6.037  -8.652
  313    HB2  PHE  44           2HB      PHE  44  14.764   7.618 -11.255
  314    HB3  PHE  44           3HB      PHE  44  13.929   8.137  -9.797
  315    HD1  PHE  44           HD1      PHE  44  15.340   8.478  -7.643
  316    HD2  PHE  44           HD2      PHE  44  17.030   8.197 -11.605
  317    HE1  PHE  44           HE1      PHE  44  17.383   9.650  -6.858
  318    HE2  PHE  44           HE2      PHE  44  19.067   9.370 -10.814
  319    HZ   PHE  44           HZ       PHE  44  19.244  10.107  -8.444
  320    H    VAL  45           H        VAL  45  12.460   6.129  -8.469
  321    HA   VAL  45           HA       VAL  45  10.581   5.345 -10.605
  322    HB   VAL  45           HB       VAL  45  11.487   3.233  -9.838
  323   HG11  VAL  45          1HG1      VAL  45  10.645   4.032  -7.027
  324   HG12  VAL  45          2HG1      VAL  45  11.202   2.429  -7.521
  325   HG13  VAL  45          3HG1      VAL  45  12.309   3.791  -7.601
  326   HG21  VAL  45          3HG2      VAL  45   8.656   3.679  -8.910
  327   HG22  VAL  45          1HG2      VAL  45   9.235   3.220 -10.531
  328   HG23  VAL  45          2HG2      VAL  45   9.442   2.108  -9.174
  329    H    LYS  46           H        LYS  46  10.719   7.758  -9.932
  330    HA   LYS  46           HA       LYS  46   9.811   8.689  -7.486
  331    HB2  LYS  46           2HB      LYS  46   9.208  10.777  -8.654
  332    HB3  LYS  46           3HB      LYS  46  10.819  10.173  -9.057
  333    HG2  LYS  46           2HG      LYS  46   9.977   9.311 -11.215
  334    HG3  LYS  46           3HG      LYS  46   8.342   9.871 -10.822
  335    HD2  LYS  46           2HD      LYS  46  10.757  11.710 -11.010
  336    HD3  LYS  46           3HD      LYS  46   9.710  11.363 -12.385
  337    HE2  LYS  46           2HE      LYS  46   8.445  12.322  -9.822
  338    HE3  LYS  46           3HE      LYS  46   9.324  13.496 -10.829
  339    HZ1  LYS  46           3HZ      LYS  46   7.897  12.938 -12.670
  340    HZ2  LYS  46           1HZ      LYS  46   7.080  11.798 -11.808
  341    HZ3  LYS  46           2HZ      LYS  46   6.999  13.411 -11.428
  342    H    ASP  47           H        ASP  47   7.669   7.639 -10.116
  343    HA   ASP  47           HA       ASP  47   5.631   7.199  -8.051
  344    HB2  ASP  47           2HB      ASP  47   5.026   9.411  -9.005
  345    HB3  ASP  47           3HB      ASP  47   5.033   8.706 -10.628
  346    H    ILE  48           H        ILE  48   4.729   5.188  -8.465
  347    HA   ILE  48           HA       ILE  48   6.094   3.529 -10.345
  348    HB   ILE  48           HB       ILE  48   5.180   2.888  -8.093
  349   HG12  ILE  48          2HG1      ILE  48   4.396   1.082 -10.383
  350   HG13  ILE  48          3HG1      ILE  48   6.043   1.326  -9.766
  351   HG21  ILE  48          1HG2      ILE  48   2.518   2.749  -9.573
  352   HG22  ILE  48          2HG2      ILE  48   2.818   2.127  -7.947
  353   HG23  ILE  48          3HG2      ILE  48   2.916   3.850  -8.238
  354   HD11  ILE  48          3HD1      ILE  48   5.353   0.492  -7.535
  355   HD12  ILE  48          1HD1      ILE  48   3.711   0.220  -8.154
  356   HD13  ILE  48          2HD1      ILE  48   5.057  -0.706  -8.804
  357    H    ASN  49           H        ASN  49   3.010   5.245 -10.744
  358    HA   ASN  49           HA       ASN  49   2.287   3.656 -13.046
  359    HB2  ASN  49           2HB      ASN  49   0.371   4.795 -12.980
  360    HB3  ASN  49           3HB      ASN  49   0.962   5.503 -11.474
  361   HD21  ASN  49          2HD2      ASN  49   2.219   7.602 -11.688
  362   HD22  ASN  49          1HD2      ASN  49   1.693   8.695 -12.969
  363    H    GLU  50           H        GLU  50   4.683   6.084 -12.696
  364    HA   GLU  50           HA       GLU  50   4.799   6.579 -15.604
  365    HB2  GLU  50           2HB      GLU  50   6.645   7.455 -13.341
  366    HB3  GLU  50           3HB      GLU  50   6.734   7.995 -15.022
  367    HG2  GLU  50           2HG      GLU  50   4.340   8.862 -14.733
  368    HG3  GLU  50           3HG      GLU  50   4.531   8.547 -13.006
  369    H    HIS  51           H        HIS  51   5.549   3.922 -13.852
  370    HA   HIS  51           HA       HIS  51   7.944   3.214 -15.479
  371    HB2  HIS  51           2HB      HIS  51   7.721   2.799 -12.462
  372    HB3  HIS  51           3HB      HIS  51   9.022   2.267 -13.534
  373    HD1  HIS  51           HD1      HIS  51   7.580   5.514 -12.028
  374    HD2  HIS  51           HD2      HIS  51  10.884   4.085 -14.241
  375    HE1  HIS  51           HE1      HIS  51   9.161   7.456 -12.286
  376    H    LEU  52           H        LEU  52   4.968   2.187 -13.968
  377    HA   LEU  52           HA       LEU  52   4.968  -0.150 -15.730
  378    HB2  LEU  52           2HB      LEU  52   5.692  -0.657 -13.176
  379    HB3  LEU  52           3HB      LEU  52   3.949  -0.577 -12.929
  380    HG   LEU  52           HG       LEU  52   3.820  -2.254 -14.961
  381   HD11  LEU  52          1HD1      LEU  52   6.715  -2.647 -14.083
  382   HD12  LEU  52          2HD1      LEU  52   5.818  -3.691 -15.198
  383   HD13  LEU  52          3HD1      LEU  52   6.195  -2.025 -15.655
  384   HD21  LEU  52          3HD2      LEU  52   4.959  -3.134 -12.287
  385   HD22  LEU  52          1HD2      LEU  52   3.244  -2.863 -12.673
  386   HD23  LEU  52          2HD2      LEU  52   4.120  -4.177 -13.467
  387    H    SER  53           H        SER  53   2.484  -1.123 -15.367
  388    HA   SER  53           HA       SER  53   0.583   1.133 -15.117
  389    HB2  SER  53           2HB      SER  53   0.823  -0.601 -17.609
  390    HB3  SER  53           3HB      SER  53  -0.322   0.726 -17.325
  391    HG   SER  53           HG       SER  53   1.491   1.362 -18.603
  392    H    VAL  54           H        VAL  54  -1.320   0.371 -14.225
  393    HA   VAL  54           HA       VAL  54  -1.767  -2.447 -13.689
  394    HB   VAL  54           HB       VAL  54  -2.500  -0.544 -12.245
  395   HG11  VAL  54          1HG1      VAL  54  -4.620  -0.092 -14.382
  396   HG12  VAL  54          2HG1      VAL  54  -4.601   0.644 -12.776
  397   HG13  VAL  54          3HG1      VAL  54  -3.331   1.041 -13.938
  398   HG21  VAL  54          3HG2      VAL  54  -4.690  -2.439 -13.113
  399   HG22  VAL  54          1HG2      VAL  54  -3.436  -2.716 -11.878
  400   HG23  VAL  54          2HG2      VAL  54  -4.675  -1.475 -11.628
  401    H    GLY  55           H        GLY  55  -3.338  -3.806 -14.500
  402    HA2  GLY  55           2HA      GLY  55  -4.656  -4.764 -16.069
  403    HA3  GLY  55           3HA      GLY  55  -5.061  -3.139 -16.660
  404    H    ASP  56           H        ASP  56  -1.745  -4.388 -16.529
  405    HA   ASP  56           HA       ASP  56  -1.711  -4.733 -19.500
  406    HB2  ASP  56           2HB      ASP  56  -0.620  -2.595 -18.727
  407    HB3  ASP  56           3HB      ASP  56   0.464  -3.576 -17.733
  408    H    GLU  57           H        GLU  57   0.064  -6.231 -20.171
  409    HA   GLU  57           HA       GLU  57   0.412  -8.437 -18.202
  410    HB2  GLU  57           2HB      GLU  57  -0.767  -8.912 -20.321
  411    HB3  GLU  57           3HB      GLU  57   0.655  -8.359 -21.225
  412    HG2  GLU  57           2HG      GLU  57   1.996 -10.183 -20.213
  413    HG3  GLU  57           3HG      GLU  57   0.584 -10.726 -19.305
  414    H    VAL  58           H        VAL  58   2.446  -9.038 -17.574
  415    HA   VAL  58           HA       VAL  58   4.836  -7.691 -18.713
  416    HB   VAL  58           HB       VAL  58   5.547  -7.029 -16.421
  417   HG11  VAL  58          1HG1      VAL  58   2.907  -5.748 -17.274
  418   HG12  VAL  58          2HG1      VAL  58   4.089  -5.039 -16.168
  419   HG13  VAL  58          3HG1      VAL  58   4.516  -5.317 -17.865
  420   HG21  VAL  58          3HG2      VAL  58   2.710  -7.691 -15.547
  421   HG22  VAL  58          1HG2      VAL  58   4.202  -8.512 -15.035
  422   HG23  VAL  58          2HG2      VAL  58   3.933  -6.827 -14.587
  423    H    GLN  59           H        GLN  59   6.703  -8.871 -18.461
  424    HA   GLN  59           HA       GLN  59   6.459 -11.503 -17.134
  425    HB2  GLN  59           2HB      GLN  59   8.260 -12.238 -18.401
  426    HB3  GLN  59           3HB      GLN  59   7.161 -11.414 -19.500
  427    HG2  GLN  59           2HG      GLN  59   9.788 -10.305 -18.446
  428    HG3  GLN  59           3HG      GLN  59   9.532 -10.998 -20.033
  429   HE21  GLN  59          2HE2      GLN  59   8.838  -8.183 -17.972
  430   HE22  GLN  59          1HE2      GLN  59   8.358  -7.107 -19.308
  431    H    VAL  60           H        VAL  60   7.555 -12.024 -15.376
  432    HA   VAL  60           HA       VAL  60   9.063  -9.887 -13.934
  433    HB   VAL  60           HB       VAL  60   7.820 -10.854 -11.903
  434   HG11  VAL  60          1HG1      VAL  60   6.194  -9.304 -13.950
  435   HG12  VAL  60          2HG1      VAL  60   5.837  -9.417 -12.217
  436   HG13  VAL  60          3HG1      VAL  60   7.323  -8.628 -12.744
  437   HG21  VAL  60          3HG2      VAL  60   5.871 -11.876 -14.011
  438   HG22  VAL  60          1HG2      VAL  60   6.848 -12.863 -12.896
  439   HG23  VAL  60          2HG2      VAL  60   5.592 -11.789 -12.271
  440    H    LYS  61           H        LYS  61  10.674 -10.611 -12.535
  441    HA   LYS  61           HA       LYS  61  11.264 -13.538 -12.591
  442    HB2  LYS  61           2HB      LYS  61  13.065 -12.034 -13.324
  443    HB3  LYS  61           3HB      LYS  61  12.976 -11.167 -11.786
  444    HG2  LYS  61           2HG      LYS  61  13.663 -13.186 -10.562
  445    HG3  LYS  61           3HG      LYS  61  13.654 -14.125 -12.066
  446    HD2  LYS  61           2HD      LYS  61  15.436 -12.633 -12.979
  447    HD3  LYS  61           3HD      LYS  61  15.474 -11.768 -11.422
  448    HE2  LYS  61           2HE      LYS  61  16.081 -13.870 -10.267
  449    HE3  LYS  61           3HE      LYS  61  16.019 -14.748 -11.807
  450    HZ1  LYS  61           3HZ      LYS  61  17.831 -13.361 -12.598
  451    HZ2  LYS  61           1HZ      LYS  61  17.892 -12.550 -11.165
  452    HZ3  LYS  61           2HZ      LYS  61  18.275 -14.147 -11.219
  453    H    VAL  62           H        VAL  62  10.832 -14.703 -10.846
  454    HA   VAL  62           HA       VAL  62   9.538 -13.653  -8.521
  455    HB   VAL  62           HB       VAL  62  10.899 -16.346  -8.953
  456   HG11  VAL  62          1HG1      VAL  62   8.687 -15.483  -7.030
  457   HG12  VAL  62          2HG1      VAL  62   9.305 -17.136  -7.218
  458   HG13  VAL  62          3HG1      VAL  62  10.351 -15.869  -6.572
  459   HG21  VAL  62          3HG2      VAL  62   7.998 -15.532  -9.463
  460   HG22  VAL  62          1HG2      VAL  62   9.197 -15.947 -10.708
  461   HG23  VAL  62          2HG2      VAL  62   8.661 -17.181  -9.570
  462    H    LEU  63           H        LEU  63  10.354 -12.790  -6.764
  463    HA   LEU  63           HA       LEU  63  13.317 -12.724  -6.412
  464    HB2  LEU  63           2HB      LEU  63  12.213 -10.619  -7.033
  465    HB3  LEU  63           3HB      LEU  63  11.127 -10.764  -5.647
  466    HG   LEU  63           HG       LEU  63  13.061 -10.570  -4.098
  467   HD11  LEU  63          1HD1      LEU  63  14.674  -9.996  -6.632
  468   HD12  LEU  63          2HD1      LEU  63  15.253  -9.822  -4.967
  469   HD13  LEU  63          3HD1      LEU  63  14.868 -11.427  -5.582
  470   HD21  LEU  63          3HD2      LEU  63  12.810  -8.347  -6.164
  471   HD22  LEU  63          1HD2      LEU  63  11.762  -8.584  -4.750
  472   HD23  LEU  63          2HD2      LEU  63  13.472  -8.167  -4.533
  473    H    ALA  64           H        ALA  64  10.225 -13.299  -4.735
  474    HA   ALA  64           HA       ALA  64  11.653 -14.871  -2.703
  475    HB1  ALA  64           1HB      ALA  64   9.884 -12.545  -1.897
  476    HB2  ALA  64           2HB      ALA  64  10.509 -13.775  -0.813
  477    HB3  ALA  64           3HB      ALA  64  11.635 -12.666  -1.621
  478    H    VAL  65           H        VAL  65  10.179 -16.369  -1.667
  479    HA   VAL  65           HA       VAL  65   7.311 -16.243  -2.421
  480    HB   VAL  65           HB       VAL  65   9.083 -18.724  -2.526
  481   HG11  VAL  65          1HG1      VAL  65   6.095 -18.409  -3.088
  482   HG12  VAL  65          2HG1      VAL  65   7.044 -19.893  -3.320
  483   HG13  VAL  65          3HG1      VAL  65   6.806 -19.242  -1.694
  484   HG21  VAL  65          3HG2      VAL  65   7.656 -17.293  -4.800
  485   HG22  VAL  65          1HG2      VAL  65   9.410 -17.372  -4.545
  486   HG23  VAL  65          2HG2      VAL  65   8.515 -18.847  -4.918
  487    H    ASP  66           H        ASP  66   6.089 -16.438  -0.579
  488    HA   ASP  66           HA       ASP  66   7.134 -17.935   1.743
  489    HB2  ASP  66           2HB      ASP  66   7.862 -15.553   2.050
  490    HB3  ASP  66           3HB      ASP  66   6.171 -15.068   2.051
  491    H    GLU  67           H        GLU  67   5.551 -19.415   1.071
  492    HA   GLU  67           HA       GLU  67   2.803 -18.695   0.658
  493    HB2  GLU  67           2HB      GLU  67   4.014 -20.605  -0.370
  494    HB3  GLU  67           3HB      GLU  67   4.097 -21.380   1.222
  495    HG2  GLU  67           2HG      GLU  67   1.689 -21.605   1.306
  496    HG3  GLU  67           3HG      GLU  67   1.481 -20.627  -0.151
  497    H    GLU  68           H        GLU  68   4.627 -19.214   3.609
  498    HA   GLU  68           HA       GLU  68   2.342 -19.923   5.236
  499    HB2  GLU  68           2HB      GLU  68   4.896 -18.500   6.082
  500    HB3  GLU  68           3HB      GLU  68   3.751 -19.334   7.127
  501    HG2  GLU  68           2HG      GLU  68   5.514 -20.601   4.994
  502    HG3  GLU  68           3HG      GLU  68   5.784 -20.683   6.727
  503    H    LYS  69           H        LYS  69   4.079 -16.830   4.555
  504    HA   LYS  69           HA       LYS  69   1.957 -15.156   5.656
  505    HB2  LYS  69           2HB      LYS  69   4.237 -14.656   3.704
  506    HB3  LYS  69           3HB      LYS  69   3.152 -13.377   4.272
  507    HG2  LYS  69           2HG      LYS  69   4.933 -15.082   6.071
  508    HG3  LYS  69           3HG      LYS  69   5.342 -13.471   5.473
  509    HD2  LYS  69           2HD      LYS  69   3.317 -12.553   6.643
  510    HD3  LYS  69           3HD      LYS  69   3.019 -14.173   7.321
  511    HE2  LYS  69           2HE      LYS  69   5.253 -14.146   8.383
  512    HE3  LYS  69           3HE      LYS  69   5.556 -12.532   7.715
  513    HZ1  LYS  69           3HZ      LYS  69   3.700 -11.711   9.016
  514    HZ2  LYS  69           1HZ      LYS  69   3.420 -13.211   9.638
  515    HZ3  LYS  69           2HZ      LYS  69   4.817 -12.419   9.996
  516    H    GLY  70           H        GLY  70   2.379 -16.840   2.636
  517    HA2  GLY  70           2HA      GLY  70   0.731 -17.318   1.090
  518    HA3  GLY  70           3HA      GLY  70  -0.349 -16.134   1.851
  519    H    LYS  71           H        LYS  71   2.994 -15.651   0.551
  520    HA   LYS  71           HA       LYS  71   1.918 -13.877  -1.576
  521    HB2  LYS  71           2HB      LYS  71   3.307 -12.008  -0.832
  522    HB3  LYS  71           3HB      LYS  71   2.109 -12.443   0.391
  523    HG2  LYS  71           2HG      LYS  71   3.771 -13.542   1.752
  524    HG3  LYS  71           3HG      LYS  71   5.002 -13.412   0.495
  525    HD2  LYS  71           2HD      LYS  71   3.708 -11.024   1.863
  526    HD3  LYS  71           3HD      LYS  71   5.216 -11.762   2.406
  527    HE2  LYS  71           2HE      LYS  71   4.781 -10.602  -0.384
  528    HE3  LYS  71           3HE      LYS  71   5.504  -9.707   0.963
  529    HZ1  LYS  71           3HZ      LYS  71   7.258 -11.351   1.033
  530    HZ2  LYS  71           1HZ      LYS  71   6.590 -12.192  -0.204
  531    HZ3  LYS  71           2HZ      LYS  71   7.179 -10.681  -0.476
  532    H    ILE  72           H        ILE  72   3.597 -12.976  -2.921
  533    HA   ILE  72           HA       ILE  72   6.169 -14.432  -3.139
  534    HB   ILE  72           HB       ILE  72   4.069 -14.036  -5.331
  535   HG12  ILE  72          2HG1      ILE  72   5.345 -16.552  -4.216
  536   HG13  ILE  72          3HG1      ILE  72   3.688 -16.005  -3.924
  537   HG21  ILE  72          1HG2      ILE  72   6.927 -15.059  -5.603
  538   HG22  ILE  72          2HG2      ILE  72   5.730 -15.015  -6.903
  539   HG23  ILE  72          3HG2      ILE  72   6.319 -13.516  -6.229
  540   HD11  ILE  72          3HD1      ILE  72   3.133 -16.285  -6.305
  541   HD12  ILE  72          1HD1      ILE  72   4.776 -16.885  -6.622
  542   HD13  ILE  72          2HD1      ILE  72   3.704 -17.798  -5.575
  543    H    SER  73           H        SER  73   7.799 -12.935  -3.590
  544    HA   SER  73           HA       SER  73   6.964 -10.146  -4.275
  545    HB2  SER  73           2HB      SER  73   9.683 -11.117  -3.373
  546    HB3  SER  73           3HB      SER  73   9.164  -9.451  -3.582
  547    HG   SER  73           HG       SER  73   9.109 -10.093  -1.397
  548    H    LEU  74           H        LEU  74   8.033  -9.135  -6.062
  549    HA   LEU  74           HA       LEU  74   9.108 -10.998  -8.132
  550    HB2  LEU  74           2HB      LEU  74   6.859  -8.988  -8.370
  551    HB3  LEU  74           3HB      LEU  74   7.552  -9.877  -9.727
  552    HG   LEU  74           HG       LEU  74   6.056 -11.154  -7.396
  553   HD11  LEU  74          1HD1      LEU  74   5.137 -10.534 -10.227
  554   HD12  LEU  74          2HD1      LEU  74   4.210 -11.435  -9.015
  555   HD13  LEU  74          3HD1      LEU  74   4.583  -9.726  -8.751
  556   HD21  LEU  74          3HD2      LEU  74   6.979 -12.333 -10.048
  557   HD22  LEU  74          1HD2      LEU  74   7.662 -12.681  -8.442
  558   HD23  LEU  74          2HD2      LEU  74   6.013 -13.155  -8.801
  559    H    SER  75           H        SER  75   9.991  -9.705  -9.999
  560    HA   SER  75           HA       SER  75  10.682  -6.890  -9.422
  561    HB2  SER  75           2HB      SER  75  13.049  -7.423 -10.079
  562    HB3  SER  75           3HB      SER  75  12.541  -8.032  -8.498
  563    HG   SER  75           HG       SER  75  13.699  -9.597  -9.666
  564    H    ILE  76           H        ILE  76  11.099  -5.672 -11.202
  565    HA   ILE  76           HA       ILE  76  10.701  -6.839 -13.924
  566    HB   ILE  76           HB       ILE  76   9.679  -4.274 -12.692
  567   HG12  ILE  76          2HG1      ILE  76   8.252  -6.249 -12.408
  568   HG13  ILE  76          3HG1      ILE  76   7.508  -4.930 -13.306
  569   HG21  ILE  76          1HG2      ILE  76   9.708  -4.971 -15.648
  570   HG22  ILE  76          2HG2      ILE  76   8.841  -3.595 -14.917
  571   HG23  ILE  76          3HG2      ILE  76  10.601  -3.659 -14.882
  572   HD11  ILE  76          3HD1      ILE  76   7.887  -6.147 -15.446
  573   HD12  ILE  76          1HD1      ILE  76   8.660  -7.462 -14.529
  574   HD13  ILE  76          2HD1      ILE  76   6.938  -7.088 -14.318
  575    H    ARG  77           H        ARG  77  12.610  -4.602 -11.890
  576    HA   ARG  77           HA       ARG  77  14.334  -3.704 -13.944
  577    HB2  ARG  77           2HB      ARG  77  15.991  -3.348 -12.246
  578    HB3  ARG  77           3HB      ARG  77  14.398  -2.889 -11.623
  579    HG2  ARG  77           2HG      ARG  77  14.300  -4.748 -10.152
  580    HG3  ARG  77           3HG      ARG  77  15.598  -5.592 -10.982
  581    HD2  ARG  77           2HD      ARG  77  16.287  -4.671  -8.785
  582    HD3  ARG  77           3HD      ARG  77  17.267  -4.107 -10.156
  583    HE   ARG  77           HE       ARG  77  15.131  -2.240  -9.500
  584   HH11  ARG  77          1HH1      ARG  77  18.372  -3.265  -8.477
  585   HH12  ARG  77          2HH1      ARG  77  18.762  -1.749  -7.755
  586   HH21  ARG  77          1HH2      ARG  77  15.656  -0.279  -8.577
  587   HH22  ARG  77          2HH2      ARG  77  17.200  -0.003  -7.802
  588    H    ALA  78           H        ALA  78  14.006  -6.901 -12.678
  589    HA   ALA  78           HA       ALA  78  16.472  -7.954 -13.776
  590    HB1  ALA  78           1HB      ALA  78  13.887  -9.302 -12.877
  591    HB2  ALA  78           2HB      ALA  78  15.434 -10.113 -13.193
  592    HB3  ALA  78           3HB      ALA  78  15.296  -8.966 -11.841
  593    H    THR  79           H        THR  79  13.318  -7.221 -15.203
  594    HA   THR  79           HA       THR  79  13.863  -9.100 -17.459
  595    HB   THR  79           HB       THR  79  11.392  -9.173 -17.673
  596    HG1  THR  79           1HG      THR  79  10.173  -8.434 -15.885
  597   HG21  THR  79          1HG2      THR  79  12.351 -10.008 -14.896
  598   HG22  THR  79          2HG2      THR  79  10.894 -10.596 -15.719
  599   HG23  THR  79          3HG2      THR  79  12.486 -10.984 -16.377
  600    H    GLN  80           H        GLN  80  13.352  -5.770 -16.618
  601    HA   GLN  80           HA       GLN  80  13.192  -5.007 -19.480
  602    HB2  GLN  80           2HB      GLN  80  11.472  -3.797 -17.283
  603    HB3  GLN  80           3HB      GLN  80  11.460  -3.382 -19.005
  604    HG2  GLN  80           2HG      GLN  80  10.724  -5.796 -19.447
  605    HG3  GLN  80           3HG      GLN  80  10.491  -5.942 -17.702
  606   HE21  GLN  80          2HE2      GLN  80   9.371  -3.190 -17.332
  607   HE22  GLN  80          1HE2      GLN  80   7.773  -3.254 -18.066
  608    H    ALA  81           H        ALA  81  13.478  -2.513 -19.574
  609    HA   ALA  81           HA       ALA  81  15.310  -1.410 -17.543
  610    HB1  ALA  81           1HB      ALA  81  15.962  -1.701 -20.510
  611    HB2  ALA  81           2HB      ALA  81  16.927  -0.797 -19.323
  612    HB3  ALA  81           3HB      ALA  81  16.769  -2.555 -19.171
  613    H    ALA  82           H        ALA  82  15.740   0.931 -18.018
  614    HA   ALA  82           HA       ALA  82  13.686   2.302 -19.650
  615    HB1  ALA  82           1HB      ALA  82  14.090   2.739 -16.658
  616    HB2  ALA  82           2HB      ALA  82  13.078   3.744 -17.712
  617    HB3  ALA  82           3HB      ALA  82  12.641   2.044 -17.429
  618    HA   PRO  83           HA       PRO  83  17.202   5.028 -20.161
  619    HB2  PRO  83           2HB      PRO  83  15.998   7.359 -20.987
  620    HB3  PRO  83           3HB      PRO  83  16.116   5.911 -22.027
  621    HG2  PRO  83           2HG      PRO  83  13.786   6.838 -20.307
  622    HG3  PRO  83           3HG      PRO  83  13.731   6.261 -21.997
  623    HD2  PRO  83           2HD      PRO  83  13.165   4.624 -19.845
  624    HD3  PRO  83           3HD      PRO  83  13.949   4.001 -21.325
  625    H    GLU  84           H        GLU  84  18.073   7.141 -19.312
  626    HA   GLU  84           HA       GLU  84  17.504   7.736 -16.600
  627    HB2  GLU  84           2HB      GLU  84  19.628   8.228 -17.824
  628    HB3  GLU  84           3HB      GLU  84  18.783   9.493 -18.736
  629    HG2  GLU  84           2HG      GLU  84  18.362  10.742 -16.671
  630    HG3  GLU  84           3HG      GLU  84  19.099   9.468 -15.702
  631    H    LYS  85           H        LYS  85  16.350   9.455 -15.659
  632    HA   LYS  85           HA       LYS  85  14.600  11.112 -17.416
  633    HB2  LYS  85           2HB      LYS  85  13.871   9.781 -14.771
  634    HB3  LYS  85           3HB      LYS  85  12.898  11.023 -15.579
  635    HG2  LYS  85           2HG      LYS  85  12.660   9.526 -17.566
  636    HG3  LYS  85           3HG      LYS  85  13.582   8.270 -16.713
  637    HD2  LYS  85           2HD      LYS  85  11.872   8.222 -14.920
  638    HD3  LYS  85           3HD      LYS  85  10.943   9.478 -15.776
  639    HE2  LYS  85           2HE      LYS  85  10.703   7.959 -17.727
  640    HE3  LYS  85           3HE      LYS  85  11.620   6.705 -16.860
  641    HZ1  LYS  85           3HZ      LYS  85   9.877   6.688 -15.180
  642    HZ2  LYS  85           1HZ      LYS  85   9.029   7.826 -15.994
  643    HZ3  LYS  85           2HZ      LYS  85   9.222   6.357 -16.643
  644    H    LYS  86           H        LYS  86  15.062  13.227 -17.087
  645    HA   LYS  86           HA       LYS  86  16.986  13.879 -14.941
  646    HB2  LYS  86           2HB      LYS  86  16.111  15.587 -17.292
  647    HB3  LYS  86           3HB      LYS  86  17.524  15.817 -16.249
  648    HG2  LYS  86           2HG      LYS  86  18.360  13.535 -17.090
  649    HG3  LYS  86           3HG      LYS  86  17.054  13.601 -18.283
  650    HD2  LYS  86           2HD      LYS  86  18.856  14.446 -19.495
  651    HD3  LYS  86           3HD      LYS  86  18.036  15.912 -18.947
  652    HE2  LYS  86           2HE      LYS  86  20.264  16.403 -18.461
  653    HE3  LYS  86           3HE      LYS  86  19.667  15.798 -16.903
  654    HZ1  LYS  86           3HZ      LYS  86  20.652  13.614 -17.466
  655    HZ2  LYS  86           1HZ      LYS  86  21.189  14.202 -18.873
  656    HZ3  LYS  86           2HZ      LYS  86  21.787  14.805 -17.473
  657    H    GLU  87           H        GLU  87  13.654  14.099 -15.270
  658    HA   GLU  87           HA       GLU  87  13.052  16.557 -14.001
  659    HB2  GLU  87           2HB      GLU  87  11.537  14.955 -15.235
  660    HB3  GLU  87           3HB      GLU  87  11.589  13.890 -13.821
  661    HG2  GLU  87           2HG      GLU  87  10.452  15.545 -12.463
  662    HG3  GLU  87           3HG      GLU  87  10.652  16.784 -13.702
  663    H    SER  88           H        SER  88  12.392  16.924 -11.776
  664    HA   SER  88           HA       SER  88  14.090  15.970  -9.730
  665    HB2  SER  88           2HB      SER  88  11.318  17.175  -9.419
  666    HB3  SER  88           3HB      SER  88  12.673  17.256  -8.274
  667    HG   SER  88           HG       SER  88  12.441  19.183  -9.528
  668    H    LYS  89           H        LYS  89  13.402  14.850  -7.721
  669    HA   LYS  89           HA       LYS  89  11.260  12.818  -8.075
  670    HB2  LYS  89           2HB      LYS  89  14.096  12.336  -7.046
  671    HB3  LYS  89           3HB      LYS  89  12.768  11.192  -6.913
  672    HG2  LYS  89           2HG      LYS  89  13.698  10.321  -8.784
  673    HG3  LYS  89           3HG      LYS  89  12.668  11.519  -9.571
  674    HD2  LYS  89           2HD      LYS  89  14.633  13.093  -9.626
  675    HD3  LYS  89           3HD      LYS  89  15.643  11.810  -8.939
  676    HE2  LYS  89           2HE      LYS  89  15.325  10.407 -10.860
  677    HE3  LYS  89           3HE      LYS  89  14.026  11.452 -11.487
  678    HZ1  LYS  89           3HZ      LYS  89  15.617  13.174 -11.838
  679    HZ2  LYS  89           1HZ      LYS  89  16.864  12.241 -11.263
  680    HZ3  LYS  89           2HZ      LYS  89  16.075  11.834 -12.666
  681    HA   PRO  90           HA       PRO  90  10.415  14.138  -3.854
  682    HB2  PRO  90           2HB      PRO  90   9.186  11.907  -2.800
  683    HB3  PRO  90           3HB      PRO  90   8.377  13.016  -3.943
  684    HG2  PRO  90           2HG      PRO  90   9.760  10.368  -4.495
  685    HG3  PRO  90           3HG      PRO  90   8.189  10.929  -5.131
  686    HD2  PRO  90           2HD      PRO  90  10.536  11.112  -6.573
  687    HD3  PRO  90           3HD      PRO  90   9.238  12.332  -6.725
  688    H    ARG  91           H        ARG  91  11.050  13.546  -1.595
  689    HA   ARG  91           HA       ARG  91  13.667  12.532  -1.360
  690    HB2  ARG  91           2HB      ARG  91  13.372  12.618   1.023
  691    HB3  ARG  91           3HB      ARG  91  12.611  14.031   0.281
  692    HG2  ARG  91           2HG      ARG  91  10.376  12.902   0.516
  693    HG3  ARG  91           3HG      ARG  91  11.168  11.560   1.355
  694    HD2  ARG  91           2HD      ARG  91  11.215  14.462   2.280
  695    HD3  ARG  91           3HD      ARG  91  10.100  13.227   2.892
  696    HE   ARG  91           HE       ARG  91  12.606  12.121   3.241
  697   HH11  ARG  91          1HH1      ARG  91  11.018  15.090   4.364
  698   HH12  ARG  91          2HH1      ARG  91  11.932  15.195   5.826
  699   HH21  ARG  91          1HH2      ARG  91  13.821  12.271   5.190
  700   HH22  ARG  91          2HH2      ARG  91  13.549  13.564   6.297
  701    H    LYS  92           H        LYS  92  10.641  10.743  -1.144
  702    HA   LYS  92           HA       LYS  92  12.100   8.305  -1.754
  703    HB2  LYS  92           2HB      LYS  92  11.983   8.489   0.794
  704    HB3  LYS  92           3HB      LYS  92  10.220   8.384   0.648
  705    HG2  LYS  92           2HG      LYS  92  10.418   6.150  -0.372
  706    HG3  LYS  92           3HG      LYS  92  12.193   6.282  -0.364
  707    HD2  LYS  92           2HD      LYS  92  12.126   6.459   2.139
  708    HD3  LYS  92           3HD      LYS  92  10.372   6.238   2.076
  709    HE2  LYS  92           2HE      LYS  92  11.298   4.108   2.614
  710    HE3  LYS  92           3HE      LYS  92  10.755   4.020   0.923
  711    HZ1  LYS  92           3HZ      LYS  92  13.062   4.354   0.255
  712    HZ2  LYS  92           1HZ      LYS  92  13.546   4.430   1.819
  713    HZ3  LYS  92           2HZ      LYS  92  12.936   3.038   1.217
  714    HA   PRO  93           HA       PRO  93   8.396   8.131  -4.305
  715    HB2  PRO  93           2HB      PRO  93   8.494   5.158  -3.816
  716    HB3  PRO  93           3HB      PRO  93   8.229   6.048  -5.349
  717    HG2  PRO  93           2HG      PRO  93  10.688   5.026  -4.792
  718    HG3  PRO  93           3HG      PRO  93  10.521   6.653  -5.513
  719    HD2  PRO  93           2HD      PRO  93  11.070   5.927  -2.630
  720    HD3  PRO  93           3HD      PRO  93  11.748   7.264  -3.606
  721    H    LYS  94           H        LYS  94   8.373   6.320  -1.227
  722    HA   LYS  94           HA       LYS  94   5.588   5.995  -0.917
  723    HB2  LYS  94           2HB      LYS  94   7.772   6.413   1.158
  724    HB3  LYS  94           3HB      LYS  94   6.096   5.996   1.556
  725    HG2  LYS  94           2HG      LYS  94   6.321   3.936   0.106
  726    HG3  LYS  94           3HG      LYS  94   8.046   4.315  -0.080
  727    HD2  LYS  94           2HD      LYS  94   8.359   4.163   2.369
  728    HD3  LYS  94           3HD      LYS  94   6.623   3.838   2.579
  729    HE2  LYS  94           2HE      LYS  94   6.855   1.786   1.178
  730    HE3  LYS  94           3HE      LYS  94   8.591   2.092   1.032
  731    HZ1  LYS  94           3HZ      LYS  94   8.755   1.851   3.445
  732    HZ2  LYS  94           1HZ      LYS  94   7.145   1.563   3.559
  733    HZ3  LYS  94           2HZ      LYS  94   8.109   0.500   2.773
  734    H    ALA  95           H        ALA  95   7.312   9.029  -0.849
  735    HA   ALA  95           HA       ALA  95   5.492  10.563   0.659
  736    HB1  ALA  95           1HB      ALA  95   7.027  11.324  -1.861
  737    HB2  ALA  95           2HB      ALA  95   6.325  12.453  -0.685
  738    HB3  ALA  95           3HB      ALA  95   7.666  11.390  -0.197
  739    H    ALA  96           H        ALA  96   4.992   9.034  -2.476
  740    HA   ALA  96           HA       ALA  96   2.706  10.597  -3.262
  741    HB1  ALA  96           1HB      ALA  96   3.615   7.798  -4.062
  742    HB2  ALA  96           2HB      ALA  96   2.424   8.792  -4.925
  743    HB3  ALA  96           3HB      ALA  96   4.113   9.315  -4.841
  744    H    GLN  97           H        GLN  97   2.342   9.989  -0.555
  745    HA   GLN  97           HA       GLN  97  -0.245   8.577  -0.576
  746    HB2  GLN  97           2HB      GLN  97   2.035   7.980   1.346
  747    HB3  GLN  97           3HB      GLN  97   0.368   7.466   1.600
  748    HG2  GLN  97           2HG      GLN  97   2.054   6.608  -0.770
  749    HG3  GLN  97           3HG      GLN  97   1.887   5.684   0.710
  750   HE21  GLN  97          2HE2      GLN  97   0.482   6.300  -2.374
  751   HE22  GLN  97          1HE2      GLN  97  -1.004   5.381  -2.125
  752    H    VAL  98           H        VAL  98  -1.117   8.952   1.872
  753    HA   VAL  98           HA       VAL  98  -0.354  11.648   2.894
  754    HB   VAL  98           HB       VAL  98  -2.758  12.043   3.346
  755   HG11  VAL  98          1HG1      VAL  98  -2.157  11.490   0.405
  756   HG12  VAL  98          2HG1      VAL  98  -3.463  12.512   1.017
  757   HG13  VAL  98          3HG1      VAL  98  -1.773  12.976   1.290
  758   HG21  VAL  98          3HG2      VAL  98  -3.304   9.543   1.701
  759   HG22  VAL  98          1HG2      VAL  98  -3.625   9.759   3.433
  760   HG23  VAL  98          2HG2      VAL  98  -4.504  10.727   2.249
  761    H    SER  99           H        SER  99  -2.007  11.572   5.161
  762    HA   SER  99           HA       SER  99  -0.479  10.071   7.004
  763    HB2  SER  99           2HB      SER  99  -3.292  11.121   7.422
  764    HB3  SER  99           3HB      SER  99  -1.996  10.948   8.624
  765    HG   SER  99           HG       SER  99  -2.240  13.123   7.893
  766    H    GLU 100           H        GLU 100  -2.611   8.737   4.863
  767    HA   GLU 100           HA       GLU 100  -2.826   6.205   6.307
  768    HB2  GLU 100           2HB      GLU 100  -4.870   7.471   6.907
  769    HB3  GLU 100           3HB      GLU 100  -5.198   7.759   5.199
  770    HG2  GLU 100           2HG      GLU 100  -6.625   5.986   6.174
  771    HG3  GLU 100           3HG      GLU 100  -5.668   5.423   4.819
  772    H    GLU 101           H        GLU 101  -3.467   4.507   4.579
  773    HA   GLU 101           HA       GLU 101  -2.135   4.748   2.125
  774    HB2  GLU 101           2HB      GLU 101  -2.915   2.633   3.139
  775    HB3  GLU 101           3HB      GLU 101  -4.595   3.088   2.791
  776    HG2  GLU 101           2HG      GLU 101  -4.058   3.113   0.352
  777    HG3  GLU 101           3HG      GLU 101  -2.395   2.663   0.724
  778    H    ALA 102           H        ALA 102  -2.559   5.739   0.254
  779    HA   ALA 102           HA       ALA 102  -4.726   7.650   0.145
  780    HB1  ALA 102           1HB      ALA 102  -2.624   6.902  -1.933
  781    HB2  ALA 102           2HB      ALA 102  -3.630   8.363  -1.952
  782    HB3  ALA 102           3HB      ALA 102  -2.441   8.136  -0.660
  783    H    SER 103           H        SER 103  -5.397   4.640  -0.083
  784    HA   SER 103           HA       SER 103  -6.519   3.130  -1.369
  785    HB2  SER 103           2HB      SER 103  -8.070   5.581  -2.279
  786    HB3  SER 103           3HB      SER 103  -8.629   3.899  -2.295
  787    HG   SER 103           HG       SER 103  -9.382   5.067  -0.460
  788    H    THR 104           H        THR 104  -4.119   3.777  -2.432
  789    HA   THR 104           HA       THR 104  -3.993   4.752  -5.018
  790    HB   THR 104           HB       THR 104  -2.070   2.603  -4.395
  791    HG1  THR 104           1HG      THR 104  -1.182   3.617  -2.626
  792   HG21  THR 104          1HG2      THR 104  -1.765   5.615  -4.745
  793   HG22  THR 104          2HG2      THR 104  -0.432   4.434  -4.712
  794   HG23  THR 104          3HG2      THR 104  -1.614   4.406  -6.032
  795    HA   PRO 105           HA       PRO 105  -4.352   0.310  -6.843
  796    HB2  PRO 105           2HB      PRO 105  -6.421  -0.831  -4.976
  797    HB3  PRO 105           3HB      PRO 105  -5.138  -1.675  -5.896
  798    HG2  PRO 105           2HG      PRO 105  -4.811  -1.177  -3.236
  799    HG3  PRO 105           3HG      PRO 105  -3.447  -0.938  -4.370
  800    HD2  PRO 105           2HD      PRO 105  -5.332   1.155  -3.234
  801    HD3  PRO 105           3HD      PRO 105  -3.558   1.231  -3.415
  802    H    GLN 106           H        GLN 106  -5.916  -0.215  -8.446
  803    HA   GLN 106           HA       GLN 106  -8.646   0.810  -8.288
  804    HB2  GLN 106           2HB      GLN 106  -8.409   2.139 -10.347
  805    HB3  GLN 106           3HB      GLN 106  -7.464   2.808  -9.018
  806    HG2  GLN 106           2HG      GLN 106  -5.395   2.118  -9.973
  807    HG3  GLN 106           3HG      GLN 106  -6.178   0.986 -11.079
  808   HE21  GLN 106          2HE2      GLN 106  -7.327   1.791 -12.933
  809   HE22  GLN 106          1HE2      GLN 106  -6.962   3.411 -13.542
  810    H    GLY 107           H        GLY 107  -9.837   0.215 -10.314
  811    HA2  GLY 107           2HA      GLY 107  -8.999  -2.378 -11.434
  812    HA3  GLY 107           3HA      GLY 107 -10.522  -1.527 -11.722
  813    H    PHE 108           H        PHE 108  -9.849  -2.322 -13.967
  814    HA   PHE 108           HA       PHE 108  -8.748  -0.026 -15.449
  815    HB2  PHE 108           2HB      PHE 108  -6.807  -1.531 -15.222
  816    HB3  PHE 108           3HB      PHE 108  -7.802  -2.907 -15.702
  817    HD1  PHE 108           HD2      PHE 108  -6.774   0.481 -17.026
  818    HD2  PHE 108           HD1      PHE 108  -7.609  -3.664 -17.880
  819    HE1  PHE 108           HE2      PHE 108  -6.277   0.867 -19.430
  820    HE2  PHE 108           HE1      PHE 108  -7.098  -3.272 -20.279
  821    HZ   PHE 108           HZ       PHE 108  -6.453  -0.999 -21.056
  822    H    ASN 109           H        ASN 109  -9.468  -0.076 -17.689
  823    HA   ASN 109           HA       ASN 109 -12.148  -0.523 -18.176
  824    HB2  ASN 109           2HB      ASN 109 -10.954   0.845 -19.679
  825    HB3  ASN 109           3HB      ASN 109  -9.757  -0.404 -20.051
  826   HD21  ASN 109          2HD2      ASN 109 -10.155  -1.787 -21.811
  827   HD22  ASN 109          1HD2      ASN 109 -11.679  -1.800 -22.672
  828    H    THR 110           H        THR 110  -9.509  -2.760 -18.972
  829    HA   THR 110           HA       THR 110  -9.402  -4.944 -19.510
  830    HB   THR 110           HB       THR 110 -11.973  -5.261 -17.919
  831    HG1  THR 110           1HG      THR 110 -10.547  -5.471 -16.144
  832   HG21  THR 110          1HG2      THR 110  -9.584  -7.117 -18.334
  833   HG22  THR 110          2HG2      THR 110 -11.008  -7.456 -17.321
  834   HG23  THR 110          3HG2      THR 110 -11.187  -7.314 -19.078
  835    H    LEU 111           H        LEU 111 -12.972  -4.828 -19.696
  836    HA   LEU 111           HA       LEU 111 -12.852  -4.983 -22.655
  837    HB2  LEU 111           2HB      LEU 111 -14.097  -7.029 -20.788
  838    HB3  LEU 111           3HB      LEU 111 -14.536  -6.911 -22.488
  839    HG   LEU 111           HG       LEU 111 -11.729  -7.548 -21.492
  840   HD11  LEU 111          1HD1      LEU 111 -13.883  -9.359 -22.663
  841   HD12  LEU 111          2HD1      LEU 111 -12.219  -9.838 -22.270
  842   HD13  LEU 111          3HD1      LEU 111 -13.327  -9.353 -20.979
  843   HD21  LEU 111          3HD2      LEU 111 -12.908  -7.675 -24.300
  844   HD22  LEU 111          1HD2      LEU 111 -11.716  -6.480 -23.722
  845   HD23  LEU 111          2HD2      LEU 111 -11.271  -8.181 -23.814
  846    H    LYS 112           H        LYS 112 -14.051  -3.286 -20.132
  847    HA   LYS 112           HA       LYS 112 -16.864  -3.172 -20.616
  848    HB2  LYS 112           2HB      LYS 112 -14.898  -1.071 -19.605
  849    HB3  LYS 112           3HB      LYS 112 -16.658  -0.856 -19.619
  850    HG2  LYS 112           2HG      LYS 112 -16.967  -2.738 -18.099
  851    HG3  LYS 112           3HG      LYS 112 -15.251  -3.146 -18.182
  852    HD2  LYS 112           2HD      LYS 112 -15.697  -2.023 -16.090
  853    HD3  LYS 112           3HD      LYS 112 -14.648  -1.035 -17.107
  854    HE2  LYS 112           2HE      LYS 112 -16.239   0.428 -16.054
  855    HE3  LYS 112           3HE      LYS 112 -16.625   0.344 -17.778
  856    HZ1  LYS 112           3HZ      LYS 112 -18.376  -1.225 -17.240
  857    HZ2  LYS 112           1HZ      LYS 112 -18.021  -1.134 -15.632
  858    HZ3  LYS 112           2HZ      LYS 112 -18.595   0.184 -16.426
  859    H    ASP 113           H        ASP 113 -14.163  -1.569 -22.217
  860    HA   ASP 113           HA       ASP 113 -15.819  -1.214 -24.638
  861    HB2  ASP 113           2HB      ASP 113 -15.769   0.975 -23.483
  862    HB3  ASP 113           3HB      ASP 113 -14.003   0.922 -23.461
  863    H    LYS 114           H        LYS 114 -14.156  -0.846 -26.535
  864    HA   LYS 114           HA       LYS 114 -11.509  -2.069 -25.981
  865    HB2  LYS 114           2HB      LYS 114 -11.790  -3.772 -27.711
  866    HB3  LYS 114           3HB      LYS 114 -12.957  -3.982 -26.396
  867    HG2  LYS 114           2HG      LYS 114 -14.734  -2.951 -27.791
  868    HG3  LYS 114           3HG      LYS 114 -13.564  -2.692 -29.092
  869    HD2  LYS 114           2HD      LYS 114 -14.878  -4.627 -29.632
  870    HD3  LYS 114           3HD      LYS 114 -13.227  -5.157 -29.261
  871    HE2  LYS 114           2HE      LYS 114 -13.938  -5.828 -26.990
  872    HE3  LYS 114           3HE      LYS 114 -15.576  -5.235 -27.308
  873    HZ1  LYS 114           3HZ      LYS 114 -15.774  -6.913 -29.037
  874    HZ2  LYS 114           1HZ      LYS 114 -14.245  -7.456 -28.741
  875    HZ3  LYS 114           2HZ      LYS 114 -15.420  -7.619 -27.596
  876    H    LEU 115           H        LEU 115 -10.035  -1.915 -27.694
  877    HA   LEU 115           HA       LEU 115 -10.488  -0.042 -29.903
  878    HB2  LEU 115           2HB      LEU 115  -8.588   0.385 -27.570
  879    HB3  LEU 115           3HB      LEU 115  -8.322   1.140 -29.138
  880    HG   LEU 115           HG       LEU 115 -10.813   1.602 -27.448
  881   HD11  LEU 115          1HD1      LEU 115  -8.338   3.333 -27.791
  882   HD12  LEU 115          2HD1      LEU 115  -9.816   3.795 -26.926
  883   HD13  LEU 115          3HD1      LEU 115  -8.816   2.479 -26.313
  884   HD21  LEU 115          3HD2      LEU 115  -9.745   3.084 -29.897
  885   HD22  LEU 115          1HD2      LEU 115 -11.175   2.011 -29.861
  886   HD23  LEU 115          2HD2      LEU 115 -11.186   3.514 -28.945
  887    H    GLU 116           H        GLU 116  -8.394  -0.099 -31.295
  888    HA   GLU 116           HA       GLU 116  -7.340  -2.699 -31.716
  889    HB2  GLU 116           2HB      GLU 116  -7.371  -0.741 -33.309
  890    HB3  GLU 116           3HB      GLU 116  -6.078  -0.007 -32.363
  891    HG2  GLU 116           2HG      GLU 116  -5.096  -1.069 -34.271
  892    HG3  GLU 116           3HG      GLU 116  -4.633  -1.999 -32.854
  893    H    GLU 117           H        GLU 117  -6.037   0.080 -29.879
  894    HA   GLU 117           HA       GLU 117  -4.907  -1.729 -27.892
  895    HB2  GLU 117           2HB      GLU 117  -3.055  -1.340 -29.551
  896    HB3  GLU 117           3HB      GLU 117  -3.183   0.401 -29.236
  897    HG2  GLU 117           2HG      GLU 117  -2.452   0.150 -26.984
  898    HG3  GLU 117           3HG      GLU 117  -2.721  -1.588 -26.986
  899    H    TRP 118           H        TRP 118  -4.902  -0.556 -25.818
  900    HA   TRP 118           HA       TRP 118  -7.086   1.212 -25.680
  901    HB2  TRP 118           2HB      TRP 118  -6.198  -0.324 -23.839
  902    HB3  TRP 118           3HB      TRP 118  -4.952   0.893 -23.558
  903    HD1  TRP 118           HD1      TRP 118  -5.485   2.381 -21.695
  904    HE1  TRP 118           HE1      TRP 118  -7.566   3.431 -20.583
  905    HE3  TRP 118           HE3      TRP 118  -9.094   0.301 -24.667
  906    HZ2  TRP 118           HZ2      TRP 118 -10.421   3.436 -21.034
  907    HZ3  TRP 118           HZ3      TRP 118 -11.459   0.868 -24.347
  908    HH2  TRP 118           HH2      TRP 118 -12.159   2.429 -22.561
  909    H    ILE 119           H        ILE 119  -3.668   2.078 -26.010
  910    HA   ILE 119           HA       ILE 119  -3.904   4.809 -25.253
  911    HB   ILE 119           HB       ILE 119  -1.847   5.170 -26.489
  912   HG12  ILE 119          2HG1      ILE 119  -2.124   2.400 -27.691
  913   HG13  ILE 119          3HG1      ILE 119  -2.458   3.915 -28.542
  914   HG21  ILE 119          1HG2      ILE 119  -1.844   2.443 -25.096
  915   HG22  ILE 119          2HG2      ILE 119  -0.425   3.434 -25.392
  916   HG23  ILE 119          3HG2      ILE 119  -1.672   4.029 -24.310
  917   HD11  ILE 119          3HD1      ILE 119  -0.124   4.656 -28.215
  918   HD12  ILE 119          1HD1      ILE 119   0.248   3.126 -27.393
  919   HD13  ILE 119          2HD1      ILE 119  -0.213   3.114 -29.088
  920    H    GLU 120           H        GLU 120  -5.179   3.287 -28.124
  921    HA   GLU 120           HA       GLU 120  -5.155   5.572 -29.809
  922    HB2  GLU 120           2HB      GLU 120  -7.039   3.191 -29.709
  923    HB3  GLU 120           3HB      GLU 120  -6.977   4.361 -31.027
  924    HG2  GLU 120           2HG      GLU 120  -4.648   2.605 -30.154
  925    HG3  GLU 120           3HG      GLU 120  -5.721   2.248 -31.495
  926    H    MET 121           H        MET 121  -6.999   5.139 -26.926
  927    HA   MET 121           HA       MET 121  -9.194   6.832 -27.450
  928    HB2  MET 121           2HB      MET 121  -9.247   7.229 -25.073
  929    HB3  MET 121           3HB      MET 121  -8.861   5.530 -25.379
  930    HG2  MET 121           2HG      MET 121  -6.444   6.061 -24.999
  931    HG3  MET 121           3HG      MET 121  -6.901   7.713 -24.585
  932    HE1  MET 121           3HE      MET 121  -5.176   5.475 -22.874
  933    HE2  MET 121           1HE      MET 121  -5.336   7.186 -22.403
  934    HE3  MET 121           2HE      MET 121  -5.712   5.900 -21.232
  935    H    SER 122           H        SER 122  -5.804   7.649 -27.264
  936    HA   SER 122           HA       SER 122  -6.466  10.497 -27.814
  937    HB2  SER 122           2HB      SER 122  -4.389   9.601 -25.781
  938    HB3  SER 122           3HB      SER 122  -4.798  11.270 -26.221
  939    HG   SER 122           HG       SER 122  -5.834  10.583 -24.271
  940    H    ASN 123           H        ASN 123  -4.045   7.847 -27.915
  941    HA   ASN 123           HA       ASN 123  -2.067   9.206 -29.450
  942    HB2  ASN 123           2HB      ASN 123  -1.658   7.066 -28.285
  943    HB3  ASN 123           3HB      ASN 123  -2.777   6.245 -29.389
  944   HD21  ASN 123          2HD2      ASN 123  -1.883   5.325 -31.235
  945   HD22  ASN 123          1HD2      ASN 123  -0.308   5.799 -31.863
  946    H    ARG 124           H        ARG 124  -1.733   9.390 -31.623
  947    HA   ARG 124           HA       ARG 124  -3.751   8.432 -33.559
  948    HB2  ARG 124           2HB      ARG 124  -2.977  11.338 -33.048
  949    HB3  ARG 124           3HB      ARG 124  -3.721  10.791 -34.558
  950    HG2  ARG 124           2HG      ARG 124  -5.744  10.089 -33.400
  951    HG3  ARG 124           3HG      ARG 124  -5.020  10.442 -31.821
  952    HD2  ARG 124           2HD      ARG 124  -4.884  12.819 -32.335
  953    HD3  ARG 124           3HD      ARG 124  -5.453  12.529 -33.982
  954    HE   ARG 124           HE       ARG 124  -7.611  12.316 -33.265
  955   HH11  ARG 124          1HH1      ARG 124  -5.552  12.180 -30.344
  956   HH12  ARG 124          2HH1      ARG 124  -6.848  12.557 -29.273
  957   HH21  ARG 124          1HH2      ARG 124  -9.284  12.896 -31.801
  958   HH22  ARG 124          2HH2      ARG 124  -8.988  12.951 -30.103
  959    H    LYS 125           H        LYS 125  -2.864   8.657 -35.794
  960    HA   LYS 125           HA       LYS 125  -0.103   8.017 -36.043
  961    HB2  LYS 125           2HB      LYS 125  -2.070   9.138 -38.095
  962    HB3  LYS 125           3HB      LYS 125  -0.447   8.534 -38.483
  963    HG2  LYS 125           2HG      LYS 125  -1.053   6.295 -37.604
  964    HG3  LYS 125           3HG      LYS 125  -2.669   6.891 -37.196
  965    HD2  LYS 125           2HD      LYS 125  -2.825   5.650 -39.245
  966    HD3  LYS 125           3HD      LYS 125  -3.092   7.367 -39.605
  967    HE2  LYS 125           2HE      LYS 125  -0.761   7.576 -40.401
  968    HE3  LYS 125           3HE      LYS 125  -0.450   5.881 -39.984
  969    HZ1  LYS 125           3HZ      LYS 125  -2.094   5.242 -41.633
  970    HZ2  LYS 125           1HZ      LYS 125  -2.384   6.820 -42.013
  971    HZ3  LYS 125           2HZ      LYS 125  -0.913   6.155 -42.322
  972    H    ASP 126           H        ASP 126   1.698   9.212 -36.649
  973    HA   ASP 126           HA       ASP 126   1.597  12.096 -37.078
  974    HB2  ASP 126           2HB      ASP 126   1.560  11.994 -34.628
  975    HB3  ASP 126           3HB      ASP 126   2.903  10.843 -34.633
  976    H    LEU 127           H        LEU 127   3.611  12.790 -37.993
  977    HA   LEU 127           HA       LEU 127   5.861  10.938 -38.210
  978    HB2  LEU 127           2HB      LEU 127   4.384  10.331 -40.110
  979    HB3  LEU 127           3HB      LEU 127   4.392  12.015 -40.652
  980    HG   LEU 127           HG       LEU 127   6.844  11.856 -41.073
  981   HD11  LEU 127          1HD1      LEU 127   6.504   8.899 -40.403
  982   HD12  LEU 127          2HD1      LEU 127   7.962   9.652 -41.084
  983   HD13  LEU 127          3HD1      LEU 127   7.437  10.064 -39.451
  984   HD21  LEU 127          3HD2      LEU 127   5.181   9.700 -42.428
  985   HD22  LEU 127          1HD2      LEU 127   5.261  11.413 -42.889
  986   HD23  LEU 127          2HD2      LEU 127   6.697  10.383 -43.052
  987    H    ILE 128           H        ILE 128   7.780  12.116 -38.493
  988    HA   ILE 128           HA       ILE 128   7.855  14.886 -37.875
  989    HB   ILE 128           HB       ILE 128  10.265  14.732 -38.402
  990   HG12  ILE 128          2HG1      ILE 128   9.707  11.929 -39.432
  991   HG13  ILE 128          3HG1      ILE 128  10.100  13.341 -40.429
  992   HG21  ILE 128          1HG2      ILE 128   9.185  12.299 -36.885
  993   HG22  ILE 128          2HG2      ILE 128  10.820  12.950 -36.741
  994   HG23  ILE 128          3HG2      ILE 128   9.454  13.918 -36.219
  995   HD11  ILE 128          3HD1      ILE 128  12.306  13.539 -39.321
  996   HD12  ILE 128          1HD1      ILE 128  11.943  12.106 -38.339
  997   HD13  ILE 128          2HD1      ILE 128  12.091  11.948 -40.081
  998    H    LYS 129           H        LYS 129   8.592  16.685 -39.047
  999    HA   LYS 129           HA       LYS 129   8.676  16.575 -41.963
 1000    HB2  LYS 129           2HB      LYS 129   6.236  16.882 -41.233
 1001    HB3  LYS 129           3HB      LYS 129   6.734  18.404 -40.497
 1002    HG2  LYS 129           2HG      LYS 129   5.692  18.776 -42.668
 1003    HG3  LYS 129           3HG      LYS 129   7.371  19.301 -42.680
 1004    HD2  LYS 129           2HD      LYS 129   6.738  18.184 -44.781
 1005    HD3  LYS 129           3HD      LYS 129   8.040  17.328 -43.955
 1006    HE2  LYS 129           2HE      LYS 129   6.435  15.674 -43.069
 1007    HE3  LYS 129           3HE      LYS 129   5.089  16.556 -43.822
 1008    HZ1  LYS 129           3HZ      LYS 129   6.056  16.069 -45.975
 1009    HZ2  LYS 129           1HZ      LYS 129   7.305  15.253 -45.273
 1010    HZ3  LYS 129           2HZ      LYS 129   5.773  14.678 -45.144
 1011    H    LYS 130           H        LYS 130   9.768  18.468 -42.809
 1012    HA   LYS 130           HA       LYS 130  10.564  20.637 -41.075
 1013    HB2  LYS 130           2HB      LYS 130  12.943  20.388 -41.535
 1014    HB3  LYS 130           3HB      LYS 130  12.330  19.037 -40.575
 1015    HG2  LYS 130           2HG      LYS 130  12.272  17.612 -42.620
 1016    HG3  LYS 130           3HG      LYS 130  12.901  18.970 -43.575
 1017    HD2  LYS 130           2HD      LYS 130  14.954  18.996 -42.186
 1018    HD3  LYS 130           3HD      LYS 130  14.322  17.633 -41.229
 1019    HE2  LYS 130           2HE      LYS 130  14.239  16.237 -43.276
 1020    HE3  LYS 130           3HE      LYS 130  14.860  17.596 -44.232
 1021    HZ1  LYS 130           3HZ      LYS 130  16.883  17.507 -42.927
 1022    HZ2  LYS 130           1HZ      LYS 130  16.305  16.247 -42.035
 1023    HZ3  LYS 130           2HZ      LYS 130  16.603  16.052 -43.640
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1   9.881 -28.610   0.886
    2    H2   MET   1           H2       MET   1   8.731 -29.177   1.918
    3    H3   MET   1           H3       MET   1   9.888 -28.018   2.417
    4    HA   MET   1           HA       MET   1   7.354 -27.635   1.423
    5    HB2  MET   1           2HB      MET   1   8.552 -26.351   3.220
    6    HB3  MET   1           3HB      MET   1   9.582 -25.637   1.960
    7    HG2  MET   1           2HG      MET   1   7.595 -24.676   0.876
    8    HG3  MET   1           3HG      MET   1   6.556 -25.403   2.118
    9    HE1  MET   1           3HE      MET   1   6.210 -24.472   4.538
   10    HE2  MET   1           1HE      MET   1   7.909 -24.882   4.869
   11    HE3  MET   1           2HE      MET   1   7.282 -23.279   5.307
   12    H    ALA   2           H        ALA   2   6.555 -26.985  -0.461
   13    HA   ALA   2           HA       ALA   2   8.273 -25.806  -2.581
   14    HB1  ALA   2           1HB      ALA   2   6.501 -28.262  -2.961
   15    HB2  ALA   2           2HB      ALA   2   7.301 -27.346  -4.258
   16    HB3  ALA   2           3HB      ALA   2   8.278 -28.232  -3.068
   17    H    ALA   3           H        ALA   3   6.890 -24.914  -4.298
   18    HA   ALA   3           HA       ALA   3   4.044 -24.361  -3.701
   19    HB1  ALA   3           1HB      ALA   3   6.173 -22.179  -3.861
   20    HB2  ALA   3           2HB      ALA   3   4.414 -21.913  -3.812
   21    HB3  ALA   3           3HB      ALA   3   5.243 -22.622  -2.412
   22    H    LYS   4           H        LYS   4   3.186 -22.919  -5.507
   23    HA   LYS   4           HA       LYS   4   3.692 -24.134  -8.066
   24    HB2  LYS   4           2HB      LYS   4   2.135 -21.672  -7.190
   25    HB3  LYS   4           3HB      LYS   4   2.162 -22.263  -8.867
   26    HG2  LYS   4           2HG      LYS   4   1.088 -24.300  -8.294
   27    HG3  LYS   4           3HG      LYS   4   1.393 -24.072  -6.561
   28    HD2  LYS   4           2HD      LYS   4  -0.959 -23.723  -7.078
   29    HD3  LYS   4           3HD      LYS   4  -0.192 -22.244  -6.467
   30    HE2  LYS   4           2HE      LYS   4  -1.643 -21.560  -8.219
   31    HE3  LYS   4           3HE      LYS   4   0.013 -21.458  -8.852
   32    HZ1  LYS   4           3HZ      LYS   4  -0.363 -23.535 -10.000
   33    HZ2  LYS   4           1HZ      LYS   4  -1.907 -23.623  -9.408
   34    HZ3  LYS   4           2HZ      LYS   4  -1.498 -22.412 -10.448
   35    H    PHE   5           H        PHE   5   5.421 -21.646  -6.534
   36    HA   PHE   5           HA       PHE   5   6.924 -21.049  -9.030
   37    HB2  PHE   5           2HB      PHE   5   5.878 -18.992  -7.027
   38    HB3  PHE   5           3HB      PHE   5   7.087 -18.664  -8.277
   39    HD1  PHE   5           HD2      PHE   5   3.536 -19.594  -7.689
   40    HD2  PHE   5           HD1      PHE   5   6.450 -18.129 -10.509
   41    HE1  PHE   5           HE2      PHE   5   1.725 -19.194  -9.347
   42    HE2  PHE   5           HE1      PHE   5   4.627 -17.671 -12.135
   43    HZ   PHE   5           HZ       PHE   5   2.274 -18.251 -11.584
   44    H    GLU   6           H        GLU   6   9.120 -20.197  -8.434
   45    HA   GLU   6           HA       GLU   6  10.010 -20.569  -5.639
   46    HB2  GLU   6           2HB      GLU   6  10.251 -22.757  -6.864
   47    HB3  GLU   6           3HB      GLU   6  11.343 -21.934  -7.999
   48    HG2  GLU   6           2HG      GLU   6  12.926 -21.465  -6.226
   49    HG3  GLU   6           3HG      GLU   6  11.820 -22.094  -4.989
   50    H    VAL   7           H        VAL   7  11.816 -19.346  -5.198
   51    HA   VAL   7           HA       VAL   7  12.283 -16.905  -6.477
   52    HB   VAL   7           HB       VAL   7  14.294 -16.779  -5.060
   53   HG11  VAL   7          1HG1      VAL   7  11.947 -18.180  -3.684
   54   HG12  VAL   7          2HG1      VAL   7  13.186 -17.202  -2.874
   55   HG13  VAL   7          3HG1      VAL   7  12.070 -16.450  -4.036
   56   HG21  VAL   7          3HG2      VAL   7  13.859 -19.713  -4.417
   57   HG22  VAL   7          1HG2      VAL   7  15.219 -19.028  -5.331
   58   HG23  VAL   7          2HG2      VAL   7  15.007 -18.612  -3.619
   59    H    GLY   8           H        GLY   8  13.405 -16.075  -7.976
   60    HA2  GLY   8           2HA      GLY   8  15.053 -15.847  -9.573
   61    HA3  GLY   8           3HA      GLY   8  15.611 -17.502  -9.247
   62    H    SER   9           H        SER   9  12.492 -18.232  -9.678
   63    HA   SER   9           HA       SER   9  12.607 -18.821 -12.478
   64    HB2  SER   9           2HB      SER   9  10.097 -18.499 -10.808
   65    HB3  SER   9           3HB      SER   9  10.336 -19.504 -12.256
   66    HG   SER   9           HG       SER   9  10.419 -20.729 -10.292
   67    H    VAL  10           H        VAL  10  10.938 -17.996 -14.066
   68    HA   VAL  10           HA       VAL  10  10.329 -15.100 -13.796
   69    HB   VAL  10           HB       VAL  10  11.818 -16.349 -16.145
   70   HG11  VAL  10          1HG1      VAL  10  10.961 -13.458 -15.640
   71   HG12  VAL  10          2HG1      VAL  10  11.933 -14.024 -17.016
   72   HG13  VAL  10          3HG1      VAL  10  10.249 -14.555 -16.844
   73   HG21  VAL  10          3HG2      VAL  10  12.809 -14.305 -14.129
   74   HG22  VAL  10          1HG2      VAL  10  13.359 -15.990 -14.275
   75   HG23  VAL  10          2HG2      VAL  10  13.675 -14.840 -15.586
   76    H    TYR  11           H        TYR  11   8.310 -14.758 -14.429
   77    HA   TYR  11           HA       TYR  11   6.963 -16.577 -16.364
   78    HB2  TYR  11           2HB      TYR  11   6.111 -16.028 -13.503
   79    HB3  TYR  11           3HB      TYR  11   4.984 -16.528 -14.774
   80    HD1  TYR  11           HD2      TYR  11   5.103 -18.778 -15.778
   81    HD2  TYR  11           HD1      TYR  11   7.716 -17.629 -12.549
   82    HE1  TYR  11           HE2      TYR  11   5.603 -21.176 -15.342
   83    HE2  TYR  11           HE1      TYR  11   8.171 -20.027 -12.058
   84    HH   TYR  11           HH       TYR  11   7.783 -22.195 -12.661
   85    H    THR  12           H        THR  12   4.757 -15.649 -16.903
   86    HA   THR  12           HA       THR  12   4.882 -12.664 -16.984
   87    HB   THR  12           HB       THR  12   3.612 -14.509 -19.023
   88    HG1  THR  12           1HG      THR  12   5.522 -14.104 -20.247
   89   HG21  THR  12          1HG2      THR  12   4.550 -11.609 -19.207
   90   HG22  THR  12          2HG2      THR  12   3.824 -12.550 -20.528
   91   HG23  THR  12          3HG2      THR  12   2.859 -12.145 -19.095
   92    H    GLY  13           H        GLY  13   2.991 -11.526 -16.671
   93    HA2  GLY  13           2HA      GLY  13   0.560 -12.895 -15.767
   94    HA3  GLY  13           3HA      GLY  13   1.508 -12.095 -14.494
   95    H    LYS  14           H        LYS  14  -0.739 -10.953 -14.519
   96    HA   LYS  14           HA       LYS  14  -0.488  -8.511 -16.224
   97    HB2  LYS  14           2HB      LYS  14  -2.926 -10.217 -15.682
   98    HB3  LYS  14           3HB      LYS  14  -3.086  -8.479 -16.025
   99    HG2  LYS  14           2HG      LYS  14  -1.835  -8.779 -18.139
  100    HG3  LYS  14           3HG      LYS  14  -1.691 -10.519 -17.806
  101    HD2  LYS  14           2HD      LYS  14  -4.165 -10.728 -17.863
  102    HD3  LYS  14           3HD      LYS  14  -4.299  -8.986 -18.212
  103    HE2  LYS  14           2HE      LYS  14  -2.994  -9.295 -20.286
  104    HE3  LYS  14           3HE      LYS  14  -2.834 -11.030 -19.937
  105    HZ1  LYS  14           3HZ      LYS  14  -5.225 -11.220 -20.113
  106    HZ2  LYS  14           1HZ      LYS  14  -5.373  -9.608 -20.438
  107    HZ3  LYS  14           2HZ      LYS  14  -4.598 -10.600 -21.501
  108    H    VAL  15           H        VAL  15  -0.798  -6.632 -15.324
  109    HA   VAL  15           HA       VAL  15  -0.275  -6.534 -12.473
  110    HB   VAL  15           HB       VAL  15  -0.866  -4.216 -14.337
  111   HG11  VAL  15          1HG1      VAL  15   0.883  -4.496 -11.844
  112   HG12  VAL  15          2HG1      VAL  15   0.669  -3.012 -12.796
  113   HG13  VAL  15          3HG1      VAL  15  -0.703  -3.696 -11.909
  114   HG21  VAL  15          3HG2      VAL  15   1.809  -5.587 -13.954
  115   HG22  VAL  15          1HG2      VAL  15   0.843  -5.563 -15.441
  116   HG23  VAL  15          2HG2      VAL  15   1.524  -4.062 -14.820
  117    H    THR  16           H        THR  16  -1.683  -6.434 -10.911
  118    HA   THR  16           HA       THR  16  -4.564  -5.944 -11.544
  119    HB   THR  16           HB       THR  16  -4.728  -7.303  -9.290
  120    HG1  THR  16           1HG      THR  16  -2.998  -8.792  -9.113
  121   HG21  THR  16          1HG2      THR  16  -3.846  -8.604 -11.908
  122   HG22  THR  16          2HG2      THR  16  -4.729  -9.407 -10.588
  123   HG23  THR  16          3HG2      THR  16  -5.505  -8.106 -11.503
  124    H    GLY  17           H        GLY  17  -1.949  -4.442  -9.858
  125    HA2  GLY  17           2HA      GLY  17  -3.693  -2.223  -9.393
  126    HA3  GLY  17           3HA      GLY  17  -3.332  -3.041  -7.858
  127    H    LEU  18           H        LEU  18  -2.549  -0.420  -8.401
  128    HA   LEU  18           HA       LEU  18   0.410  -0.733  -8.150
  129    HB2  LEU  18           2HB      LEU  18  -1.163   1.648  -9.141
  130    HB3  LEU  18           3HB      LEU  18   0.564   1.676  -8.745
  131    HG   LEU  18           HG       LEU  18  -0.759   0.178 -11.049
  132   HD11  LEU  18          1HD1      LEU  18   1.285   2.437 -10.948
  133   HD12  LEU  18          2HD1      LEU  18   0.673   1.664 -12.425
  134   HD13  LEU  18          3HD1      LEU  18  -0.425   2.607 -11.395
  135   HD21  LEU  18          3HD2      LEU  18   2.173   0.179 -10.284
  136   HD22  LEU  18          1HD2      LEU  18   1.060  -1.206 -10.178
  137   HD23  LEU  18          2HD2      LEU  18   1.465  -0.521 -11.760
  138    H    GLN  19           H        GLN  19   1.320   0.715  -6.609
  139    HA   GLN  19           HA       GLN  19  -0.404   1.814  -4.471
  140    HB2  GLN  19           2HB      GLN  19   1.769  -0.242  -3.987
  141    HB3  GLN  19           3HB      GLN  19   0.832   0.618  -2.751
  142    HG2  GLN  19           2HG      GLN  19  -1.249  -0.591  -3.556
  143    HG3  GLN  19           3HG      GLN  19  -0.217  -1.471  -4.702
  144   HE21  GLN  19          2HE2      GLN  19  -1.361  -1.326  -1.427
  145   HE22  GLN  19          1HE2      GLN  19  -0.371  -2.628  -0.803
  146    H    ALA  20           H        ALA  20   1.029   3.129  -2.977
  147    HA   ALA  20           HA       ALA  20   3.053   4.618  -4.264
  148    HB1  ALA  20           1HB      ALA  20   2.540   4.244  -1.281
  149    HB2  ALA  20           2HB      ALA  20   3.460   5.571  -2.027
  150    HB3  ALA  20           3HB      ALA  20   1.717   5.417  -2.340
  151    H    TYR  21           H        TYR  21   3.352   1.447  -3.066
  152    HA   TYR  21           HA       TYR  21   6.329   1.618  -2.991
  153    HB2  TYR  21           2HB      TYR  21   6.407   0.315  -1.000
  154    HB3  TYR  21           3HB      TYR  21   5.371   1.723  -0.724
  155    HD1  TYR  21           HD2      TYR  21   2.891   1.442  -0.483
  156    HD2  TYR  21           HD1      TYR  21   5.532  -1.943  -0.873
  157    HE1  TYR  21           HE2      TYR  21   1.086  -0.057   0.351
  158    HE2  TYR  21           HE1      TYR  21   3.747  -3.445  -0.010
  159    HH   TYR  21           HH       TYR  21   1.576  -3.579   0.777
  160    H    GLY  22           H        GLY  22   3.929   0.297  -4.818
  161    HA2  GLY  22           2HA      GLY  22   5.677  -1.522  -6.004
  162    HA3  GLY  22           3HA      GLY  22   4.747  -2.442  -4.807
  163    H    ALA  23           H        ALA  23   4.430  -3.381  -7.139
  164    HA   ALA  23           HA       ALA  23   1.752  -2.502  -8.196
  165    HB1  ALA  23           1HB      ALA  23   4.197  -3.405  -9.778
  166    HB2  ALA  23           2HB      ALA  23   2.574  -3.131 -10.443
  167    HB3  ALA  23           3HB      ALA  23   3.504  -1.769  -9.779
  168    H    PHE  24           H        PHE  24   0.339  -4.133  -7.814
  169    HA   PHE  24           HA       PHE  24   1.282  -6.822  -7.209
  170    HB2  PHE  24           2HB      PHE  24  -1.423  -5.519  -7.535
  171    HB3  PHE  24           3HB      PHE  24  -1.284  -7.272  -7.339
  172    HD1  PHE  24           HD1      PHE  24   0.348  -7.969  -5.282
  173    HD2  PHE  24           HD2      PHE  24  -1.926  -4.314  -5.629
  174    HE1  PHE  24           HE1      PHE  24   0.324  -7.743  -2.803
  175    HE2  PHE  24           HE2      PHE  24  -1.958  -4.104  -3.153
  176    HZ   PHE  24           HZ       PHE  24  -0.828  -5.806  -1.738
  177    H    VAL  25           H        VAL  25   1.259  -8.585  -8.585
  178    HA   VAL  25           HA       VAL  25   0.073  -8.292 -11.304
  179    HB   VAL  25           HB       VAL  25   2.829  -9.463 -10.749
  180   HG11  VAL  25          1HG1      VAL  25   1.346  -8.800 -13.333
  181   HG12  VAL  25          2HG1      VAL  25   2.995  -9.452 -13.224
  182   HG13  VAL  25          3HG1      VAL  25   1.618 -10.431 -12.684
  183   HG21  VAL  25          3HG2      VAL  25   2.165  -6.789 -12.024
  184   HG22  VAL  25          1HG2      VAL  25   2.954  -7.031 -10.452
  185   HG23  VAL  25          2HG2      VAL  25   3.775  -7.539 -11.936
  186    H    ALA  26           H        ALA  26  -1.506  -9.715 -11.291
  187    HA   ALA  26           HA       ALA  26  -1.414 -12.251  -9.873
  188    HB1  ALA  26           1HB      ALA  26  -3.195 -11.262 -12.131
  189    HB2  ALA  26           2HB      ALA  26  -3.456 -12.732 -11.160
  190    HB3  ALA  26           3HB      ALA  26  -3.538 -11.138 -10.386
  191    H    LEU  27           H        LEU  27  -1.024 -14.268 -10.682
  192    HA   LEU  27           HA       LEU  27   0.827 -14.290 -13.056
  193    HB2  LEU  27           2HB      LEU  27   0.978 -15.813 -10.458
  194    HB3  LEU  27           3HB      LEU  27   2.155 -15.916 -11.782
  195    HG   LEU  27           HG       LEU  27   1.636 -13.431 -10.086
  196   HD11  LEU  27          1HD1      LEU  27   3.961 -15.400 -10.065
  197   HD12  LEU  27          2HD1      LEU  27   3.860 -13.905  -9.114
  198   HD13  LEU  27          3HD1      LEU  27   2.729 -15.233  -8.796
  199   HD21  LEU  27          3HD2      LEU  27   3.768 -13.934 -12.175
  200   HD22  LEU  27          1HD2      LEU  27   2.380 -12.833 -12.324
  201   HD23  LEU  27          2HD2      LEU  27   3.636 -12.507 -11.119
  202    H    ASP  28           H        ASP  28  -1.672 -15.894 -11.230
  203    HA   ASP  28           HA       ASP  28  -2.208 -17.968 -13.221
  204    HB2  ASP  28           2HB      ASP  28  -0.633 -19.279 -12.367
  205    HB3  ASP  28           3HB      ASP  28  -0.523 -18.445 -10.810
  206    H    GLU  29           H        GLU  29  -4.118 -19.219 -12.461
  207    HA   GLU  29           HA       GLU  29  -6.226 -17.443 -11.850
  208    HB2  GLU  29           2HB      GLU  29  -6.029 -20.466 -11.762
  209    HB3  GLU  29           3HB      GLU  29  -7.553 -19.561 -11.651
  210    HG2  GLU  29           2HG      GLU  29  -5.618 -19.466 -13.991
  211    HG3  GLU  29           3HG      GLU  29  -7.090 -20.451 -13.951
  212    H    GLU  30           H        GLU  30  -4.159 -19.040  -9.587
  213    HA   GLU  30           HA       GLU  30  -5.917 -18.147  -7.334
  214    HB2  GLU  30           2HB      GLU  30  -4.278 -20.689  -7.558
  215    HB3  GLU  30           3HB      GLU  30  -5.129 -20.135  -6.106
  216    HG2  GLU  30           2HG      GLU  30  -6.431 -20.996  -8.733
  217    HG3  GLU  30           3HG      GLU  30  -6.326 -21.903  -7.216
  218    H    THR  31           H        THR  31  -3.187 -17.222  -8.858
  219    HA   THR  31           HA       THR  31  -1.685 -16.723  -6.319
  220    HB   THR  31           HB       THR  31  -0.283 -17.681  -8.821
  221    HG1  THR  31           1HG      THR  31  -0.222 -19.748  -7.883
  222   HG21  THR  31          1HG2      THR  31   0.429 -17.766  -5.855
  223   HG22  THR  31          2HG2      THR  31   1.463 -18.331  -7.183
  224   HG23  THR  31          3HG2      THR  31   1.066 -16.608  -7.044
  225    H    GLN  32           H        GLN  32  -0.593 -14.962  -6.180
  226    HA   GLN  32           HA       GLN  32  -0.182 -13.069  -8.418
  227    HB2  GLN  32           2HB      GLN  32  -2.386 -12.503  -7.671
  228    HB3  GLN  32           3HB      GLN  32  -1.906 -12.625  -5.966
  229    HG2  GLN  32           2HG      GLN  32  -0.702 -10.607  -6.025
  230    HG3  GLN  32           3HG      GLN  32  -0.695 -10.511  -7.791
  231   HE21  GLN  32          2HE2      GLN  32  -1.967  -8.972  -5.213
  232   HE22  GLN  32          1HE2      GLN  32  -3.506  -8.485  -5.873
  233    H    GLY  33           H        GLY  33   1.443 -11.526  -7.877
  234    HA2  GLY  33           2HA      GLY  33   2.679 -11.705  -5.178
  235    HA3  GLY  33           3HA      GLY  33   3.707 -11.871  -6.618
  236    H    LEU  34           H        LEU  34   4.534  -9.909  -5.248
  237    HA   LEU  34           HA       LEU  34   3.256  -7.374  -6.216
  238    HB2  LEU  34           2HB      LEU  34   2.677  -7.725  -3.912
  239    HB3  LEU  34           3HB      LEU  34   4.361  -8.089  -3.478
  240    HG   LEU  34           HG       LEU  34   5.010  -5.760  -4.010
  241   HD11  LEU  34          1HD1      LEU  34   2.025  -5.285  -4.448
  242   HD12  LEU  34          2HD1      LEU  34   3.280  -4.033  -4.396
  243   HD13  LEU  34          3HD1      LEU  34   3.284  -5.223  -5.701
  244   HD21  LEU  34          3HD2      LEU  34   2.662  -5.960  -2.087
  245   HD22  LEU  34          1HD2      LEU  34   4.368  -6.313  -1.716
  246   HD23  LEU  34          2HD2      LEU  34   3.870  -4.656  -2.118
  247    H    VAL  35           H        VAL  35   4.664  -6.541  -7.679
  248    HA   VAL  35           HA       VAL  35   7.549  -6.778  -7.410
  249    HB   VAL  35           HB       VAL  35   5.923  -4.720  -8.965
  250   HG11  VAL  35          1HG1      VAL  35   8.788  -5.730  -9.278
  251   HG12  VAL  35          2HG1      VAL  35   7.985  -4.552 -10.338
  252   HG13  VAL  35          3HG1      VAL  35   8.315  -4.140  -8.646
  253   HG21  VAL  35          3HG2      VAL  35   6.984  -7.382  -9.962
  254   HG22  VAL  35          1HG2      VAL  35   5.272  -6.955  -9.724
  255   HG23  VAL  35          2HG2      VAL  35   6.235  -6.111 -10.949
  256    H    HIS  36           H        HIS  36   8.628  -5.724  -5.694
  257    HA   HIS  36           HA       HIS  36   7.327  -3.507  -4.311
  258    HB2  HIS  36           2HB      HIS  36   9.043  -5.265  -3.344
  259    HB3  HIS  36           3HB      HIS  36  10.270  -4.191  -4.049
  260    HD1  HIS  36           HD1      HIS  36  10.960  -2.221  -2.482
  261    HD2  HIS  36           HD2      HIS  36   7.202  -3.905  -1.543
  262    HE1  HIS  36           HE1      HIS  36  10.193  -1.101  -0.400
  263    H    ILE  37           H        ILE  37   7.875  -1.313  -4.493
  264    HA   ILE  37           HA       ILE  37   8.637  -0.284  -7.029
  265    HB   ILE  37           HB       ILE  37   7.381   0.950  -5.235
  266   HG12  ILE  37          2HG1      ILE  37   9.781   2.472  -6.208
  267   HG13  ILE  37          3HG1      ILE  37   8.434   1.967  -7.251
  268   HG21  ILE  37          1HG2      ILE  37  10.157   1.322  -4.002
  269   HG22  ILE  37          2HG2      ILE  37   8.682   2.159  -3.488
  270   HG23  ILE  37          3HG2      ILE  37   8.814   0.406  -3.277
  271   HD11  ILE  37          3HD1      ILE  37   6.854   3.277  -5.856
  272   HD12  ILE  37          1HD1      ILE  37   8.198   3.793  -4.815
  273   HD13  ILE  37          2HD1      ILE  37   8.145   4.311  -6.510
  274    H    SER  38           H        SER  38  10.796  -1.097  -4.429
  275    HA   SER  38           HA       SER  38  13.202   0.018  -5.424
  276    HB2  SER  38           2HB      SER  38  13.034  -2.665  -4.052
  277    HB3  SER  38           3HB      SER  38  14.242  -1.374  -3.854
  278    HG   SER  38           HG       SER  38  12.767  -1.477  -2.079
  279    H    GLU  39           H        GLU  39  11.332  -2.427  -6.845
  280    HA   GLU  39           HA       GLU  39  13.623  -3.511  -8.435
  281    HB2  GLU  39           2HB      GLU  39  11.111  -4.900  -7.464
  282    HB3  GLU  39           3HB      GLU  39  12.371  -5.610  -8.486
  283    HG2  GLU  39           2HG      GLU  39  12.701  -4.702  -5.600
  284    HG3  GLU  39           3HG      GLU  39  12.566  -6.370  -6.174
  285    H    VAL  40           H        VAL  40  11.087  -1.433  -8.710
  286    HA   VAL  40           HA       VAL  40   9.939  -2.388 -11.244
  287    HB   VAL  40           HB       VAL  40   9.825   0.180  -9.638
  288   HG11  VAL  40          1HG1      VAL  40   8.299  -0.425 -12.211
  289   HG12  VAL  40          2HG1      VAL  40   8.024   0.972 -11.144
  290   HG13  VAL  40          3HG1      VAL  40   9.556   0.811 -12.019
  291   HG21  VAL  40          3HG2      VAL  40   7.761  -1.974 -10.255
  292   HG22  VAL  40          1HG2      VAL  40   8.591  -1.720  -8.707
  293   HG23  VAL  40          2HG2      VAL  40   7.456  -0.501  -9.311
  294    H    THR  41           H        THR  41  12.574  -0.189 -10.305
  295    HA   THR  41           HA       THR  41  13.683  -0.357 -13.034
  296    HB   THR  41           HB       THR  41  12.949   2.296 -11.741
  297    HG1  THR  41           1HG      THR  41  11.476   2.449 -13.516
  298   HG21  THR  41          1HG2      THR  41  14.028   1.701 -14.536
  299   HG22  THR  41          2HG2      THR  41  13.543   3.300 -13.924
  300   HG23  THR  41          3HG2      THR  41  14.936   2.469 -13.211
  301    H    HIS  42           H        HIS  42  15.966  -0.107 -12.921
  302    HA   HIS  42           HA       HIS  42  17.164  -0.267 -10.275
  303    HB2  HIS  42           2HB      HIS  42  17.938  -1.410 -12.480
  304    HB3  HIS  42           3HB      HIS  42  18.665   0.158 -12.884
  305    HD1  HIS  42           HD1      HIS  42  19.731   0.684  -9.794
  306    HD2  HIS  42           HD2      HIS  42  20.305  -2.731 -12.234
  307    HE1  HIS  42           HE1      HIS  42  21.780  -0.451  -8.952
  308    H    GLY  43           H        GLY  43  16.912   2.274 -12.748
  309    HA2  GLY  43           2HA      GLY  43  18.263   4.282 -11.116
  310    HA3  GLY  43           3HA      GLY  43  17.323   4.559 -12.598
  311    H    PHE  44           H        PHE  44  16.934   6.364 -10.654
  312    HA   PHE  44           HA       PHE  44  15.023   5.747  -8.642
  313    HB2  PHE  44           2HB      PHE  44  16.446   7.758  -8.597
  314    HB3  PHE  44           3HB      PHE  44  15.613   8.405 -10.023
  315    HD1  PHE  44           HD2      PHE  44  14.472   6.898  -6.743
  316    HD2  PHE  44           HD1      PHE  44  14.303  10.216  -9.495
  317    HE1  PHE  44           HE2      PHE  44  12.823   8.038  -5.272
  318    HE2  PHE  44           HE1      PHE  44  12.684  11.373  -7.999
  319    HZ   PHE  44           HZ       PHE  44  11.927  10.273  -5.895
  320    H    VAL  45           H        VAL  45  13.215   4.696  -9.179
  321    HA   VAL  45           HA       VAL  45  11.290   5.632 -11.205
  322    HB   VAL  45           HB       VAL  45  11.234   3.335 -10.691
  323   HG11  VAL  45          1HG1      VAL  45  10.957   3.999  -7.725
  324   HG12  VAL  45          2HG1      VAL  45  10.841   2.376  -8.439
  325   HG13  VAL  45          3HG1      VAL  45  12.375   3.254  -8.497
  326   HG21  VAL  45          3HG2      VAL  45   8.885   4.592  -9.324
  327   HG22  VAL  45          1HG2      VAL  45   9.075   4.189 -11.043
  328   HG23  VAL  45          2HG2      VAL  45   9.017   2.895  -9.830
  329    H    LYS  46           H        LYS  46  11.449   7.811 -10.930
  330    HA   LYS  46           HA       LYS  46  10.674   9.163  -8.572
  331    HB2  LYS  46           2HB      LYS  46  10.184  11.084 -10.011
  332    HB3  LYS  46           3HB      LYS  46  11.743  10.323 -10.394
  333    HG2  LYS  46           2HG      LYS  46  10.804   9.264 -12.375
  334    HG3  LYS  46           3HG      LYS  46   9.177   9.844 -11.958
  335    HD2  LYS  46           2HD      LYS  46  10.074  11.226 -13.733
  336    HD3  LYS  46           3HD      LYS  46   9.960  12.187 -12.240
  337    HE2  LYS  46           2HE      LYS  46  12.367  11.881 -11.834
  338    HE3  LYS  46           3HE      LYS  46  12.498  10.858 -13.283
  339    HZ1  LYS  46           3HZ      LYS  46  11.870  12.762 -14.604
  340    HZ2  LYS  46           1HZ      LYS  46  11.748  13.711 -13.261
  341    HZ3  LYS  46           2HZ      LYS  46  13.214  13.110 -13.716
  342    H    ASP  47           H        ASP  47   8.529   7.674 -10.934
  343    HA   ASP  47           HA       ASP  47   6.497   7.655  -8.815
  344    HB2  ASP  47           2HB      ASP  47   5.978   9.717 -10.138
  345    HB3  ASP  47           3HB      ASP  47   5.864   8.701 -11.588
  346    H    ILE  48           H        ILE  48   6.121   5.528  -8.703
  347    HA   ILE  48           HA       ILE  48   6.613   3.524 -10.698
  348    HB   ILE  48           HB       ILE  48   6.414   3.063  -8.294
  349   HG12  ILE  48          2HG1      ILE  48   4.265   1.602  -9.797
  350   HG13  ILE  48          3HG1      ILE  48   6.011   1.339  -9.991
  351   HG21  ILE  48          1HG2      ILE  48   3.444   3.731  -8.605
  352   HG22  ILE  48          2HG2      ILE  48   4.197   3.030  -7.166
  353   HG23  ILE  48          3HG2      ILE  48   4.624   4.665  -7.661
  354   HD11  ILE  48          3HD1      ILE  48   6.190   0.718  -7.597
  355   HD12  ILE  48          1HD1      ILE  48   4.444   0.972  -7.400
  356   HD13  ILE  48          2HD1      ILE  48   5.033  -0.327  -8.449
  357    H    ASN  49           H        ASN  49   3.732   5.514 -10.329
  358    HA   ASN  49           HA       ASN  49   2.178   4.001 -12.218
  359    HB2  ASN  49           2HB      ASN  49   2.004   6.937 -11.480
  360    HB3  ASN  49           3HB      ASN  49   0.744   5.998 -12.295
  361   HD21  ASN  49          2HD2      ASN  49   2.404   6.573  -9.205
  362   HD22  ASN  49          1HD2      ASN  49   1.185   5.770  -8.217
  363    H    GLU  50           H        GLU  50   4.947   5.856 -12.772
  364    HA   GLU  50           HA       GLU  50   4.267   6.196 -15.672
  365    HB2  GLU  50           2HB      GLU  50   6.375   7.553 -13.964
  366    HB3  GLU  50           3HB      GLU  50   6.092   7.838 -15.689
  367    HG2  GLU  50           2HG      GLU  50   4.157   8.481 -13.415
  368    HG3  GLU  50           3HG      GLU  50   5.158   9.616 -14.338
  369    H    HIS  51           H        HIS  51   5.701   4.005 -13.708
  370    HA   HIS  51           HA       HIS  51   7.694   3.150 -15.786
  371    HB2  HIS  51           2HB      HIS  51   7.974   3.062 -12.747
  372    HB3  HIS  51           3HB      HIS  51   9.070   2.271 -13.894
  373    HD1  HIS  51           HD1      HIS  51   7.953   5.868 -12.979
  374    HD2  HIS  51           HD2      HIS  51  11.126   3.730 -14.784
  375    HE1  HIS  51           HE1      HIS  51   9.722   7.533 -13.493
  376    H    LEU  52           H        LEU  52   4.998   2.347 -13.914
  377    HA   LEU  52           HA       LEU  52   4.811  -0.324 -15.175
  378    HB2  LEU  52           2HB      LEU  52   5.547  -0.006 -12.546
  379    HB3  LEU  52           3HB      LEU  52   3.799  -0.224 -12.392
  380    HG   LEU  52           HG       LEU  52   4.986  -2.353 -12.108
  381   HD11  LEU  52          1HD1      LEU  52   3.527  -2.292 -14.787
  382   HD12  LEU  52          2HD1      LEU  52   3.855  -3.740 -13.818
  383   HD13  LEU  52          3HD1      LEU  52   2.772  -2.488 -13.186
  384   HD21  LEU  52          3HD2      LEU  52   6.113  -1.962 -14.878
  385   HD22  LEU  52          1HD2      LEU  52   7.001  -1.945 -13.343
  386   HD23  LEU  52          2HD2      LEU  52   6.220  -3.436 -13.904
  387    H    SER  53           H        SER  53   2.341  -1.016 -14.767
  388    HA   SER  53           HA       SER  53   0.445   1.226 -14.596
  389    HB2  SER  53           2HB      SER  53   1.064  -0.185 -17.223
  390    HB3  SER  53           3HB      SER  53  -0.363   0.836 -16.933
  391    HG   SER  53           HG       SER  53   1.371   1.983 -17.886
  392    H    VAL  54           H        VAL  54  -1.327   0.323 -13.626
  393    HA   VAL  54           HA       VAL  54  -1.922  -2.522 -13.563
  394    HB   VAL  54           HB       VAL  54  -2.629  -0.954 -11.813
  395   HG11  VAL  54          1HG1      VAL  54  -4.517   0.227 -13.903
  396   HG12  VAL  54          2HG1      VAL  54  -4.541   0.591 -12.164
  397   HG13  VAL  54          3HG1      VAL  54  -3.145   1.070 -13.149
  398   HG21  VAL  54          3HG2      VAL  54  -4.941  -2.292 -13.194
  399   HG22  VAL  54          1HG2      VAL  54  -3.836  -2.992 -11.991
  400   HG23  VAL  54          2HG2      VAL  54  -4.936  -1.677 -11.531
  401    H    GLY  55           H        GLY  55  -3.393  -3.745 -14.501
  402    HA2  GLY  55           2HA      GLY  55  -4.791  -4.497 -16.150
  403    HA3  GLY  55           3HA      GLY  55  -5.088  -2.810 -16.629
  404    H    ASP  56           H        ASP  56  -1.846  -4.254 -16.500
  405    HA   ASP  56           HA       ASP  56  -1.781  -4.507 -19.481
  406    HB2  ASP  56           2HB      ASP  56  -0.731  -2.423 -18.699
  407    HB3  ASP  56           3HB      ASP  56   0.410  -3.349 -17.703
  408    H    GLU  57           H        GLU  57  -0.065  -6.016 -20.190
  409    HA   GLU  57           HA       GLU  57   0.349  -8.262 -18.274
  410    HB2  GLU  57           2HB      GLU  57  -0.693  -8.652 -20.503
  411    HB3  GLU  57           3HB      GLU  57   0.796  -8.053 -21.267
  412    HG2  GLU  57           2HG      GLU  57   2.073  -9.898 -20.210
  413    HG3  GLU  57           3HG      GLU  57   0.582 -10.485 -19.445
  414    H    VAL  58           H        VAL  58   2.363  -8.826 -17.586
  415    HA   VAL  58           HA       VAL  58   4.807  -7.451 -18.613
  416    HB   VAL  58           HB       VAL  58   5.455  -6.907 -16.270
  417   HG11  VAL  58          1HG1      VAL  58   2.879  -5.517 -17.149
  418   HG12  VAL  58          2HG1      VAL  58   4.048  -4.883 -15.975
  419   HG13  VAL  58          3HG1      VAL  58   4.520  -5.091 -17.674
  420   HG21  VAL  58          3HG2      VAL  58   2.599  -7.539 -15.516
  421   HG22  VAL  58          1HG2      VAL  58   4.064  -8.408 -15.007
  422   HG23  VAL  58          2HG2      VAL  58   3.806  -6.733 -14.486
  423    H    GLN  59           H        GLN  59   6.687  -8.567 -18.237
  424    HA   GLN  59           HA       GLN  59   6.384 -11.321 -17.149
  425    HB2  GLN  59           2HB      GLN  59   7.222 -10.984 -19.495
  426    HB3  GLN  59           3HB      GLN  59   8.625 -10.132 -18.813
  427    HG2  GLN  59           2HG      GLN  59   9.429 -12.100 -17.732
  428    HG3  GLN  59           3HG      GLN  59   7.895 -12.964 -17.958
  429   HE21  GLN  59          2HE2      GLN  59   7.290 -13.614 -20.147
  430   HE22  GLN  59          1HE2      GLN  59   8.551 -13.898 -21.346
  431    H    VAL  60           H        VAL  60   7.373 -11.858 -15.331
  432    HA   VAL  60           HA       VAL  60   8.904  -9.777 -13.786
  433    HB   VAL  60           HB       VAL  60   7.593 -10.760 -11.814
  434   HG11  VAL  60          1HG1      VAL  60   6.027  -9.163 -13.883
  435   HG12  VAL  60          2HG1      VAL  60   5.633  -9.287 -12.157
  436   HG13  VAL  60          3HG1      VAL  60   7.136  -8.500 -12.658
  437   HG21  VAL  60          3HG2      VAL  60   5.697 -11.729 -13.967
  438   HG22  VAL  60          1HG2      VAL  60   6.633 -12.733 -12.835
  439   HG23  VAL  60          2HG2      VAL  60   5.366 -11.654 -12.228
  440    H    LYS  61           H        LYS  61  10.510 -10.512 -12.481
  441    HA   LYS  61           HA       LYS  61  11.117 -13.430 -12.544
  442    HB2  LYS  61           2HB      LYS  61  12.913 -11.840 -13.069
  443    HB3  LYS  61           3HB      LYS  61  12.666 -11.034 -11.507
  444    HG2  LYS  61           2HG      LYS  61  13.340 -13.062 -10.309
  445    HG3  LYS  61           3HG      LYS  61  13.478 -13.953 -11.841
  446    HD2  LYS  61           2HD      LYS  61  15.286 -12.417 -12.566
  447    HD3  LYS  61           3HD      LYS  61  15.155 -11.543 -11.019
  448    HE2  LYS  61           2HE      LYS  61  15.732 -13.616  -9.802
  449    HE3  LYS  61           3HE      LYS  61  15.861 -14.489 -11.346
  450    HZ1  LYS  61           3HZ      LYS  61  17.675 -13.025 -11.949
  451    HZ2  LYS  61           1HZ      LYS  61  17.557 -12.216 -10.515
  452    HZ3  LYS  61           2HZ      LYS  61  18.014 -13.799 -10.532
  453    H    VAL  62           H        VAL  62  10.719 -14.697 -10.769
  454    HA   VAL  62           HA       VAL  62   9.343 -13.678  -8.452
  455    HB   VAL  62           HB       VAL  62  10.808 -16.323  -8.823
  456   HG11  VAL  62          1HG1      VAL  62   8.566 -15.463  -6.934
  457   HG12  VAL  62          2HG1      VAL  62   9.242 -17.101  -7.057
  458   HG13  VAL  62          3HG1      VAL  62  10.250 -15.766  -6.465
  459   HG21  VAL  62          3HG2      VAL  62   7.883 -15.636  -9.348
  460   HG22  VAL  62          1HG2      VAL  62   9.098 -16.019 -10.587
  461   HG23  VAL  62          2HG2      VAL  62   8.607 -17.260  -9.420
  462    H    LEU  63           H        LEU  63  10.212 -12.396  -7.009
  463    HA   LEU  63           HA       LEU  63  13.126 -12.255  -6.574
  464    HB2  LEU  63           2HB      LEU  63  11.697 -10.266  -6.779
  465    HB3  LEU  63           3HB      LEU  63  10.789 -10.763  -5.340
  466    HG   LEU  63           HG       LEU  63  13.009 -10.640  -4.057
  467   HD11  LEU  63          1HD1      LEU  63  13.824  -9.044  -6.531
  468   HD12  LEU  63          2HD1      LEU  63  14.742  -9.147  -5.011
  469   HD13  LEU  63          3HD1      LEU  63  14.534 -10.595  -6.018
  470   HD21  LEU  63          3HD2      LEU  63  11.818  -8.114  -5.258
  471   HD22  LEU  63          1HD2      LEU  63  11.212  -8.985  -3.836
  472   HD23  LEU  63          2HD2      LEU  63  12.800  -8.186  -3.776
  473    H    ALA  64           H        ALA  64  10.172 -13.147  -4.774
  474    HA   ALA  64           HA       ALA  64  11.660 -14.883  -2.918
  475    HB1  ALA  64           1HB      ALA  64  10.112 -12.470  -1.919
  476    HB2  ALA  64           2HB      ALA  64  10.753 -13.779  -0.912
  477    HB3  ALA  64           3HB      ALA  64  11.869 -12.707  -1.788
  478    H    VAL  65           H        VAL  65  10.194 -16.252  -1.735
  479    HA   VAL  65           HA       VAL  65   7.303 -16.121  -2.478
  480    HB   VAL  65           HB       VAL  65   9.067 -18.606  -2.430
  481   HG11  VAL  65          1HG1      VAL  65   6.086 -18.317  -3.047
  482   HG12  VAL  65          2HG1      VAL  65   7.035 -19.815  -3.189
  483   HG13  VAL  65          3HG1      VAL  65   6.775 -19.078  -1.596
  484   HG21  VAL  65          3HG2      VAL  65   7.642 -17.272  -4.763
  485   HG22  VAL  65          1HG2      VAL  65   9.399 -17.327  -4.496
  486   HG23  VAL  65          2HG2      VAL  65   8.507 -18.825  -4.824
  487    H    ASP  66           H        ASP  66   5.987 -16.466  -0.801
  488    HA   ASP  66           HA       ASP  66   7.037 -17.270   1.865
  489    HB2  ASP  66           2HB      ASP  66   7.249 -14.792   1.757
  490    HB3  ASP  66           3HB      ASP  66   5.555 -14.723   1.235
  491    H    GLU  67           H        GLU  67   5.827 -18.999   0.508
  492    HA   GLU  67           HA       GLU  67   2.978 -19.017   0.307
  493    HB2  GLU  67           2HB      GLU  67   4.538 -20.467  -0.912
  494    HB3  GLU  67           3HB      GLU  67   4.994 -21.253   0.613
  495    HG2  GLU  67           2HG      GLU  67   3.433 -22.649  -0.719
  496    HG3  GLU  67           3HG      GLU  67   2.809 -22.188   0.871
  497    H    GLU  68           H        GLU  68   5.023 -19.382   3.121
  498    HA   GLU  68           HA       GLU  68   3.193 -20.738   4.833
  499    HB2  GLU  68           2HB      GLU  68   5.257 -18.591   5.444
  500    HB3  GLU  68           3HB      GLU  68   4.417 -19.576   6.663
  501    HG2  GLU  68           2HG      GLU  68   5.385 -21.637   5.603
  502    HG3  GLU  68           3HG      GLU  68   6.281 -20.592   4.482
  503    H    LYS  69           H        LYS  69   3.476 -17.247   4.006
  504    HA   LYS  69           HA       LYS  69   0.934 -16.657   5.391
  505    HB2  LYS  69           2HB      LYS  69   2.935 -15.103   5.135
  506    HB3  LYS  69           3HB      LYS  69   2.496 -14.960   3.422
  507    HG2  LYS  69           2HG      LYS  69   0.521 -14.330   5.623
  508    HG3  LYS  69           3HG      LYS  69   1.729 -13.135   5.110
  509    HD2  LYS  69           2HD      LYS  69   0.806 -13.261   2.773
  510    HD3  LYS  69           3HD      LYS  69  -0.465 -14.351   3.370
  511    HE2  LYS  69           2HE      LYS  69  -1.178 -12.605   4.992
  512    HE3  LYS  69           3HE      LYS  69   0.054 -11.509   4.329
  513    HZ1  LYS  69           3HZ      LYS  69  -1.091 -11.613   2.212
  514    HZ2  LYS  69           1HZ      LYS  69  -2.231 -12.630   2.833
  515    HZ3  LYS  69           2HZ      LYS  69  -2.116 -11.083   3.389
  516    H    GLY  70           H        GLY  70   2.171 -17.003   2.094
  517    HA2  GLY  70           2HA      GLY  70   0.791 -18.142   0.407
  518    HA3  GLY  70           3HA      GLY  70  -0.615 -17.263   1.040
  519    H    LYS  71           H        LYS  71   2.666 -15.850   0.483
  520    HA   LYS  71           HA       LYS  71   1.601 -14.392  -1.896
  521    HB2  LYS  71           2HB      LYS  71   2.258 -12.288  -1.086
  522    HB3  LYS  71           3HB      LYS  71   1.288 -13.040   0.195
  523    HG2  LYS  71           2HG      LYS  71   3.307 -13.529   1.502
  524    HG3  LYS  71           3HG      LYS  71   4.343 -12.930   0.184
  525    HD2  LYS  71           2HD      LYS  71   3.172 -10.700   0.404
  526    HD3  LYS  71           3HD      LYS  71   2.379 -11.330   1.863
  527    HE2  LYS  71           2HE      LYS  71   5.395 -11.251   1.532
  528    HE3  LYS  71           3HE      LYS  71   4.475  -9.871   2.171
  529    HZ1  LYS  71           3HZ      LYS  71   3.711 -11.293   3.957
  530    HZ2  LYS  71           1HZ      LYS  71   4.572 -12.581   3.370
  531    HZ3  LYS  71           2HZ      LYS  71   5.354 -11.256   3.930
  532    H    ILE  72           H        ILE  72   3.304 -13.054  -2.909
  533    HA   ILE  72           HA       ILE  72   5.971 -14.380  -3.098
  534    HB   ILE  72           HB       ILE  72   3.909 -14.016  -5.324
  535   HG12  ILE  72          2HG1      ILE  72   5.299 -16.470  -4.254
  536   HG13  ILE  72          3HG1      ILE  72   3.590 -16.032  -4.057
  537   HG21  ILE  72          1HG2      ILE  72   6.838 -14.843  -5.583
  538   HG22  ILE  72          2HG2      ILE  72   5.651 -14.831  -6.903
  539   HG23  ILE  72          3HG2      ILE  72   6.141 -13.315  -6.157
  540   HD11  ILE  72          3HD1      ILE  72   3.235 -16.275  -6.492
  541   HD12  ILE  72          1HD1      ILE  72   4.936 -16.739  -6.697
  542   HD13  ILE  72          2HD1      ILE  72   3.851 -17.782  -5.774
  543    H    SER  73           H        SER  73   7.549 -12.910  -3.628
  544    HA   SER  73           HA       SER  73   6.690 -10.114  -4.256
  545    HB2  SER  73           2HB      SER  73   9.379 -11.015  -3.196
  546    HB3  SER  73           3HB      SER  73   8.767  -9.357  -3.344
  547    HG   SER  73           HG       SER  73   8.600 -10.173  -1.185
  548    H    LEU  74           H        LEU  74   7.890  -9.051  -5.941
  549    HA   LEU  74           HA       LEU  74   9.007 -10.915  -8.001
  550    HB2  LEU  74           2HB      LEU  74   6.831  -8.858  -8.300
  551    HB3  LEU  74           3HB      LEU  74   7.547  -9.762  -9.647
  552    HG   LEU  74           HG       LEU  74   5.955 -11.027  -7.366
  553   HD11  LEU  74          1HD1      LEU  74   5.127 -10.385 -10.227
  554   HD12  LEU  74          2HD1      LEU  74   4.152 -11.282  -9.044
  555   HD13  LEU  74          3HD1      LEU  74   4.533  -9.568  -8.767
  556   HD21  LEU  74          3HD2      LEU  74   6.934 -12.201  -9.985
  557   HD22  LEU  74          1HD2      LEU  74   7.564 -12.562  -8.363
  558   HD23  LEU  74          2HD2      LEU  74   5.908 -13.016  -8.783
  559    H    SER  75           H        SER  75  10.072  -9.746  -9.751
  560    HA   SER  75           HA       SER  75  10.741  -6.888  -9.276
  561    HB2  SER  75           2HB      SER  75  13.131  -7.549  -9.939
  562    HB3  SER  75           3HB      SER  75  12.604  -7.887  -8.277
  563    HG   SER  75           HG       SER  75  13.723  -9.663  -9.218
  564    H    ILE  76           H        ILE  76  11.421  -5.760 -11.037
  565    HA   ILE  76           HA       ILE  76  10.640  -6.812 -13.759
  566    HB   ILE  76           HB       ILE  76   9.719  -4.398 -12.182
  567   HG12  ILE  76          2HG1      ILE  76   8.353  -6.401 -12.148
  568   HG13  ILE  76          3HG1      ILE  76   7.546  -4.962 -12.792
  569   HG21  ILE  76          1HG2      ILE  76   9.615  -4.632 -15.223
  570   HG22  ILE  76          2HG2      ILE  76   8.804  -3.381 -14.250
  571   HG23  ILE  76          3HG2      ILE  76  10.572  -3.456 -14.306
  572   HD11  ILE  76          3HD1      ILE  76   7.821  -5.832 -15.105
  573   HD12  ILE  76          1HD1      ILE  76   8.639  -7.270 -14.455
  574   HD13  ILE  76          2HD1      ILE  76   6.927  -6.967 -14.097
  575    H    ARG  77           H        ARG  77  12.644  -4.398 -11.937
  576    HA   ARG  77           HA       ARG  77  14.188  -3.706 -14.203
  577    HB2  ARG  77           2HB      ARG  77  15.890  -3.026 -12.729
  578    HB3  ARG  77           3HB      ARG  77  14.333  -2.658 -11.961
  579    HG2  ARG  77           2HG      ARG  77  14.598  -4.526 -10.403
  580    HG3  ARG  77           3HG      ARG  77  16.073  -5.065 -11.237
  581    HD2  ARG  77           2HD      ARG  77  17.265  -3.059 -10.597
  582    HD3  ARG  77           3HD      ARG  77  15.780  -2.314  -9.958
  583    HE   ARG  77           HE       ARG  77  15.986  -4.610  -8.500
  584   HH11  ARG  77          1HH2      ARG  77  18.514  -2.212  -9.182
  585   HH12  ARG  77          2HH2      ARG  77  19.174  -2.287  -7.579
  586   HH21  ARG  77          1HH1      ARG  77  16.750  -4.566  -6.380
  587   HH22  ARG  77          2HH1      ARG  77  18.180  -3.635  -5.979
  588    H    ALA  78           H        ALA  78  14.178  -6.710 -12.461
  589    HA   ALA  78           HA       ALA  78  16.477  -7.909 -13.626
  590    HB1  ALA  78           1HB      ALA  78  13.830  -9.164 -12.771
  591    HB2  ALA  78           2HB      ALA  78  15.360 -10.029 -13.036
  592    HB3  ALA  78           3HB      ALA  78  15.224  -8.854 -11.707
  593    H    THR  79           H        THR  79  13.075  -7.724 -14.864
  594    HA   THR  79           HA       THR  79  13.824  -9.386 -17.170
  595    HB   THR  79           HB       THR  79  11.360  -9.148 -17.683
  596    HG1  THR  79           1HG      THR  79  10.086  -8.288 -15.967
  597   HG21  THR  79          1HG2      THR  79  12.057 -10.078 -14.854
  598   HG22  THR  79          2HG2      THR  79  10.611 -10.543 -15.774
  599   HG23  THR  79          3HG2      THR  79  12.212 -11.052 -16.334
  600    H    GLN  80           H        GLN  80  13.049  -5.996 -16.509
  601    HA   GLN  80           HA       GLN  80  13.404  -5.132 -19.279
  602    HB2  GLN  80           2HB      GLN  80  13.329  -3.626 -16.638
  603    HB3  GLN  80           3HB      GLN  80  13.363  -2.866 -18.243
  604    HG2  GLN  80           2HG      GLN  80  11.204  -4.025 -18.792
  605    HG3  GLN  80           3HG      GLN  80  11.173  -4.663 -17.137
  606   HE21  GLN  80          2HE2      GLN  80   8.951  -3.346 -17.692
  607   HE22  GLN  80          1HE2      GLN  80   8.949  -1.719 -17.031
  608    H    ALA  81           H        ALA  81  15.676  -6.533 -17.481
  609    HA   ALA  81           HA       ALA  81  17.819  -4.675 -17.414
  610    HB1  ALA  81           1HB      ALA  81  17.899  -7.718 -17.569
  611    HB2  ALA  81           2HB      ALA  81  19.228  -6.664 -17.034
  612    HB3  ALA  81           3HB      ALA  81  17.731  -6.757 -16.080
  613    H    ALA  82           H        ALA  82  16.425  -6.071 -20.194
  614    HA   ALA  82           HA       ALA  82  18.587  -6.479 -21.932
  615    HB1  ALA  82           1HB      ALA  82  15.865  -5.242 -22.515
  616    HB2  ALA  82           2HB      ALA  82  16.963  -5.946 -23.722
  617    HB3  ALA  82           3HB      ALA  82  16.233  -6.984 -22.477
  618    HA   PRO  83           HA       PRO  83  20.675  -2.704 -22.606
  619    HB2  PRO  83           2HB      PRO  83  20.284  -3.081 -25.574
  620    HB3  PRO  83           3HB      PRO  83  21.775  -2.707 -24.667
  621    HG2  PRO  83           2HG      PRO  83  21.330  -5.258 -25.490
  622    HG3  PRO  83           3HG      PRO  83  22.027  -4.933 -23.879
  623    HD2  PRO  83           2HD      PRO  83  19.146  -5.623 -24.588
  624    HD3  PRO  83           3HD      PRO  83  20.122  -6.167 -23.198
  625    H    GLU  84           H        GLU  84  17.633  -3.062 -24.377
  626    HA   GLU  84           HA       GLU  84  16.882  -0.275 -23.752
  627    HB2  GLU  84           2HB      GLU  84  17.936  -0.199 -25.968
  628    HB3  GLU  84           3HB      GLU  84  16.857  -1.490 -26.529
  629    HG2  GLU  84           2HG      GLU  84  16.196   0.766 -27.339
  630    HG3  GLU  84           3HG      GLU  84  14.936  -0.042 -26.393
  631    H    LYS  85           H        LYS  85  14.640  -0.029 -23.789
  632    HA   LYS  85           HA       LYS  85  12.942  -2.500 -23.703
  633    HB2  LYS  85           2HB      LYS  85  11.729  -1.281 -21.841
  634    HB3  LYS  85           3HB      LYS  85  13.296  -2.023 -21.473
  635    HG2  LYS  85           2HG      LYS  85  13.151   0.080 -20.312
  636    HG3  LYS  85           3HG      LYS  85  14.375   0.201 -21.588
  637    HD2  LYS  85           2HD      LYS  85  12.625   1.350 -23.020
  638    HD3  LYS  85           3HD      LYS  85  11.570   1.373 -21.597
  639    HE2  LYS  85           2HE      LYS  85  12.634   3.533 -21.806
  640    HE3  LYS  85           3HE      LYS  85  13.311   2.700 -20.387
  641    HZ1  LYS  85           3HZ      LYS  85  15.222   2.121 -21.739
  642    HZ2  LYS  85           1HZ      LYS  85  14.604   2.874 -23.049
  643    HZ3  LYS  85           2HZ      LYS  85  15.027   3.753 -21.710
  644    H    LYS  86           H        LYS  86  13.336   0.503 -25.194
  645    HA   LYS  86           HA       LYS  86  10.666   1.147 -25.916
  646    HB2  LYS  86           2HB      LYS  86  12.798   2.413 -26.411
  647    HB3  LYS  86           3HB      LYS  86  13.143   1.211 -27.676
  648    HG2  LYS  86           2HG      LYS  86  11.176   1.864 -28.925
  649    HG3  LYS  86           3HG      LYS  86  10.620   2.907 -27.599
  650    HD2  LYS  86           2HD      LYS  86  11.548   4.294 -29.356
  651    HD3  LYS  86           3HD      LYS  86  12.615   4.358 -27.935
  652    HE2  LYS  86           2HE      LYS  86  14.143   2.737 -28.981
  653    HE3  LYS  86           3HE      LYS  86  13.058   2.599 -30.384
  654    HZ1  LYS  86           3HZ      LYS  86  13.474   4.919 -30.851
  655    HZ2  LYS  86           1HZ      LYS  86  14.480   5.047 -29.549
  656    HZ3  LYS  86           2HZ      LYS  86  14.895   4.084 -30.818
  657    H    GLU  87           H        GLU  87   9.451   0.600 -27.787
  658    HA   GLU  87           HA       GLU  87  10.022  -2.005 -29.111
  659    HB2  GLU  87           2HB      GLU  87   8.621  -2.352 -27.082
  660    HB3  GLU  87           3HB      GLU  87   7.430  -1.211 -27.743
  661    HG2  GLU  87           2HG      GLU  87   6.921  -2.680 -29.577
  662    HG3  GLU  87           3HG      GLU  87   8.273  -3.761 -29.184
  663    H    SER  88           H        SER  88   8.723  -2.239 -31.039
  664    HA   SER  88           HA       SER  88   8.898   0.071 -32.739
  665    HB2  SER  88           2HB      SER  88   7.524  -2.558 -33.351
  666    HB3  SER  88           3HB      SER  88   8.380  -1.471 -34.468
  667    HG   SER  88           HG       SER  88   9.650  -3.322 -33.874
  668    H    LYS  89           H        LYS  89   6.519  -0.225 -30.567
  669    HA   LYS  89           HA       LYS  89   4.709   1.455 -32.201
  670    HB2  LYS  89           2HB      LYS  89   3.837  -0.930 -30.534
  671    HB3  LYS  89           3HB      LYS  89   2.740   0.318 -31.148
  672    HG2  LYS  89           2HG      LYS  89   4.423  -1.532 -32.875
  673    HG3  LYS  89           3HG      LYS  89   2.710  -1.781 -32.498
  674    HD2  LYS  89           2HD      LYS  89   2.050   0.168 -33.718
  675    HD3  LYS  89           3HD      LYS  89   3.722   0.734 -33.870
  676    HE2  LYS  89           2HE      LYS  89   2.595  -1.766 -35.184
  677    HE3  LYS  89           3HE      LYS  89   2.832  -0.201 -35.993
  678    HZ1  LYS  89           3HZ      LYS  89   5.192  -0.407 -35.555
  679    HZ2  LYS  89           1HZ      LYS  89   4.973  -1.850 -34.812
  680    HZ3  LYS  89           2HZ      LYS  89   4.656  -1.706 -36.426
  681    HA   PRO  90           HA       PRO  90   5.039   3.803 -28.503
  682    HB2  PRO  90           2HB      PRO  90   2.760   5.338 -28.516
  683    HB3  PRO  90           3HB      PRO  90   4.112   5.596 -29.649
  684    HG2  PRO  90           2HG      PRO  90   1.500   4.049 -30.072
  685    HG3  PRO  90           3HG      PRO  90   2.271   5.224 -31.174
  686    HD2  PRO  90           2HD      PRO  90   2.621   2.500 -31.481
  687    HD3  PRO  90           3HD      PRO  90   3.927   3.652 -31.864
  688    H    ARG  91           H        ARG  91   3.891   4.351 -26.396
  689    HA   ARG  91           HA       ARG  91   2.591   2.181 -25.089
  690    HB2  ARG  91           2HB      ARG  91   3.776   3.997 -23.943
  691    HB3  ARG  91           3HB      ARG  91   2.564   5.168 -24.510
  692    HG2  ARG  91           2HG      ARG  91   0.827   4.065 -23.161
  693    HG3  ARG  91           3HG      ARG  91   1.989   2.822 -22.642
  694    HD2  ARG  91           2HD      ARG  91   3.304   4.453 -21.426
  695    HD3  ARG  91           3HD      ARG  91   2.382   5.800 -22.122
  696    HE   ARG  91           HE       ARG  91   0.641   5.417 -20.664
  697   HH11  ARG  91          1HH1      ARG  91   3.027   2.807 -20.245
  698   HH12  ARG  91          2HH1      ARG  91   2.360   2.270 -18.753
  699   HH21  ARG  91          1HH2      ARG  91  -0.216   4.659 -18.679
  700   HH22  ARG  91          2HH2      ARG  91   0.507   3.315 -17.857
  701    H    LYS  92           H        LYS  92   1.199   4.907 -26.900
  702    HA   LYS  92           HA       LYS  92  -1.513   4.523 -26.161
  703    HB2  LYS  92           2HB      LYS  92  -0.414   5.448 -28.829
  704    HB3  LYS  92           3HB      LYS  92  -2.063   5.699 -28.228
  705    HG2  LYS  92           2HG      LYS  92   0.495   6.897 -27.113
  706    HG3  LYS  92           3HG      LYS  92  -0.748   7.746 -28.048
  707    HD2  LYS  92           2HD      LYS  92  -1.060   6.580 -25.260
  708    HD3  LYS  92           3HD      LYS  92  -0.872   8.297 -25.657
  709    HE2  LYS  92           2HE      LYS  92  -3.209   6.559 -26.546
  710    HE3  LYS  92           3HE      LYS  92  -3.230   7.610 -25.114
  711    HZ1  LYS  92           3HZ      LYS  92  -2.890   9.495 -26.571
  712    HZ2  LYS  92           1HZ      LYS  92  -2.868   8.518 -27.898
  713    HZ3  LYS  92           2HZ      LYS  92  -4.246   8.672 -27.011
  714    HA   PRO  93           HA       PRO  93  -2.672   0.688 -28.106
  715    HB2  PRO  93           2HB      PRO  93  -5.184   2.178 -28.878
  716    HB3  PRO  93           3HB      PRO  93  -5.011   0.556 -28.154
  717    HG2  PRO  93           2HG      PRO  93  -5.703   2.692 -26.598
  718    HG3  PRO  93           3HG      PRO  93  -4.555   1.471 -25.981
  719    HD2  PRO  93           2HD      PRO  93  -3.944   4.208 -27.176
  720    HD3  PRO  93           3HD      PRO  93  -3.175   3.392 -25.788
  721    H    LYS  94           H        LYS  94  -2.766  -0.234 -30.194
  722    HA   LYS  94           HA       LYS  94  -2.081   1.347 -32.512
  723    HB2  LYS  94           2HB      LYS  94  -3.166  -1.479 -32.202
  724    HB3  LYS  94           3HB      LYS  94  -2.644  -0.773 -33.748
  725    HG2  LYS  94           2HG      LYS  94  -0.368  -0.504 -32.920
  726    HG3  LYS  94           3HG      LYS  94  -0.854  -1.045 -31.300
  727    HD2  LYS  94           2HD      LYS  94   0.301  -2.849 -32.454
  728    HD3  LYS  94           3HD      LYS  94  -1.406  -3.276 -32.200
  729    HE2  LYS  94           2HE      LYS  94  -1.912  -2.659 -34.545
  730    HE3  LYS  94           3HE      LYS  94  -0.209  -2.221 -34.799
  731    HZ1  LYS  94           3HZ      LYS  94   0.375  -4.518 -34.368
  732    HZ2  LYS  94           1HZ      LYS  94  -1.206  -4.919 -34.134
  733    HZ3  LYS  94           2HZ      LYS  94  -0.698  -4.427 -35.619
  734    H    ALA  95           H        ALA  95  -5.151   0.474 -31.065
  735    HA   ALA  95           HA       ALA  95  -6.875   0.860 -33.276
  736    HB1  ALA  95           1HB      ALA  95  -7.360   1.394 -30.312
  737    HB2  ALA  95           2HB      ALA  95  -8.617   1.197 -31.554
  738    HB3  ALA  95           3HB      ALA  95  -7.565  -0.172 -31.135
  739    H    ALA  96           H        ALA  96  -8.342   2.585 -33.654
  740    HA   ALA  96           HA       ALA  96  -7.720   5.347 -32.754
  741    HB1  ALA  96           1HB      ALA  96  -7.767   4.458 -35.673
  742    HB2  ALA  96           2HB      ALA  96  -7.710   6.140 -35.101
  743    HB3  ALA  96           3HB      ALA  96  -6.343   5.050 -34.787
  744    H    GLN  97           H        GLN  97  -9.496   6.831 -33.502
  745    HA   GLN  97           HA       GLN  97 -12.087   5.808 -32.970
  746    HB2  GLN  97           2HB      GLN  97 -11.306   8.199 -32.789
  747    HB3  GLN  97           3HB      GLN  97 -11.367   8.296 -34.563
  748    HG2  GLN  97           2HG      GLN  97 -13.772   7.849 -34.545
  749    HG3  GLN  97           3HG      GLN  97 -13.757   7.613 -32.785
  750   HE21  GLN  97          2HE2      GLN  97 -14.292   9.879 -35.284
  751   HE22  GLN  97          1HE2      GLN  97 -14.237  11.337 -34.283
  752    H    VAL  98           H        VAL  98 -13.712   5.059 -34.197
  753    HA   VAL  98           HA       VAL  98 -13.528   4.908 -37.197
  754    HB   VAL  98           HB       VAL  98 -12.397   2.917 -36.168
  755   HG11  VAL  98          1HG1      VAL  98 -15.170   2.298 -35.045
  756   HG12  VAL  98          2HG1      VAL  98 -13.784   1.188 -35.052
  757   HG13  VAL  98          3HG1      VAL  98 -13.719   2.675 -34.086
  758   HG21  VAL  98          3HG2      VAL  98 -14.924   2.324 -37.688
  759   HG22  VAL  98          1HG2      VAL  98 -13.318   2.711 -38.349
  760   HG23  VAL  98          2HG2      VAL  98 -13.563   1.207 -37.437
  761    H    SER  99           H        SER  99 -15.495   5.230 -34.366
  762    HA   SER  99           HA       SER  99 -18.033   4.682 -35.478
  763    HB2  SER  99           2HB      SER  99 -17.441   6.947 -33.558
  764    HB3  SER  99           3HB      SER  99 -18.880   5.906 -33.640
  765    HG   SER  99           HG       SER  99 -17.446   5.308 -31.919
  766    H    GLU 100           H        GLU 100 -16.031   7.581 -35.738
  767    HA   GLU 100           HA       GLU 100 -17.452   8.318 -38.217
  768    HB2  GLU 100           2HB      GLU 100 -16.846  10.235 -35.947
  769    HB3  GLU 100           3HB      GLU 100 -17.282  10.720 -37.595
  770    HG2  GLU 100           2HG      GLU 100 -19.070   9.221 -35.630
  771    HG3  GLU 100           3HG      GLU 100 -19.138  10.936 -36.066
  772    H    GLU 101           H        GLU 101 -15.836   8.973 -39.716
  773    HA   GLU 101           HA       GLU 101 -13.071   8.435 -39.214
  774    HB2  GLU 101           2HB      GLU 101 -14.324   8.403 -41.401
  775    HB3  GLU 101           3HB      GLU 101 -14.304  10.178 -41.368
  776    HG2  GLU 101           2HG      GLU 101 -12.541   9.423 -42.810
  777    HG3  GLU 101           3HG      GLU 101 -11.794  10.107 -41.356
  778    H    ALA 102           H        ALA 102 -14.924  11.430 -39.161
  779    HA   ALA 102           HA       ALA 102 -13.011  12.672 -37.252
  780    HB1  ALA 102           1HB      ALA 102 -13.977  14.001 -39.823
  781    HB2  ALA 102           2HB      ALA 102 -13.150  14.821 -38.478
  782    HB3  ALA 102           3HB      ALA 102 -12.290  13.588 -39.430
  783    H    SER 103           H        SER 103 -14.154  13.585 -35.657
  784    HA   SER 103           HA       SER 103 -16.931  12.964 -35.411
  785    HB2  SER 103           2HB      SER 103 -15.417  14.977 -33.737
  786    HB3  SER 103           3HB      SER 103 -16.726  13.879 -33.245
  787    HG   SER 103           HG       SER 103 -14.643  13.133 -32.574
  788    H    THR 104           H        THR 104 -18.678  14.386 -34.937
  789    HA   THR 104           HA       THR 104 -19.157  16.324 -36.964
  790    HB   THR 104           HB       THR 104 -21.209  16.754 -35.376
  791    HG1  THR 104           1HG      THR 104 -21.510  14.970 -33.944
  792   HG21  THR 104          1HG2      THR 104 -20.656  13.984 -36.543
  793   HG22  THR 104          2HG2      THR 104 -22.261  14.644 -36.149
  794   HG23  THR 104          3HG2      THR 104 -21.291  15.380 -37.442
  795    HA   PRO 105           HA       PRO 105 -17.938  20.285 -35.352
  796    HB2  PRO 105           2HB      PRO 105 -20.802  21.113 -35.815
  797    HB3  PRO 105           3HB      PRO 105 -19.296  21.958 -36.264
  798    HG2  PRO 105           2HG      PRO 105 -20.712  20.551 -38.137
  799    HG3  PRO 105           3HG      PRO 105 -18.928  20.474 -38.129
  800    HD2  PRO 105           2HD      PRO 105 -20.912  18.456 -36.992
  801    HD3  PRO 105           3HD      PRO 105 -19.398  18.157 -37.889
  802    H    GLN 106           H        GLN 106 -18.067  21.453 -33.464
  803    HA   GLN 106           HA       GLN 106 -18.300  21.717 -31.188
  804    HB2  GLN 106           2HB      GLN 106 -21.254  21.335 -31.783
  805    HB3  GLN 106           3HB      GLN 106 -20.551  22.100 -30.344
  806    HG2  GLN 106           2HG      GLN 106 -19.576  23.889 -31.817
  807    HG3  GLN 106           3HG      GLN 106 -20.395  23.148 -33.206
  808   HE21  GLN 106          2HE2      GLN 106 -20.804  25.128 -30.321
  809   HE22  GLN 106          1HE2      GLN 106 -22.491  25.509 -30.601
  810    H    GLY 107           H        GLY 107 -17.800  19.035 -32.195
  811    HA2  GLY 107           2HA      GLY 107 -18.119  17.626 -29.648
  812    HA3  GLY 107           3HA      GLY 107 -18.953  16.891 -31.035
  813    H    PHE 108           H        PHE 108 -15.938  18.694 -31.349
  814    HA   PHE 108           HA       PHE 108 -14.543  16.693 -32.783
  815    HB2  PHE 108           2HB      PHE 108 -14.015  19.095 -32.872
  816    HB3  PHE 108           3HB      PHE 108 -13.461  19.065 -31.188
  817    HD1  PHE 108           HD1      PHE 108 -12.784  17.591 -34.569
  818    HD2  PHE 108           HD2      PHE 108 -11.220  18.594 -30.672
  819    HE1  PHE 108           HE1      PHE 108 -10.495  16.986 -35.330
  820    HE2  PHE 108           HE2      PHE 108  -8.931  18.002 -31.438
  821    HZ   PHE 108           HZ       PHE 108  -8.564  17.196 -33.767
  822    H    ASN 109           H        ASN 109 -12.831  15.350 -32.277
  823    HA   ASN 109           HA       ASN 109 -12.042  14.968 -29.441
  824    HB2  ASN 109           2HB      ASN 109 -13.716  13.228 -29.784
  825    HB3  ASN 109           3HB      ASN 109 -12.961  12.760 -31.324
  826   HD21  ASN 109          2HD2      ASN 109 -12.248  10.687 -30.897
  827   HD22  ASN 109          1HD2      ASN 109 -11.140  10.298 -29.583
  828    H    THR 110           H        THR 110  -9.872  15.147 -29.435
  829    HA   THR 110           HA       THR 110  -8.258  15.428 -31.757
  830    HB   THR 110           HB       THR 110  -7.264  14.641 -29.007
  831    HG1  THR 110           1HG      THR 110  -7.478  16.876 -28.480
  832   HG21  THR 110          1HG2      THR 110  -6.235  16.621 -31.095
  833   HG22  THR 110          2HG2      THR 110  -5.464  16.265 -29.531
  834   HG23  THR 110          3HG2      THR 110  -5.563  15.005 -30.779
  835    H    LEU 111           H        LEU 111  -7.031  14.113 -32.921
  836    HA   LEU 111           HA       LEU 111  -6.318  11.396 -32.049
  837    HB2  LEU 111           2HB      LEU 111  -8.492  11.074 -33.089
  838    HB3  LEU 111           3HB      LEU 111  -7.975  11.974 -34.531
  839    HG   LEU 111           HG       LEU 111  -6.275  10.207 -34.996
  840   HD11  LEU 111          1HD1      LEU 111  -7.635   8.693 -32.716
  841   HD12  LEU 111          2HD1      LEU 111  -6.417   8.025 -33.828
  842   HD13  LEU 111          3HD1      LEU 111  -5.967   9.311 -32.697
  843   HD21  LEU 111          3HD2      LEU 111  -9.134   9.205 -34.702
  844   HD22  LEU 111          1HD2      LEU 111  -8.477  10.120 -36.076
  845   HD23  LEU 111          2HD2      LEU 111  -7.889   8.479 -35.744
  846    H    LYS 112           H        LYS 112  -4.311  10.909 -32.919
  847    HA   LYS 112           HA       LYS 112  -3.364  12.144 -35.422
  848    HB2  LYS 112           2HB      LYS 112  -2.708  13.731 -33.599
  849    HB3  LYS 112           3HB      LYS 112  -1.828  12.404 -32.807
  850    HG2  LYS 112           2HG      LYS 112  -0.308  12.212 -34.693
  851    HG3  LYS 112           3HG      LYS 112  -1.259  13.384 -35.631
  852    HD2  LYS 112           2HD      LYS 112   0.738  14.475 -34.792
  853    HD3  LYS 112           3HD      LYS 112  -0.689  15.145 -33.969
  854    HE2  LYS 112           2HE      LYS 112  -0.240  13.731 -32.003
  855    HE3  LYS 112           3HE      LYS 112   1.156  13.002 -32.828
  856    HZ1  LYS 112           3HZ      LYS 112   2.190  15.172 -32.851
  857    HZ2  LYS 112           1HZ      LYS 112   0.895  15.847 -32.086
  858    HZ3  LYS 112           2HZ      LYS 112   1.827  14.734 -31.305
  859    H    ASP 113           H        ASP 113  -1.914  10.789 -36.429
  860    HA   ASP 113           HA       ASP 113  -0.545   8.588 -35.057
  861    HB2  ASP 113           2HB      ASP 113  -2.631   7.508 -35.480
  862    HB3  ASP 113           3HB      ASP 113  -2.707   8.109 -37.150
  863    H    LYS 114           H        LYS 114   1.227   7.896 -36.359
  864    HA   LYS 114           HA       LYS 114   1.502   8.914 -39.144
  865    HB2  LYS 114           2HB      LYS 114   3.392   9.367 -36.826
  866    HB3  LYS 114           3HB      LYS 114   4.018   9.262 -38.483
  867    HG2  LYS 114           2HG      LYS 114   1.837  11.195 -37.630
  868    HG3  LYS 114           3HG      LYS 114   3.556  11.609 -37.639
  869    HD2  LYS 114           2HD      LYS 114   3.690  11.677 -39.941
  870    HD3  LYS 114           3HD      LYS 114   2.418  10.470 -40.173
  871    HE2  LYS 114           2HE      LYS 114   1.831  13.261 -39.142
  872    HE3  LYS 114           3HE      LYS 114   1.886  12.882 -40.879
  873    HZ1  LYS 114           3HZ      LYS 114   0.136  11.254 -40.522
  874    HZ2  LYS 114           1HZ      LYS 114   0.086  11.596 -38.918
  875    HZ3  LYS 114           2HZ      LYS 114  -0.355  12.742 -40.019
  876    H    LEU 115           H        LEU 115   1.257   6.166 -37.379
  877    HA   LEU 115           HA       LEU 115   3.224   4.489 -38.537
  878    HB2  LEU 115           2HB      LEU 115   1.599   3.815 -36.841
  879    HB3  LEU 115           3HB      LEU 115   0.282   3.944 -38.026
  880    HG   LEU 115           HG       LEU 115   1.231   2.095 -39.333
  881   HD11  LEU 115          1HD1      LEU 115   3.348   1.887 -37.138
  882   HD12  LEU 115          2HD1      LEU 115   3.114   0.730 -38.476
  883   HD13  LEU 115          3HD1      LEU 115   3.644   2.382 -38.818
  884   HD21  LEU 115          3HD2      LEU 115   0.960   1.447 -36.370
  885   HD22  LEU 115          1HD2      LEU 115  -0.362   1.571 -37.550
  886   HD23  LEU 115          2HD2      LEU 115   0.836   0.268 -37.703
  887    H    GLU 116           H        GLU 116   0.641   6.169 -40.049
  888    HA   GLU 116           HA       GLU 116   0.146   5.176 -42.543
  889    HB2  GLU 116           2HB      GLU 116   1.156   7.955 -41.897
  890    HB3  GLU 116           3HB      GLU 116   0.219   7.480 -43.325
  891    HG2  GLU 116           2HG      GLU 116  -1.692   6.901 -41.891
  892    HG3  GLU 116           3HG      GLU 116  -0.792   7.410 -40.445
  893    H    GLU 117           H        GLU 117   3.335   6.537 -41.536
  894    HA   GLU 117           HA       GLU 117   4.431   6.549 -44.198
  895    HB2  GLU 117           2HB      GLU 117   5.723   6.552 -41.448
  896    HB3  GLU 117           3HB      GLU 117   6.612   6.760 -42.973
  897    HG2  GLU 117           2HG      GLU 117   5.162   8.721 -43.494
  898    HG3  GLU 117           3HG      GLU 117   4.433   8.604 -41.879
  899    H    TRP 118           H        TRP 118   3.812   3.896 -42.117
  900    HA   TRP 118           HA       TRP 118   5.513   2.111 -43.805
  901    HB2  TRP 118           2HB      TRP 118   5.384   1.919 -40.769
  902    HB3  TRP 118           3HB      TRP 118   6.410   1.015 -41.897
  903    HD1  TRP 118           HD1      TRP 118   8.374   2.312 -42.986
  904    HE1  TRP 118           HE1      TRP 118   9.861   4.326 -42.147
  905    HE3  TRP 118           HE3      TRP 118   5.297   4.087 -39.321
  906    HZ2  TRP 118           HZ2      TRP 118   9.634   6.380 -40.176
  907    HZ3  TRP 118           HZ3      TRP 118   5.892   6.013 -37.993
  908    HH2  TRP 118           HH2      TRP 118   8.044   7.223 -38.370
  909    H    ILE 119           H        ILE 119   2.434   2.725 -42.715
  910    HA   ILE 119           HA       ILE 119   1.440   0.237 -41.792
  911    HB   ILE 119           HB       ILE 119   0.246   2.455 -41.729
  912   HG12  ILE 119          2HG1      ILE 119  -2.008   1.688 -42.193
  913   HG13  ILE 119          3HG1      ILE 119  -1.351   0.243 -42.989
  914   HG21  ILE 119          1HG2      ILE 119  -0.310   1.891 -44.684
  915   HG22  ILE 119          2HG2      ILE 119  -1.064   3.176 -43.717
  916   HG23  ILE 119          3HG2      ILE 119   0.675   3.225 -44.049
  917   HD11  ILE 119          3HD1      ILE 119  -0.298  -0.451 -40.843
  918   HD12  ILE 119          1HD1      ILE 119  -0.955   1.002 -40.055
  919   HD13  ILE 119          2HD1      ILE 119  -2.051  -0.257 -40.665
  920    H    GLU 120           H        GLU 120   2.019   1.155 -45.116
  921    HA   GLU 120           HA       GLU 120   2.144  -1.750 -45.706
  922    HB2  GLU 120           2HB      GLU 120  -0.093  -0.654 -46.462
  923    HB3  GLU 120           3HB      GLU 120   0.894   0.191 -47.673
  924    HG2  GLU 120           2HG      GLU 120   1.775  -2.076 -48.412
  925    HG3  GLU 120           3HG      GLU 120   0.629  -2.811 -47.274
  926    H    MET 121           H        MET 121   4.218  -0.348 -44.906
  927    HA   MET 121           HA       MET 121   6.276   0.583 -45.389
  928    HB2  MET 121           2HB      MET 121   5.975  -1.021 -47.949
  929    HB3  MET 121           3HB      MET 121   7.483  -0.382 -47.274
  930    HG2  MET 121           2HG      MET 121   7.500  -2.651 -46.763
  931    HG3  MET 121           3HG      MET 121   7.101  -1.803 -45.258
  932    HE1  MET 121           3HE      MET 121   4.584  -2.682 -48.232
  933    HE2  MET 121           1HE      MET 121   5.681  -4.084 -48.204
  934    HE3  MET 121           2HE      MET 121   3.980  -4.270 -47.714
  935    H    SER 122           H        SER 122   7.072   1.198 -48.309
  936    HA   SER 122           HA       SER 122   5.742   3.805 -48.558
  937    HB2  SER 122           2HB      SER 122   7.718   2.441 -50.414
  938    HB3  SER 122           3HB      SER 122   7.336   4.175 -50.318
  939    HG   SER 122           HG       SER 122   9.292   3.631 -49.202
  940    H    ASN 123           H        ASN 123   4.652   0.750 -49.395
  941    HA   ASN 123           HA       ASN 123   3.925   1.258 -52.178
  942    HB2  ASN 123           2HB      ASN 123   4.437  -1.043 -51.127
  943    HB3  ASN 123           3HB      ASN 123   2.833  -0.924 -50.372
  944   HD21  ASN 123          2HD2      ASN 123   1.128  -1.765 -51.563
  945   HD22  ASN 123          1HD2      ASN 123   1.186  -2.002 -53.306
  946    H    ARG 124           H        ARG 124   2.322   1.821 -49.101
  947    HA   ARG 124           HA       ARG 124  -0.310   2.127 -49.961
  948    HB2  ARG 124           2HB      ARG 124  -0.308   4.165 -48.322
  949    HB3  ARG 124           3HB      ARG 124  -0.212   2.490 -47.752
  950    HG2  ARG 124           2HG      ARG 124   1.268   3.824 -46.420
  951    HG3  ARG 124           3HG      ARG 124   2.235   2.753 -47.448
  952    HD2  ARG 124           2HD      ARG 124   2.601   4.704 -49.019
  953    HD3  ARG 124           3HD      ARG 124   1.768   5.741 -47.839
  954    HE   ARG 124           HE       ARG 124   3.901   4.230 -46.630
  955   HH11  ARG 124          1HH1      ARG 124   3.200   7.248 -48.392
  956   HH12  ARG 124          2HH1      ARG 124   4.715   7.985 -47.956
  957   HH21  ARG 124          1HH2      ARG 124   5.909   5.197 -46.158
  958   HH22  ARG 124          2HH2      ARG 124   6.247   6.823 -46.692
  959    H    LYS 125           H        LYS 125  -1.647   3.772 -50.677
  960    HA   LYS 125           HA       LYS 125  -0.711   4.703 -53.197
  961    HB2  LYS 125           2HB      LYS 125  -3.071   4.128 -52.596
  962    HB3  LYS 125           3HB      LYS 125  -3.153   5.614 -51.623
  963    HG2  LYS 125           2HG      LYS 125  -2.771   6.980 -53.635
  964    HG3  LYS 125           3HG      LYS 125  -2.598   5.510 -54.622
  965    HD2  LYS 125           2HD      LYS 125  -4.940   4.884 -54.105
  966    HD3  LYS 125           3HD      LYS 125  -5.113   6.349 -53.105
  967    HE2  LYS 125           2HE      LYS 125  -4.625   7.754 -55.085
  968    HE3  LYS 125           3HE      LYS 125  -4.461   6.291 -56.082
  969    HZ1  LYS 125           3HZ      LYS 125  -6.766   5.800 -55.625
  970    HZ2  LYS 125           1HZ      LYS 125  -6.918   7.157 -54.698
  971    HZ3  LYS 125           2HZ      LYS 125  -6.632   7.289 -56.317
  972    H    ASP 126           H        ASP 126  -1.251   6.498 -50.173
  973    HA   ASP 126           HA       ASP 126   0.941   8.319 -50.972
  974    HB2  ASP 126           2HB      ASP 126  -1.059   9.550 -51.714
  975    HB3  ASP 126           3HB      ASP 126  -1.815   9.263 -50.134
  976    H    LEU 127           H        LEU 127  -1.564   7.817 -48.447
  977    HA   LEU 127           HA       LEU 127   0.566   7.235 -46.438
  978    HB2  LEU 127           2HB      LEU 127  -1.660   9.260 -46.286
  979    HB3  LEU 127           3HB      LEU 127  -0.933   8.583 -44.822
  980    HG   LEU 127           HG       LEU 127   0.598  10.135 -46.964
  981   HD11  LEU 127          1HD1      LEU 127  -0.334  10.967 -44.179
  982   HD12  LEU 127          2HD1      LEU 127   0.688  11.939 -45.266
  983   HD13  LEU 127          3HD1      LEU 127  -0.989  11.569 -45.720
  984   HD21  LEU 127          3HD2      LEU 127   1.519   9.223 -44.223
  985   HD22  LEU 127          1HD2      LEU 127   2.062   8.566 -45.784
  986   HD23  LEU 127          2HD2      LEU 127   2.428  10.246 -45.357
  987    H    ILE 128           H        ILE 128  -2.391   6.406 -47.838
  988    HA   ILE 128           HA       ILE 128  -2.693   4.028 -46.070
  989    HB   ILE 128           HB       ILE 128  -5.174   4.363 -46.064
  990   HG12  ILE 128          2HG1      ILE 128  -4.666   7.161 -47.039
  991   HG13  ILE 128          3HG1      ILE 128  -5.302   5.821 -48.018
  992   HG21  ILE 128          1HG2      ILE 128  -3.644   6.639 -44.712
  993   HG22  ILE 128          2HG2      ILE 128  -5.265   6.089 -44.271
  994   HG23  ILE 128          3HG2      ILE 128  -3.882   5.009 -44.050
  995   HD11  ILE 128          3HD1      ILE 128  -7.269   5.646 -46.517
  996   HD12  ILE 128          1HD1      ILE 128  -6.646   6.995 -45.542
  997   HD13  ILE 128          2HD1      ILE 128  -7.135   7.275 -47.219
  998    H    LYS 129           H        LYS 129  -4.281   2.480 -47.166
  999    HA   LYS 129           HA       LYS 129  -4.746   2.932 -50.033
 1000    HB2  LYS 129           2HB      LYS 129  -2.418   1.758 -49.605
 1001    HB3  LYS 129           3HB      LYS 129  -3.420   0.340 -49.237
 1002    HG2  LYS 129           2HG      LYS 129  -4.498   0.555 -51.475
 1003    HG3  LYS 129           3HG      LYS 129  -3.453   1.946 -51.825
 1004    HD2  LYS 129           2HD      LYS 129  -2.117   0.425 -52.802
 1005    HD3  LYS 129           3HD      LYS 129  -1.581   0.095 -51.146
 1006    HE2  LYS 129           2HE      LYS 129  -3.716  -1.431 -52.688
 1007    HE3  LYS 129           3HE      LYS 129  -2.045  -1.974 -52.401
 1008    HZ1  LYS 129           3HZ      LYS 129  -2.534  -2.043 -50.044
 1009    HZ2  LYS 129           1HZ      LYS 129  -4.101  -1.554 -50.310
 1010    HZ3  LYS 129           2HZ      LYS 129  -3.592  -2.998 -50.876
 1011    H    LYS 130           H        LYS 130  -6.418   1.424 -50.807
 1012    HA   LYS 130           HA       LYS 130  -8.274   0.387 -48.917
 1013    HB2  LYS 130           2HB      LYS 130  -7.734  -0.398 -51.806
 1014    HB3  LYS 130           3HB      LYS 130  -9.114  -0.972 -50.844
 1015    HG2  LYS 130           2HG      LYS 130  -9.863   1.396 -50.548
 1016    HG3  LYS 130           3HG      LYS 130  -8.521   1.928 -51.587
 1017    HD2  LYS 130           2HD      LYS 130  -9.434   0.594 -53.464
 1018    HD3  LYS 130           3HD      LYS 130 -10.772   0.044 -52.426
 1019    HE2  LYS 130           2HE      LYS 130 -11.498   2.393 -52.125
 1020    HE3  LYS 130           3HE      LYS 130 -10.169   2.935 -53.174
 1021    HZ1  LYS 130           3HZ      LYS 130 -11.171   1.690 -54.976
 1022    HZ2  LYS 130           1HZ      LYS 130 -12.402   1.189 -54.002
 1023    HZ3  LYS 130           2HZ      LYS 130 -12.246   2.784 -54.374
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1  -1.995 -23.187   3.124
    2    H2   MET   1           H2       MET   1  -3.567 -23.171   2.643
    3    H3   MET   1           H3       MET   1  -2.872 -21.854   3.515
    4    HA   MET   1           HA       MET   1  -3.126 -22.216   0.799
    5    HB2  MET   1           2HB      MET   1  -3.347 -20.106   2.142
    6    HB3  MET   1           3HB      MET   1  -1.585 -20.132   2.384
    7    HG2  MET   1           2HG      MET   1  -1.171 -19.842   0.047
    8    HG3  MET   1           3HG      MET   1  -2.878 -20.131  -0.358
    9    HE1  MET   1           3HE      MET   1  -1.040 -17.709  -1.465
   10    HE2  MET   1           1HE      MET   1  -2.722 -17.991  -1.971
   11    HE3  MET   1           2HE      MET   1  -2.217 -16.376  -1.420
   12    H    ALA   2           H        ALA   2  -1.656 -22.267  -0.847
   13    HA   ALA   2           HA       ALA   2   1.223 -22.826  -0.310
   14    HB1  ALA   2           1HB      ALA   2  -0.644 -24.626  -1.918
   15    HB2  ALA   2           2HB      ALA   2   1.127 -24.779  -1.822
   16    HB3  ALA   2           3HB      ALA   2   0.134 -25.046  -0.372
   17    H    ALA   3           H        ALA   3   2.402 -22.834  -2.403
   18    HA   ALA   3           HA       ALA   3   1.170 -21.104  -4.519
   19    HB1  ALA   3           1HB      ALA   3   3.939 -20.808  -3.273
   20    HB2  ALA   3           2HB      ALA   3   3.306 -19.861  -4.638
   21    HB3  ALA   3           3HB      ALA   3   2.566 -19.702  -3.030
   22    H    LYS   4           H        LYS   4   2.746 -21.027  -6.420
   23    HA   LYS   4           HA       LYS   4   3.807 -23.743  -7.115
   24    HB2  LYS   4           2HB      LYS   4   2.510 -23.739  -9.145
   25    HB3  LYS   4           3HB      LYS   4   1.435 -23.594  -7.738
   26    HG2  LYS   4           2HG      LYS   4   1.337 -21.102  -8.174
   27    HG3  LYS   4           3HG      LYS   4   2.242 -21.390  -9.676
   28    HD2  LYS   4           2HD      LYS   4  -0.059 -21.250 -10.305
   29    HD3  LYS   4           3HD      LYS   4   0.373 -22.974 -10.368
   30    HE2  LYS   4           2HE      LYS   4  -0.612 -23.274  -8.096
   31    HE3  LYS   4           3HE      LYS   4  -1.098 -21.564  -8.100
   32    HZ1  LYS   4           3HZ      LYS   4  -2.487 -22.022 -10.007
   33    HZ2  LYS   4           1HZ      LYS   4  -2.035 -23.608  -9.999
   34    HZ3  LYS   4           2HZ      LYS   4  -2.913 -22.994  -8.740
   35    H    PHE   5           H        PHE   5   5.132 -21.272  -6.435
   36    HA   PHE   5           HA       PHE   5   6.848 -20.995  -8.859
   37    HB2  PHE   5           2HB      PHE   5   5.801 -18.705  -7.113
   38    HB3  PHE   5           3HB      PHE   5   7.090 -18.576  -8.324
   39    HD1  PHE   5           HD2      PHE   5   3.474 -18.985  -7.766
   40    HD2  PHE   5           HD1      PHE   5   6.605 -18.510 -10.702
   41    HE1  PHE   5           HE2      PHE   5   1.758 -18.676  -9.550
   42    HE2  PHE   5           HE1      PHE   5   4.886 -18.206 -12.467
   43    HZ   PHE   5           HZ       PHE   5   2.467 -18.355 -11.913
   44    H    GLU   6           H        GLU   6   9.011 -20.224  -8.264
   45    HA   GLU   6           HA       GLU   6   9.814 -20.273  -5.427
   46    HB2  GLU   6           2HB      GLU   6  11.523 -21.912  -5.763
   47    HB3  GLU   6           3HB      GLU   6   9.938 -22.611  -6.157
   48    HG2  GLU   6           2HG      GLU   6  10.440 -22.310  -8.592
   49    HG3  GLU   6           3HG      GLU   6  12.039 -21.673  -8.147
   50    H    VAL   7           H        VAL   7  11.830 -19.284  -5.091
   51    HA   VAL   7           HA       VAL   7  12.249 -16.936  -6.628
   52    HB   VAL   7           HB       VAL   7  14.248 -16.625  -5.209
   53   HG11  VAL   7          1HG1      VAL   7  11.856 -17.787  -3.699
   54   HG12  VAL   7          2HG1      VAL   7  13.095 -16.715  -3.010
   55   HG13  VAL   7          3HG1      VAL   7  12.008 -16.115  -4.284
   56   HG21  VAL   7          3HG2      VAL   7  13.789 -19.424  -4.164
   57   HG22  VAL   7          1HG2      VAL   7  15.168 -18.871  -5.140
   58   HG23  VAL   7          2HG2      VAL   7  14.918 -18.216  -3.507
   59    H    GLY   8           H        GLY   8  13.505 -16.204  -8.044
   60    HA2  GLY   8           2HA      GLY   8  15.236 -16.148  -9.599
   61    HA3  GLY   8           3HA      GLY   8  15.609 -17.852  -9.257
   62    H    SER   9           H        SER   9  12.516 -18.370  -9.655
   63    HA   SER   9           HA       SER   9  12.530 -19.032 -12.433
   64    HB2  SER   9           2HB      SER   9  10.115 -18.525 -10.667
   65    HB3  SER   9           3HB      SER   9  10.204 -19.538 -12.126
   66    HG   SER   9           HG       SER   9  10.321 -20.772 -10.173
   67    H    VAL  10           H        VAL  10  11.127 -18.157 -14.110
   68    HA   VAL  10           HA       VAL  10  10.452 -15.266 -13.865
   69    HB   VAL  10           HB       VAL  10  12.018 -16.527 -16.155
   70   HG11  VAL  10          1HG1      VAL  10  11.140 -13.634 -15.697
   71   HG12  VAL  10          2HG1      VAL  10  12.159 -14.206 -17.037
   72   HG13  VAL  10          3HG1      VAL  10  10.469 -14.738 -16.918
   73   HG21  VAL  10          3HG2      VAL  10  12.930 -14.463 -14.124
   74   HG22  VAL  10          1HG2      VAL  10  13.490 -16.148 -14.234
   75   HG23  VAL  10          2HG2      VAL  10  13.850 -15.006 -15.545
   76    H    TYR  11           H        TYR  11   8.425 -14.989 -14.459
   77    HA   TYR  11           HA       TYR  11   7.176 -16.679 -16.567
   78    HB2  TYR  11           2HB      TYR  11   6.210 -16.364 -13.705
   79    HB3  TYR  11           3HB      TYR  11   5.144 -16.783 -15.060
   80    HD1  TYR  11           HD2      TYR  11   5.391 -18.942 -16.254
   81    HD2  TYR  11           HD1      TYR  11   7.776 -18.007 -12.784
   82    HE1  TYR  11           HE2      TYR  11   5.921 -21.358 -15.980
   83    HE2  TYR  11           HE1      TYR  11   8.260 -20.429 -12.459
   84    HH   TYR  11           HH       TYR  11   7.961 -22.546 -13.252
   85    H    THR  12           H        THR  12   4.908 -15.731 -17.021
   86    HA   THR  12           HA       THR  12   5.093 -12.745 -16.997
   87    HB   THR  12           HB       THR  12   3.781 -14.499 -19.087
   88    HG1  THR  12           1HG      THR  12   5.710 -14.098 -20.303
   89   HG21  THR  12          1HG2      THR  12   4.786 -11.618 -19.191
   90   HG22  THR  12          2HG2      THR  12   4.041 -12.506 -20.539
   91   HG23  THR  12          3HG2      THR  12   3.082 -12.118 -19.095
   92    H    GLY  13           H        GLY  13   3.247 -11.563 -16.693
   93    HA2  GLY  13           2HA      GLY  13   0.815 -12.868 -15.691
   94    HA3  GLY  13           3HA      GLY  13   1.820 -12.054 -14.472
   95    H    LYS  14           H        LYS  14  -0.339 -10.861 -14.383
   96    HA   LYS  14           HA       LYS  14  -0.453  -8.601 -16.361
   97    HB2  LYS  14           2HB      LYS  14  -2.085 -10.619 -16.605
   98    HB3  LYS  14           3HB      LYS  14  -2.873  -9.933 -15.170
   99    HG2  LYS  14           2HG      LYS  14  -2.382  -8.437 -17.756
  100    HG3  LYS  14           3HG      LYS  14  -3.881  -9.316 -17.389
  101    HD2  LYS  14           2HD      LYS  14  -2.796  -6.855 -15.997
  102    HD3  LYS  14           3HD      LYS  14  -4.215  -6.944 -17.056
  103    HE2  LYS  14           2HE      LYS  14  -3.969  -8.346 -14.365
  104    HE3  LYS  14           3HE      LYS  14  -4.757  -6.771 -14.605
  105    HZ1  LYS  14           3HZ      LYS  14  -6.337  -7.853 -16.060
  106    HZ2  LYS  14           1HZ      LYS  14  -5.607  -9.315 -15.839
  107    HZ3  LYS  14           2HZ      LYS  14  -6.353  -8.567 -14.572
  108    H    VAL  15           H        VAL  15  -0.323  -6.692 -15.369
  109    HA   VAL  15           HA       VAL  15  -0.026  -6.502 -12.515
  110    HB   VAL  15           HB       VAL  15  -0.600  -4.196 -14.401
  111   HG11  VAL  15          1HG1      VAL  15   1.127  -4.469 -11.891
  112   HG12  VAL  15          2HG1      VAL  15   0.912  -2.982 -12.842
  113   HG13  VAL  15          3HG1      VAL  15  -0.468  -3.684 -11.971
  114   HG21  VAL  15          3HG2      VAL  15   2.089  -5.535 -14.004
  115   HG22  VAL  15          1HG2      VAL  15   1.132  -5.514 -15.500
  116   HG23  VAL  15          2HG2      VAL  15   1.795  -4.004 -14.858
  117    H    THR  16           H        THR  16  -1.451  -6.337 -10.990
  118    HA   THR  16           HA       THR  16  -4.325  -5.850 -11.678
  119    HB   THR  16           HB       THR  16  -4.527  -7.205  -9.412
  120    HG1  THR  16           1HG      THR  16  -2.841  -8.751  -9.252
  121   HG21  THR  16          1HG2      THR  16  -3.699  -8.525 -12.037
  122   HG22  THR  16          2HG2      THR  16  -4.593  -9.308 -10.713
  123   HG23  THR  16          3HG2      THR  16  -5.342  -7.981 -11.620
  124    H    GLY  17           H        GLY  17  -1.720  -4.392  -9.917
  125    HA2  GLY  17           2HA      GLY  17  -3.426  -2.149  -9.509
  126    HA3  GLY  17           3HA      GLY  17  -3.196  -2.997  -7.964
  127    H    LEU  18           H        LEU  18  -2.327  -0.405  -8.343
  128    HA   LEU  18           HA       LEU  18   0.622  -0.749  -7.980
  129    HB2  LEU  18           2HB      LEU  18  -0.934   1.572  -9.076
  130    HB3  LEU  18           3HB      LEU  18   0.761   1.727  -8.572
  131    HG   LEU  18           HG       LEU  18  -0.282  -0.012 -10.847
  132   HD11  LEU  18          1HD1      LEU  18   1.444   2.501 -10.877
  133   HD12  LEU  18          2HD1      LEU  18   1.004   1.531 -12.300
  134   HD13  LEU  18          3HD1      LEU  18  -0.254   2.404 -11.395
  135   HD21  LEU  18          3HD2      LEU  18   2.557   0.359  -9.937
  136   HD22  LEU  18          1HD2      LEU  18   1.573  -1.117  -9.816
  137   HD23  LEU  18          2HD2      LEU  18   2.024  -0.484 -11.409
  138    H    GLN  19           H        GLN  19   1.465   0.311  -6.250
  139    HA   GLN  19           HA       GLN  19  -0.239   1.796  -4.328
  140    HB2  GLN  19           2HB      GLN  19   1.524  -0.547  -3.560
  141    HB3  GLN  19           3HB      GLN  19   0.568   0.477  -2.468
  142    HG2  GLN  19           2HG      GLN  19  -1.519  -0.381  -3.558
  143    HG3  GLN  19           3HG      GLN  19  -0.540  -1.513  -4.517
  144   HE21  GLN  19          2HE2      GLN  19   0.962  -2.984  -3.189
  145   HE22  GLN  19          1HE2      GLN  19   0.312  -3.582  -1.674
  146    H    ALA  20           H        ALA  20   1.204   2.962  -2.782
  147    HA   ALA  20           HA       ALA  20   3.454   4.140  -3.992
  148    HB1  ALA  20           1HB      ALA  20   2.655   4.116  -1.051
  149    HB2  ALA  20           2HB      ALA  20   3.735   5.295  -1.832
  150    HB3  ALA  20           3HB      ALA  20   2.018   5.223  -2.293
  151    H    TYR  21           H        TYR  21   3.446   1.063  -2.698
  152    HA   TYR  21           HA       TYR  21   6.422   1.063  -2.426
  153    HB2  TYR  21           2HB      TYR  21   6.275  -0.422  -0.555
  154    HB3  TYR  21           3HB      TYR  21   5.340   1.052  -0.235
  155    HD1  TYR  21           HD2      TYR  21   2.857   0.979  -0.118
  156    HD2  TYR  21           HD1      TYR  21   5.189  -2.604  -0.716
  157    HE1  TYR  21           HE2      TYR  21   0.881  -0.405   0.515
  158    HE2  TYR  21           HE1      TYR  21   3.238  -3.991  -0.043
  159    HH   TYR  21           HH       TYR  21   1.064  -4.007   0.628
  160    H    GLY  22           H        GLY  22   3.960  -0.099  -4.395
  161    HA2  GLY  22           2HA      GLY  22   5.749  -1.665  -5.811
  162    HA3  GLY  22           3HA      GLY  22   4.962  -2.777  -4.673
  163    H    ALA  23           H        ALA  23   4.647  -3.454  -7.112
  164    HA   ALA  23           HA       ALA  23   1.922  -2.612  -8.095
  165    HB1  ALA  23           1HB      ALA  23   4.364  -3.573  -9.646
  166    HB2  ALA  23           2HB      ALA  23   2.754  -3.261 -10.329
  167    HB3  ALA  23           3HB      ALA  23   3.713  -1.922  -9.656
  168    H    PHE  24           H        PHE  24   0.466  -4.200  -7.733
  169    HA   PHE  24           HA       PHE  24   1.344  -6.920  -7.198
  170    HB2  PHE  24           2HB      PHE  24  -1.382  -5.598  -7.529
  171    HB3  PHE  24           3HB      PHE  24  -1.168  -7.357  -7.445
  172    HD1  PHE  24           HD2      PHE  24   0.485  -8.092  -5.403
  173    HD2  PHE  24           HD1      PHE  24  -2.020  -4.578  -5.560
  174    HE1  PHE  24           HE2      PHE  24   0.385  -8.052  -2.916
  175    HE2  PHE  24           HE1      PHE  24  -2.143  -4.559  -3.076
  176    HZ   PHE  24           HZ       PHE  24  -0.930  -6.284  -1.749
  177    H    VAL  25           H        VAL  25   1.404  -8.611  -8.613
  178    HA   VAL  25           HA       VAL  25   0.281  -8.276 -11.356
  179    HB   VAL  25           HB       VAL  25   3.015  -9.475 -10.741
  180   HG11  VAL  25          1HG1      VAL  25   1.586  -8.787 -13.350
  181   HG12  VAL  25          2HG1      VAL  25   3.227  -9.454 -13.214
  182   HG13  VAL  25          3HG1      VAL  25   1.831 -10.426 -12.703
  183   HG21  VAL  25          3HG2      VAL  25   2.398  -6.790 -12.018
  184   HG22  VAL  25          1HG2      VAL  25   3.142  -7.045 -10.424
  185   HG23  VAL  25          2HG2      VAL  25   4.001  -7.552 -11.891
  186    H    ALA  26           H        ALA  26  -1.300  -9.679 -11.404
  187    HA   ALA  26           HA       ALA  26  -1.298 -12.197  -9.948
  188    HB1  ALA  26           1HB      ALA  26  -3.012 -11.201 -12.254
  189    HB2  ALA  26           2HB      ALA  26  -3.329 -12.646 -11.264
  190    HB3  ALA  26           3HB      ALA  26  -3.387 -11.034 -10.521
  191    H    LEU  27           H        LEU  27  -1.032 -14.228 -10.747
  192    HA   LEU  27           HA       LEU  27   0.841 -14.413 -13.092
  193    HB2  LEU  27           2HB      LEU  27   0.922 -15.856 -10.452
  194    HB3  LEU  27           3HB      LEU  27   2.076 -16.077 -11.784
  195    HG   LEU  27           HG       LEU  27   1.740 -13.519 -10.149
  196   HD11  LEU  27          1HD1      LEU  27   3.953 -15.621 -10.147
  197   HD12  LEU  27          2HD1      LEU  27   3.965 -14.100  -9.225
  198   HD13  LEU  27          3HD1      LEU  27   2.768 -15.358  -8.847
  199   HD21  LEU  27          3HD2      LEU  27   3.795 -14.188 -12.269
  200   HD22  LEU  27          1HD2      LEU  27   2.469 -13.012 -12.415
  201   HD23  LEU  27          2HD2      LEU  27   3.768 -12.734 -11.239
  202    H    ASP  28           H        ASP  28  -1.707 -15.839 -11.175
  203    HA   ASP  28           HA       ASP  28  -2.559 -17.574 -13.399
  204    HB2  ASP  28           2HB      ASP  28  -0.997 -18.966 -12.058
  205    HB3  ASP  28           3HB      ASP  28  -1.988 -18.653 -10.617
  206    H    GLU  29           H        GLU  29  -4.809 -18.474 -12.741
  207    HA   GLU  29           HA       GLU  29  -6.507 -16.375 -11.819
  208    HB2  GLU  29           2HB      GLU  29  -8.286 -17.936 -12.050
  209    HB3  GLU  29           3HB      GLU  29  -7.129 -18.223 -13.368
  210    HG2  GLU  29           2HG      GLU  29  -6.203 -20.171 -12.105
  211    HG3  GLU  29           3HG      GLU  29  -7.393 -19.872 -10.820
  212    H    GLU  30           H        GLU  30  -4.633 -18.398  -9.928
  213    HA   GLU  30           HA       GLU  30  -6.003 -17.534  -7.431
  214    HB2  GLU  30           2HB      GLU  30  -5.780 -19.821  -6.542
  215    HB3  GLU  30           3HB      GLU  30  -6.894 -19.734  -7.922
  216    HG2  GLU  30           2HG      GLU  30  -5.308 -20.698  -9.396
  217    HG3  GLU  30           3HG      GLU  30  -3.981 -20.573  -8.221
  218    H    THR  31           H        THR  31  -3.333 -16.900  -8.997
  219    HA   THR  31           HA       THR  31  -1.816 -16.757  -6.450
  220    HB   THR  31           HB       THR  31  -0.487 -17.809  -8.966
  221    HG1  THR  31           1HG      THR  31  -0.569 -19.864  -7.948
  222   HG21  THR  31          1HG2      THR  31   0.303 -17.903  -6.016
  223   HG22  THR  31          2HG2      THR  31   1.248 -18.572  -7.364
  224   HG23  THR  31          3HG2      THR  31   0.999 -16.818  -7.243
  225    H    GLN  32           H        GLN  32  -0.555 -15.034  -6.273
  226    HA   GLN  32           HA       GLN  32  -0.106 -13.111  -8.483
  227    HB2  GLN  32           2HB      GLN  32  -2.317 -12.535  -7.750
  228    HB3  GLN  32           3HB      GLN  32  -1.840 -12.649  -6.042
  229    HG2  GLN  32           2HG      GLN  32  -0.616 -10.641  -6.119
  230    HG3  GLN  32           3HG      GLN  32  -0.611 -10.560  -7.890
  231   HE21  GLN  32          2HE2      GLN  32  -1.927  -9.086  -5.237
  232   HE22  GLN  32          1HE2      GLN  32  -3.439  -8.549  -5.933
  233    H    GLY  33           H        GLY  33   1.505 -11.565  -7.892
  234    HA2  GLY  33           2HA      GLY  33   2.736 -11.783  -5.199
  235    HA3  GLY  33           3HA      GLY  33   3.768 -11.985  -6.632
  236    H    LEU  34           H        LEU  34   4.663 -10.050  -5.291
  237    HA   LEU  34           HA       LEU  34   3.400  -7.472  -6.155
  238    HB2  LEU  34           2HB      LEU  34   2.853  -7.937  -3.852
  239    HB3  LEU  34           3HB      LEU  34   4.554  -8.268  -3.458
  240    HG   LEU  34           HG       LEU  34   5.124  -5.904  -3.976
  241   HD11  LEU  34          1HD1      LEU  34   2.107  -5.521  -4.251
  242   HD12  LEU  34          2HD1      LEU  34   3.322  -4.224  -4.227
  243   HD13  LEU  34          3HD1      LEU  34   3.295  -5.384  -5.565
  244   HD21  LEU  34          3HD2      LEU  34   2.887  -6.242  -1.947
  245   HD22  LEU  34          1HD2      LEU  34   4.619  -6.547  -1.673
  246   HD23  LEU  34          2HD2      LEU  34   4.052  -4.896  -1.996
  247    H    VAL  35           H        VAL  35   4.797  -6.804  -7.728
  248    HA   VAL  35           HA       VAL  35   7.675  -6.921  -7.472
  249    HB   VAL  35           HB       VAL  35   5.935  -4.956  -9.017
  250   HG11  VAL  35          1HG1      VAL  35   8.874  -5.733  -9.314
  251   HG12  VAL  35          2HG1      VAL  35   7.984  -4.625 -10.381
  252   HG13  VAL  35          3HG1      VAL  35   8.272  -4.184  -8.686
  253   HG21  VAL  35          3HG2      VAL  35   7.195  -7.538  -9.984
  254   HG22  VAL  35          1HG2      VAL  35   5.456  -7.234  -9.753
  255   HG23  VAL  35          2HG2      VAL  35   6.356  -6.336 -10.990
  256    H    HIS  36           H        HIS  36   8.714  -5.904  -5.763
  257    HA   HIS  36           HA       HIS  36   7.407  -3.758  -4.282
  258    HB2  HIS  36           2HB      HIS  36  10.184  -5.035  -4.150
  259    HB3  HIS  36           3HB      HIS  36   9.643  -3.702  -3.106
  260    HD1  HIS  36           HD1      HIS  36   7.591  -6.910  -3.972
  261    HD2  HIS  36           HD2      HIS  36   9.387  -4.859  -0.728
  262    HE1  HIS  36           HE1      HIS  36   6.887  -8.094  -1.925
  263    H    ILE  37           H        ILE  37   8.028  -1.571  -4.253
  264    HA   ILE  37           HA       ILE  37   8.440  -0.414  -6.846
  265    HB   ILE  37           HB       ILE  37   7.292   0.644  -4.849
  266   HG12  ILE  37          2HG1      ILE  37   9.367   2.401  -6.100
  267   HG13  ILE  37          3HG1      ILE  37   7.921   1.791  -6.936
  268   HG21  ILE  37          1HG2      ILE  37  10.162   1.233  -3.968
  269   HG22  ILE  37          2HG2      ILE  37   8.700   1.935  -3.250
  270   HG23  ILE  37          3HG2      ILE  37   9.004   0.194  -3.104
  271   HD11  ILE  37          3HD1      ILE  37   6.471   2.898  -5.250
  272   HD12  ILE  37          1HD1      ILE  37   7.914   3.515  -4.414
  273   HD13  ILE  37          2HD1      ILE  37   7.533   4.077  -6.051
  274    H    SER  38           H        SER  38  10.921  -1.113  -4.509
  275    HA   SER  38           HA       SER  38  13.061   0.202  -5.894
  276    HB2  SER  38           2HB      SER  38  13.266  -2.289  -4.183
  277    HB3  SER  38           3HB      SER  38  14.451  -0.977  -4.378
  278    HG   SER  38           HG       SER  38  13.270  -0.824  -2.391
  279    H    GLU  39           H        GLU  39  11.264  -2.390  -6.990
  280    HA   GLU  39           HA       GLU  39  13.526  -3.608  -8.532
  281    HB2  GLU  39           2HB      GLU  39  10.932  -4.866  -7.608
  282    HB3  GLU  39           3HB      GLU  39  12.246  -5.665  -8.491
  283    HG2  GLU  39           2HG      GLU  39  12.432  -4.517  -5.695
  284    HG3  GLU  39           3HG      GLU  39  12.223  -6.240  -6.053
  285    H    VAL  40           H        VAL  40  11.072  -1.466  -8.962
  286    HA   VAL  40           HA       VAL  40   9.727  -2.632 -11.275
  287    HB   VAL  40           HB       VAL  40   9.802   0.161 -10.088
  288   HG11  VAL  40          1HG1      VAL  40   7.854  -0.973 -12.152
  289   HG12  VAL  40          2HG1      VAL  40   7.718   0.614 -11.359
  290   HG13  VAL  40          3HG1      VAL  40   9.072   0.284 -12.460
  291   HG21  VAL  40          3HG2      VAL  40   7.729  -2.078  -9.902
  292   HG22  VAL  40          1HG2      VAL  40   8.805  -1.537  -8.598
  293   HG23  VAL  40          2HG2      VAL  40   7.545  -0.450  -9.214
  294    H    THR  41           H        THR  41  12.561  -0.559 -10.854
  295    HA   THR  41           HA       THR  41  13.428  -0.997 -13.628
  296    HB   THR  41           HB       THR  41  11.796   0.750 -14.035
  297    HG1  THR  41           1HG      THR  41  13.205   2.368 -14.802
  298   HG21  THR  41          1HG2      THR  41  13.226   2.396 -11.901
  299   HG22  THR  41          2HG2      THR  41  11.944   2.987 -12.978
  300   HG23  THR  41          3HG2      THR  41  11.581   1.739 -11.771
  301    H    HIS  42           H        HIS  42  15.551  -0.080 -13.999
  302    HA   HIS  42           HA       HIS  42  17.246  -0.009 -11.621
  303    HB2  HIS  42           2HB      HIS  42  17.722   0.491 -14.575
  304    HB3  HIS  42           3HB      HIS  42  19.034   0.556 -13.381
  305    HD1  HIS  42           HD1      HIS  42  17.323  -1.856 -15.603
  306    HD2  HIS  42           HD2      HIS  42  19.442  -1.950 -11.942
  307    HE1  HIS  42           HE1      HIS  42  18.056  -4.195 -15.287
  308    H    GLY  43           H        GLY  43  15.493   2.397 -13.501
  309    HA2  GLY  43           2HA      GLY  43  17.073   4.669 -12.641
  310    HA3  GLY  43           3HA      GLY  43  15.441   4.707 -13.344
  311    H    PHE  44           H        PHE  44  16.171   6.426 -11.187
  312    HA   PHE  44           HA       PHE  44  14.967   5.406  -8.771
  313    HB2  PHE  44           2HB      PHE  44  14.807   7.740  -8.092
  314    HB3  PHE  44           3HB      PHE  44  16.422   7.417  -8.753
  315    HD1  PHE  44           HD1      PHE  44  17.147   8.416 -10.875
  316    HD2  PHE  44           HD2      PHE  44  13.286   9.287  -9.150
  317    HE1  PHE  44           HE1      PHE  44  16.922  10.391 -12.377
  318    HE2  PHE  44           HE2      PHE  44  13.069  11.268 -10.644
  319    HZ   PHE  44           HZ       PHE  44  14.880  11.818 -12.261
  320    H    VAL  45           H        VAL  45  12.802   5.254  -8.217
  321    HA   VAL  45           HA       VAL  45  10.855   5.642 -10.354
  322    HB   VAL  45           HB       VAL  45  10.579   4.750  -7.456
  323   HG11  VAL  45          1HG1      VAL  45   8.553   4.647  -9.738
  324   HG12  VAL  45          2HG1      VAL  45   8.335   3.936  -8.126
  325   HG13  VAL  45          3HG1      VAL  45   8.450   5.698  -8.306
  326   HG21  VAL  45          3HG2      VAL  45  10.552   3.189 -10.084
  327   HG22  VAL  45          1HG2      VAL  45  11.865   3.180  -8.885
  328   HG23  VAL  45          2HG2      VAL  45  10.279   2.496  -8.469
  329    H    LYS  46           H        LYS  46  10.102   7.560 -10.879
  330    HA   LYS  46           HA       LYS  46  10.104   9.907  -9.213
  331    HB2  LYS  46           2HB      LYS  46   8.385   9.164 -11.598
  332    HB3  LYS  46           3HB      LYS  46   8.526  10.788 -10.890
  333    HG2  LYS  46           2HG      LYS  46  10.837  10.970 -11.587
  334    HG3  LYS  46           3HG      LYS  46  10.882   9.262 -12.076
  335    HD2  LYS  46           2HD      LYS  46  10.670  10.589 -14.076
  336    HD3  LYS  46           3HD      LYS  46   9.123   9.761 -13.794
  337    HE2  LYS  46           2HE      LYS  46   8.328  11.903 -12.655
  338    HE3  LYS  46           3HE      LYS  46   9.801  12.680 -13.279
  339    HZ1  LYS  46           3HZ      LYS  46   9.068  12.123 -15.508
  340    HZ2  LYS  46           1HZ      LYS  46   7.695  11.411 -14.920
  341    HZ3  LYS  46           2HZ      LYS  46   7.920  13.029 -14.731
  342    H    ASP  47           H        ASP  47   7.560   7.812 -10.312
  343    HA   ASP  47           HA       ASP  47   6.213   7.486  -7.741
  344    HB2  ASP  47           2HB      ASP  47   4.963   9.432  -8.433
  345    HB3  ASP  47           3HB      ASP  47   4.859   8.825 -10.101
  346    H    ILE  48           H        ILE  48   5.144   5.304  -7.986
  347    HA   ILE  48           HA       ILE  48   6.358   3.622  -9.995
  348    HB   ILE  48           HB       ILE  48   5.516   2.978  -7.679
  349   HG12  ILE  48          2HG1      ILE  48   4.615   1.255  -9.954
  350   HG13  ILE  48          3HG1      ILE  48   6.287   1.447  -9.386
  351   HG21  ILE  48          1HG2      ILE  48   2.812   2.964  -9.104
  352   HG22  ILE  48          2HG2      ILE  48   3.129   2.302  -7.490
  353   HG23  ILE  48          3HG2      ILE  48   3.276   4.045  -7.773
  354   HD11  ILE  48          3HD1      ILE  48   5.637   0.573  -7.158
  355   HD12  ILE  48          1HD1      ILE  48   3.963   0.376  -7.725
  356   HD13  ILE  48          2HD1      ILE  48   5.261  -0.599  -8.441
  357    H    ASN  49           H        ASN  49   3.237   5.241 -10.338
  358    HA   ASN  49           HA       ASN  49   2.709   3.737 -12.748
  359    HB2  ASN  49           2HB      ASN  49   0.717   4.777 -12.695
  360    HB3  ASN  49           3HB      ASN  49   1.244   5.450 -11.138
  361   HD21  ASN  49          2HD2      ASN  49   2.353   7.614 -11.200
  362   HD22  ASN  49          1HD2      ASN  49   1.857   8.747 -12.450
  363    H    GLU  50           H        GLU  50   4.905   6.352 -12.239
  364    HA   GLU  50           HA       GLU  50   5.054   7.093 -15.053
  365    HB2  GLU  50           2HB      GLU  50   6.991   7.453 -12.749
  366    HB3  GLU  50           3HB      GLU  50   7.186   8.162 -14.361
  367    HG2  GLU  50           2HG      GLU  50   4.753   8.733 -12.623
  368    HG3  GLU  50           3HG      GLU  50   6.252   9.678 -12.520
  369    H    HIS  51           H        HIS  51   5.802   4.165 -13.617
  370    HA   HIS  51           HA       HIS  51   7.832   3.528 -15.720
  371    HB2  HIS  51           2HB      HIS  51   8.081   2.776 -12.787
  372    HB3  HIS  51           3HB      HIS  51   9.260   2.402 -14.061
  373    HD1  HIS  51           HD1      HIS  51  10.943   4.411 -14.730
  374    HD2  HIS  51           HD2      HIS  51   8.032   5.349 -11.816
  375    HE1  HIS  51           HE1      HIS  51  11.593   6.597 -13.770
  376    H    LEU  52           H        LEU  52   4.934   2.631 -14.199
  377    HA   LEU  52           HA       LEU  52   4.848   0.151 -15.799
  378    HB2  LEU  52           2HB      LEU  52   5.687  -0.167 -13.276
  379    HB3  LEU  52           3HB      LEU  52   3.943  -0.118 -12.944
  380    HG   LEU  52           HG       LEU  52   3.765  -1.894 -14.866
  381   HD11  LEU  52          1HD1      LEU  52   6.694  -2.223 -14.067
  382   HD12  LEU  52          2HD1      LEU  52   5.765  -3.343 -15.087
  383   HD13  LEU  52          3HD1      LEU  52   6.108  -1.697 -15.660
  384   HD21  LEU  52          3HD2      LEU  52   5.003  -2.615 -12.194
  385   HD22  LEU  52          1HD2      LEU  52   3.273  -2.377 -12.530
  386   HD23  LEU  52          2HD2      LEU  52   4.142  -3.733 -13.280
  387    H    SER  53           H        SER  53   2.446  -0.825 -15.202
  388    HA   SER  53           HA       SER  53   0.428   1.353 -15.128
  389    HB2  SER  53           2HB      SER  53   0.831  -0.520 -17.488
  390    HB3  SER  53           3HB      SER  53  -0.514   0.624 -17.278
  391    HG   SER  53           HG       SER  53   1.160   1.447 -18.642
  392    H    VAL  54           H        VAL  54  -1.511   0.471 -14.211
  393    HA   VAL  54           HA       VAL  54  -1.754  -2.369 -13.669
  394    HB   VAL  54           HB       VAL  54  -3.895  -0.202 -13.605
  395   HG11  VAL  54          1HG1      VAL  54  -3.739  -2.894 -12.161
  396   HG12  VAL  54          2HG1      VAL  54  -5.023  -1.681 -11.955
  397   HG13  VAL  54          3HG1      VAL  54  -4.829  -2.506 -13.511
  398   HG21  VAL  54          3HG2      VAL  54  -2.094  -1.192 -11.363
  399   HG22  VAL  54          1HG2      VAL  54  -2.033   0.414 -12.128
  400   HG23  VAL  54          2HG2      VAL  54  -3.455  -0.060 -11.177
  401    H    GLY  55           H        GLY  55  -3.201  -3.830 -14.682
  402    HA2  GLY  55           2HA      GLY  55  -4.545  -4.704 -16.328
  403    HA3  GLY  55           3HA      GLY  55  -4.886  -3.051 -16.885
  404    H    ASP  56           H        ASP  56  -1.573  -4.210 -16.619
  405    HA   ASP  56           HA       ASP  56  -1.400  -4.551 -19.594
  406    HB2  ASP  56           2HB      ASP  56  -0.353  -2.420 -18.713
  407    HB3  ASP  56           3HB      ASP  56   0.675  -3.458 -17.700
  408    H    GLU  57           H        GLU  57   0.337  -6.028 -20.247
  409    HA   GLU  57           HA       GLU  57   0.652  -8.299 -18.336
  410    HB2  GLU  57           2HB      GLU  57  -0.419  -8.695 -20.523
  411    HB3  GLU  57           3HB      GLU  57   1.042  -8.087 -21.335
  412    HG2  GLU  57           2HG      GLU  57   2.363  -9.920 -20.358
  413    HG3  GLU  57           3HG      GLU  57   0.926 -10.530 -19.511
  414    H    VAL  58           H        VAL  58   2.638  -8.874 -17.609
  415    HA   VAL  58           HA       VAL  58   5.119  -7.540 -18.614
  416    HB   VAL  58           HB       VAL  58   5.703  -6.915 -16.287
  417   HG11  VAL  58          1HG1      VAL  58   3.094  -5.619 -17.220
  418   HG12  VAL  58          2HG1      VAL  58   4.236  -4.921 -16.051
  419   HG13  VAL  58          3HG1      VAL  58   4.728  -5.155 -17.744
  420   HG21  VAL  58          3HG2      VAL  58   2.855  -7.594 -15.549
  421   HG22  VAL  58          1HG2      VAL  58   4.332  -8.421 -15.004
  422   HG23  VAL  58          2HG2      VAL  58   4.031  -6.739 -14.524
  423    H    GLN  59           H        GLN  59   6.958  -8.697 -18.269
  424    HA   GLN  59           HA       GLN  59   6.604 -11.438 -17.167
  425    HB2  GLN  59           2HB      GLN  59   7.542 -11.048 -19.475
  426    HB3  GLN  59           3HB      GLN  59   8.930 -10.247 -18.703
  427    HG2  GLN  59           2HG      GLN  59   9.663 -12.255 -17.673
  428    HG3  GLN  59           3HG      GLN  59   8.109 -13.075 -17.935
  429   HE21  GLN  59          2HE2      GLN  59   7.521 -13.678 -20.146
  430   HE22  GLN  59          1HE2      GLN  59   8.796 -13.983 -21.322
  431    H    VAL  60           H        VAL  60   7.614 -12.056 -15.350
  432    HA   VAL  60           HA       VAL  60   9.046  -9.981 -13.702
  433    HB   VAL  60           HB       VAL  60   7.739 -11.063 -11.786
  434   HG11  VAL  60          1HG1      VAL  60   6.140  -9.464 -13.832
  435   HG12  VAL  60          2HG1      VAL  60   5.729  -9.651 -12.114
  436   HG13  VAL  60          3HG1      VAL  60   7.208  -8.790 -12.578
  437   HG21  VAL  60          3HG2      VAL  60   5.914 -12.045 -13.980
  438   HG22  VAL  60          1HG2      VAL  60   6.875 -13.037 -12.859
  439   HG23  VAL  60          2HG2      VAL  60   5.557 -12.023 -12.243
  440    H    LYS  61           H        LYS  61  10.660 -10.711 -12.402
  441    HA   LYS  61           HA       LYS  61  11.227 -13.647 -12.451
  442    HB2  LYS  61           2HB      LYS  61  13.045 -12.157 -13.198
  443    HB3  LYS  61           3HB      LYS  61  12.966 -11.289 -11.651
  444    HG2  LYS  61           2HG      LYS  61  13.620 -13.309 -10.432
  445    HG3  LYS  61           3HG      LYS  61  13.582 -14.260 -11.933
  446    HD2  LYS  61           2HD      LYS  61  15.404 -12.815 -12.857
  447    HD3  LYS  61           3HD      LYS  61  15.473 -11.952 -11.300
  448    HE2  LYS  61           2HE      LYS  61  16.025 -14.063 -10.148
  449    HE3  LYS  61           3HE      LYS  61  15.937 -14.937 -11.696
  450    HZ1  LYS  61           3HZ      LYS  61  17.779 -13.606 -12.479
  451    HZ2  LYS  61           1HZ      LYS  61  17.862 -12.795 -11.045
  452    HZ3  LYS  61           2HZ      LYS  61  18.204 -14.408 -11.101
  453    H    VAL  62           H        VAL  62  10.695 -14.791 -10.729
  454    HA   VAL  62           HA       VAL  62   9.492 -13.687  -8.376
  455    HB   VAL  62           HB       VAL  62  10.747 -16.436  -8.751
  456   HG11  VAL  62          1HG1      VAL  62   8.510 -15.434  -6.922
  457   HG12  VAL  62          2HG1      VAL  62   9.071 -17.118  -7.046
  458   HG13  VAL  62          3HG1      VAL  62  10.153 -15.865  -6.403
  459   HG21  VAL  62          3HG2      VAL  62   7.902 -15.538  -9.372
  460   HG22  VAL  62          1HG2      VAL  62   9.131 -16.015 -10.566
  461   HG23  VAL  62          2HG2      VAL  62   8.503 -17.212  -9.416
  462    H    LEU  63           H        LEU  63  10.327 -12.860  -6.642
  463    HA   LEU  63           HA       LEU  63  13.307 -12.846  -6.299
  464    HB2  LEU  63           2HB      LEU  63  12.254 -10.749  -7.002
  465    HB3  LEU  63           3HB      LEU  63  11.175 -10.809  -5.591
  466    HG   LEU  63           HG       LEU  63  13.133 -10.615  -4.086
  467   HD11  LEU  63          1HD1      LEU  63  14.742 -10.201  -6.650
  468   HD12  LEU  63          2HD1      LEU  63  15.350  -9.974  -4.994
  469   HD13  LEU  63          3HD1      LEU  63  14.886 -11.594  -5.550
  470   HD21  LEU  63          3HD2      LEU  63  12.959  -8.463  -6.236
  471   HD22  LEU  63          1HD2      LEU  63  11.917  -8.600  -4.802
  472   HD23  LEU  63          2HD2      LEU  63  13.648  -8.238  -4.612
  473    H    ALA  64           H        ALA  64  10.202 -13.241  -4.592
  474    HA   ALA  64           HA       ALA  64  11.589 -14.880  -2.566
  475    HB1  ALA  64           1HB      ALA  64   9.931 -12.454  -1.776
  476    HB2  ALA  64           2HB      ALA  64  10.527 -13.704  -0.673
  477    HB3  ALA  64           3HB      ALA  64  11.679 -12.644  -1.518
  478    H    VAL  65           H        VAL  65  10.117 -16.277  -1.494
  479    HA   VAL  65           HA       VAL  65   7.214 -16.086  -2.164
  480    HB   VAL  65           HB       VAL  65   8.919 -18.608  -2.341
  481   HG11  VAL  65          1HG1      VAL  65   5.921 -18.215  -2.802
  482   HG12  VAL  65          2HG1      VAL  65   6.822 -19.726  -3.071
  483   HG13  VAL  65          3HG1      VAL  65   6.655 -19.073  -1.428
  484   HG21  VAL  65          3HG2      VAL  65   7.441 -17.131  -4.542
  485   HG22  VAL  65          1HG2      VAL  65   9.205 -17.247  -4.345
  486   HG23  VAL  65          2HG2      VAL  65   8.255 -18.704  -4.706
  487    H    ASP  66           H        ASP  66   6.040 -16.269  -0.365
  488    HA   ASP  66           HA       ASP  66   6.973 -17.956   1.883
  489    HB2  ASP  66           2HB      ASP  66   7.565 -15.575   2.464
  490    HB3  ASP  66           3HB      ASP  66   5.843 -15.175   2.288
  491    H    GLU  67           H        GLU  67   5.538 -19.339   0.711
  492    HA   GLU  67           HA       GLU  67   2.799 -18.640   0.181
  493    HB2  GLU  67           2HB      GLU  67   2.560 -20.888  -0.502
  494    HB3  GLU  67           3HB      GLU  67   4.170 -20.339  -1.014
  495    HG2  GLU  67           2HG      GLU  67   5.101 -21.473   1.052
  496    HG3  GLU  67           3HG      GLU  67   3.500 -22.202   1.304
  497    H    GLU  68           H        GLU  68   4.302 -19.686   3.134
  498    HA   GLU  68           HA       GLU  68   1.841 -20.571   4.388
  499    HB2  GLU  68           2HB      GLU  68   4.464 -19.574   5.556
  500    HB3  GLU  68           3HB      GLU  68   3.133 -20.290   6.492
  501    HG2  GLU  68           2HG      GLU  68   3.345 -22.371   5.147
  502    HG3  GLU  68           3HG      GLU  68   4.750 -21.680   4.306
  503    H    LYS  69           H        LYS  69   3.699 -17.448   4.436
  504    HA   LYS  69           HA       LYS  69   1.564 -15.964   5.703
  505    HB2  LYS  69           2HB      LYS  69   3.972 -15.303   5.502
  506    HB3  LYS  69           3HB      LYS  69   3.695 -15.019   3.771
  507    HG2  LYS  69           2HG      LYS  69   3.682 -12.925   5.021
  508    HG3  LYS  69           3HG      LYS  69   2.109 -13.253   4.267
  509    HD2  LYS  69           2HD      LYS  69   1.839 -12.286   6.519
  510    HD3  LYS  69           3HD      LYS  69   1.176 -13.932   6.431
  511    HE2  LYS  69           2HE      LYS  69   3.198 -14.828   7.507
  512    HE3  LYS  69           3HE      LYS  69   3.916 -13.202   7.547
  513    HZ1  LYS  69           3HZ      LYS  69   2.136 -12.522   9.012
  514    HZ2  LYS  69           1HZ      LYS  69   1.470 -14.030   8.975
  515    HZ3  LYS  69           2HZ      LYS  69   2.951 -13.799   9.661
  516    H    GLY  70           H        GLY  70   2.108 -17.054   2.431
  517    HA2  GLY  70           2HA      GLY  70   0.487 -17.239   0.750
  518    HA3  GLY  70           3HA      GLY  70  -0.566 -16.110   1.632
  519    H    LYS  71           H        LYS  71   2.879 -15.609   0.739
  520    HA   LYS  71           HA       LYS  71   2.061 -13.387  -1.096
  521    HB2  LYS  71           2HB      LYS  71   4.039 -13.275   1.212
  522    HB3  LYS  71           3HB      LYS  71   3.921 -12.044  -0.066
  523    HG2  LYS  71           2HG      LYS  71   1.523 -11.668   0.583
  524    HG3  LYS  71           3HG      LYS  71   1.746 -12.805   1.932
  525    HD2  LYS  71           2HD      LYS  71   3.523 -11.350   2.869
  526    HD3  LYS  71           3HD      LYS  71   3.306 -10.212   1.517
  527    HE2  LYS  71           2HE      LYS  71   0.936  -9.888   2.195
  528    HE3  LYS  71           3HE      LYS  71   1.192 -10.986   3.571
  529    HZ1  LYS  71           3HZ      LYS  71   2.825  -9.435   4.418
  530    HZ2  LYS  71           1HZ      LYS  71   2.587  -8.420   3.143
  531    HZ3  LYS  71           2HZ      LYS  71   1.370  -8.682   4.224
  532    H    ILE  72           H        ILE  72   3.583 -12.763  -2.562
  533    HA   ILE  72           HA       ILE  72   6.109 -14.297  -2.963
  534    HB   ILE  72           HB       ILE  72   3.915 -13.861  -5.053
  535   HG12  ILE  72          2HG1      ILE  72   5.059 -16.416  -3.961
  536   HG13  ILE  72          3HG1      ILE  72   3.447 -15.743  -3.638
  537   HG21  ILE  72          1HG2      ILE  72   6.723 -15.023  -5.388
  538   HG22  ILE  72          2HG2      ILE  72   5.479 -14.953  -6.653
  539   HG23  ILE  72          3HG2      ILE  72   6.170 -13.457  -6.018
  540   HD11  ILE  72          3HD1      ILE  72   2.849 -16.007  -6.029
  541   HD12  ILE  72          1HD1      ILE  72   4.455 -16.694  -6.357
  542   HD13  ILE  72          2HD1      ILE  72   3.322 -17.563  -5.309
  543    H    SER  73           H        SER  73   7.705 -12.883  -3.506
  544    HA   SER  73           HA       SER  73   6.929 -10.089  -4.234
  545    HB2  SER  73           2HB      SER  73   9.605 -11.060  -3.195
  546    HB3  SER  73           3HB      SER  73   9.069  -9.382  -3.404
  547    HG   SER  73           HG       SER  73   8.885 -10.103  -1.210
  548    H    LEU  74           H        LEU  74   7.997  -9.145  -5.997
  549    HA   LEU  74           HA       LEU  74   9.111 -11.060  -8.014
  550    HB2  LEU  74           2HB      LEU  74   6.894  -9.051  -8.337
  551    HB3  LEU  74           3HB      LEU  74   7.597  -9.995  -9.667
  552    HG   LEU  74           HG       LEU  74   6.036 -11.169  -7.314
  553   HD11  LEU  74          1HD1      LEU  74   5.234 -10.738 -10.224
  554   HD12  LEU  74          2HD1      LEU  74   4.260 -11.573  -8.996
  555   HD13  LEU  74          3HD1      LEU  74   4.601  -9.836  -8.829
  556   HD21  LEU  74          3HD2      LEU  74   7.062 -12.497  -9.835
  557   HD22  LEU  74          1HD2      LEU  74   7.679 -12.736  -8.185
  558   HD23  LEU  74          2HD2      LEU  74   6.033 -13.246  -8.593
  559    H    SER  75           H        SER  75   9.988  -9.809  -9.915
  560    HA   SER  75           HA       SER  75  10.712  -6.976  -9.403
  561    HB2  SER  75           2HB      SER  75  13.080  -7.562 -10.039
  562    HB3  SER  75           3HB      SER  75  12.561  -8.091  -8.424
  563    HG   SER  75           HG       SER  75  13.710  -9.733  -9.561
  564    H    ILE  76           H        ILE  76  11.289  -5.829 -11.176
  565    HA   ILE  76           HA       ILE  76  10.600  -6.943 -13.901
  566    HB   ILE  76           HB       ILE  76   9.759  -4.388 -12.491
  567   HG12  ILE  76          2HG1      ILE  76   8.325  -6.259 -12.102
  568   HG13  ILE  76          3HG1      ILE  76   7.530  -4.948 -12.996
  569   HG21  ILE  76          1HG2      ILE  76   9.457  -5.011 -15.463
  570   HG22  ILE  76          2HG2      ILE  76   8.734  -3.624 -14.617
  571   HG23  ILE  76          3HG2      ILE  76  10.497  -3.751 -14.769
  572   HD11  ILE  76          3HD1      ILE  76   7.744  -6.253 -15.099
  573   HD12  ILE  76          1HD1      ILE  76   8.541  -7.562 -14.199
  574   HD13  ILE  76          2HD1      ILE  76   6.842  -7.155 -13.873
  575    H    ARG  77           H        ARG  77  12.615  -4.579 -12.045
  576    HA   ARG  77           HA       ARG  77  14.255  -3.930 -14.272
  577    HB2  ARG  77           2HB      ARG  77  15.889  -3.257 -12.734
  578    HB3  ARG  77           3HB      ARG  77  14.302  -2.856 -12.046
  579    HG2  ARG  77           2HG      ARG  77  14.477  -4.737 -10.458
  580    HG3  ARG  77           3HG      ARG  77  16.025  -5.232 -11.183
  581    HD2  ARG  77           2HD      ARG  77  17.087  -3.166 -10.512
  582    HD3  ARG  77           3HD      ARG  77  15.533  -2.472  -9.989
  583    HE   ARG  77           HE       ARG  77  15.798  -4.749  -8.461
  584   HH11  ARG  77          1HH1      ARG  77  18.011  -2.044  -9.029
  585   HH12  ARG  77          2HH1      ARG  77  18.601  -2.026  -7.390
  586   HH21  ARG  77          1HH2      ARG  77  16.477  -4.624  -6.302
  587   HH22  ARG  77          2HH2      ARG  77  17.734  -3.498  -5.838
  588    H    ALA  78           H        ALA  78  14.034  -6.921 -12.573
  589    HA   ALA  78           HA       ALA  78  16.422  -8.126 -13.607
  590    HB1  ALA  78           1HB      ALA  78  13.774  -9.357 -12.736
  591    HB2  ALA  78           2HB      ALA  78  15.314 -10.223 -12.936
  592    HB3  ALA  78           3HB      ALA  78  15.149  -8.986 -11.668
  593    H    THR  79           H        THR  79  13.357  -7.403 -15.173
  594    HA   THR  79           HA       THR  79  13.913  -9.431 -17.307
  595    HB   THR  79           HB       THR  79  11.461  -9.455 -17.621
  596    HG1  THR  79           1HG      THR  79  10.188  -8.448 -15.966
  597   HG21  THR  79          1HG2      THR  79  12.258  -9.966 -14.715
  598   HG22  THR  79          2HG2      THR  79  10.818 -10.616 -15.527
  599   HG23  THR  79          3HG2      THR  79  12.436 -11.121 -16.057
  600    H    GLN  80           H        GLN  80  13.173  -6.086 -16.665
  601    HA   GLN  80           HA       GLN  80  13.882  -5.252 -19.404
  602    HB2  GLN  80           2HB      GLN  80  11.813  -3.989 -19.704
  603    HB3  GLN  80           3HB      GLN  80  11.503  -5.735 -19.610
  604    HG2  GLN  80           2HG      GLN  80  10.681  -5.520 -17.325
  605    HG3  GLN  80           3HG      GLN  80  11.129  -3.802 -17.284
  606   HE21  GLN  80          2HE2      GLN  80   9.131  -2.796 -17.037
  607   HE22  GLN  80          1HE2      GLN  80   7.794  -2.999 -18.154
  608    H    ALA  81           H        ALA  81  13.323  -2.624 -19.286
  609    HA   ALA  81           HA       ALA  81  13.841  -1.501 -16.575
  610    HB1  ALA  81           1HB      ALA  81  15.476  -0.844 -19.064
  611    HB2  ALA  81           2HB      ALA  81  15.556   0.018 -17.509
  612    HB3  ALA  81           3HB      ALA  81  16.079  -1.680 -17.613
  613    H    ALA  82           H        ALA  82  13.181   0.686 -16.427
  614    HA   ALA  82           HA       ALA  82  11.753   1.957 -18.702
  615    HB1  ALA  82           1HB      ALA  82  10.413   1.269 -16.048
  616    HB2  ALA  82           2HB      ALA  82   9.721   2.288 -17.332
  617    HB3  ALA  82           3HB      ALA  82  10.015   0.559 -17.631
  618    HA   PRO  83           HA       PRO  83  14.418   4.783 -16.170
  619    HB2  PRO  83           2HB      PRO  83  14.396   6.144 -18.860
  620    HB3  PRO  83           3HB      PRO  83  15.727   5.981 -17.685
  621    HG2  PRO  83           2HG      PRO  83  15.619   4.375 -19.903
  622    HG3  PRO  83           3HG      PRO  83  16.122   3.689 -18.336
  623    HD2  PRO  83           2HD      PRO  83  13.386   3.530 -19.680
  624    HD3  PRO  83           3HD      PRO  83  14.267   2.264 -18.787
  625    H    GLU  84           H        GLU  84  11.957   5.563 -18.615
  626    HA   GLU  84           HA       GLU  84  10.154   6.714 -16.630
  627    HB2  GLU  84           2HB      GLU  84  11.553   8.668 -17.177
  628    HB3  GLU  84           3HB      GLU  84  11.241   8.411 -18.909
  629    HG2  GLU  84           2HG      GLU  84   8.875   8.851 -18.593
  630    HG3  GLU  84           3HG      GLU  84   9.081   9.001 -16.834
  631    H    LYS  85           H        LYS  85   8.179   5.881 -17.291
  632    HA   LYS  85           HA       LYS  85   7.718   4.654 -19.867
  633    HB2  LYS  85           2HB      LYS  85   6.577   4.153 -17.662
  634    HB3  LYS  85           3HB      LYS  85   5.693   5.683 -17.857
  635    HG2  LYS  85           2HG      LYS  85   4.713   4.852 -19.969
  636    HG3  LYS  85           3HG      LYS  85   5.619   3.332 -19.796
  637    HD2  LYS  85           2HD      LYS  85   3.426   2.847 -19.015
  638    HD3  LYS  85           3HD      LYS  85   4.426   3.026 -17.554
  639    HE2  LYS  85           2HE      LYS  85   3.635   5.416 -17.392
  640    HE3  LYS  85           3HE      LYS  85   2.525   5.087 -18.745
  641    HZ1  LYS  85           3HZ      LYS  85   1.490   3.393 -17.387
  642    HZ2  LYS  85           1HZ      LYS  85   2.515   3.707 -16.137
  643    HZ3  LYS  85           2HZ      LYS  85   1.444   4.860 -16.616
  644    H    LYS  86           H        LYS  86   7.114   5.607 -21.751
  645    HA   LYS  86           HA       LYS  86   6.004   8.357 -21.810
  646    HB2  LYS  86           2HB      LYS  86   7.752   9.149 -23.294
  647    HB3  LYS  86           3HB      LYS  86   8.432   8.666 -21.725
  648    HG2  LYS  86           2HG      LYS  86   9.103   6.471 -22.774
  649    HG3  LYS  86           3HG      LYS  86   8.568   7.114 -24.343
  650    HD2  LYS  86           2HD      LYS  86  10.741   8.338 -22.597
  651    HD3  LYS  86           3HD      LYS  86  11.039   7.264 -23.984
  652    HE2  LYS  86           2HE      LYS  86   9.883   8.905 -25.466
  653    HE3  LYS  86           3HE      LYS  86   9.683   9.991 -24.069
  654    HZ1  LYS  86           3HZ      LYS  86  12.075  10.098 -23.891
  655    HZ2  LYS  86           1HZ      LYS  86  12.263   9.094 -25.189
  656    HZ3  LYS  86           2HZ      LYS  86  11.597  10.588 -25.393
  657    H    GLU  87           H        GLU  87   5.320   8.976 -23.931
  658    HA   GLU  87           HA       GLU  87   5.002   6.955 -26.039
  659    HB2  GLU  87           2HB      GLU  87   3.204   6.614 -24.192
  660    HB3  GLU  87           3HB      GLU  87   2.524   8.146 -24.783
  661    HG2  GLU  87           2HG      GLU  87   2.230   7.199 -27.009
  662    HG3  GLU  87           3HG      GLU  87   3.003   5.677 -26.518
  663    H    SER  88           H        SER  88   3.758   8.035 -27.850
  664    HA   SER  88           HA       SER  88   4.887  10.579 -28.567
  665    HB2  SER  88           2HB      SER  88   2.539   9.194 -29.887
  666    HB3  SER  88           3HB      SER  88   3.789  10.214 -30.636
  667    HG   SER  88           HG       SER  88   4.148   7.951 -30.999
  668    H    LYS  89           H        LYS  89   2.521  10.340 -26.335
  669    HA   LYS  89           HA       LYS  89   1.643  13.117 -26.834
  670    HB2  LYS  89           2HB      LYS  89  -0.693  12.599 -26.560
  671    HB3  LYS  89           3HB      LYS  89  -0.032  11.777 -27.985
  672    HG2  LYS  89           2HG      LYS  89  -0.018   9.626 -26.772
  673    HG3  LYS  89           3HG      LYS  89  -0.587  10.435 -25.292
  674    HD2  LYS  89           2HD      LYS  89  -2.610  11.194 -26.556
  675    HD3  LYS  89           3HD      LYS  89  -2.057  10.233 -27.945
  676    HE2  LYS  89           2HE      LYS  89  -2.654   9.076 -25.198
  677    HE3  LYS  89           3HE      LYS  89  -3.847   9.156 -26.517
  678    HZ1  LYS  89           3HZ      LYS  89  -2.395   7.758 -27.825
  679    HZ2  LYS  89           1HZ      LYS  89  -1.288   7.676 -26.596
  680    HZ3  LYS  89           2HZ      LYS  89  -2.776   7.009 -26.408
  681    HA   PRO  90           HA       PRO  90   2.086  13.314 -22.457
  682    HB2  PRO  90           2HB      PRO  90   0.029  14.986 -21.667
  683    HB3  PRO  90           3HB      PRO  90   1.579  15.539 -22.351
  684    HG2  PRO  90           2HG      PRO  90  -1.119  15.122 -23.735
  685    HG3  PRO  90           3HG      PRO  90   0.036  16.462 -23.951
  686    HD2  PRO  90           2HD      PRO  90  -0.046  14.358 -25.720
  687    HD3  PRO  90           3HD      PRO  90   1.499  15.132 -25.299
  688    H    ARG  91           H        ARG  91   1.144  12.566 -20.462
  689    HA   ARG  91           HA       ARG  91  -0.410  10.189 -20.785
  690    HB2  ARG  91           2HB      ARG  91   1.322  10.818 -18.976
  691    HB3  ARG  91           3HB      ARG  91  -0.010  11.691 -18.187
  692    HG2  ARG  91           2HG      ARG  91  -1.138   9.207 -18.704
  693    HG3  ARG  91           3HG      ARG  91   0.547   8.788 -18.332
  694    HD2  ARG  91           2HD      ARG  91   0.276  10.286 -16.242
  695    HD3  ARG  91           3HD      ARG  91  -1.469  10.241 -16.577
  696    HE   ARG  91           HE       ARG  91   0.131   8.251 -15.327
  697   HH11  ARG  91          1HH1      ARG  91  -2.742   8.511 -17.421
  698   HH12  ARG  91          2HH1      ARG  91  -3.328   6.922 -16.995
  699   HH21  ARG  91          1HH2      ARG  91  -0.609   6.212 -14.850
  700   HH22  ARG  91          2HH2      ARG  91  -2.114   5.606 -15.525
  701    H    LYS  92           H        LYS  92  -2.572   9.960 -21.023
  702    HA   LYS  92           HA       LYS  92  -4.480  12.038 -20.325
  703    HB2  LYS  92           2HB      LYS  92  -4.790   9.072 -20.890
  704    HB3  LYS  92           3HB      LYS  92  -6.137  10.211 -20.693
  705    HG2  LYS  92           2HG      LYS  92  -4.025  10.287 -22.882
  706    HG3  LYS  92           3HG      LYS  92  -5.703   9.733 -23.067
  707    HD2  LYS  92           2HD      LYS  92  -6.456  12.051 -22.391
  708    HD3  LYS  92           3HD      LYS  92  -4.752  12.556 -22.445
  709    HE2  LYS  92           2HE      LYS  92  -5.703  13.212 -24.526
  710    HE3  LYS  92           3HE      LYS  92  -4.691  11.786 -24.851
  711    HZ1  LYS  92           3HZ      LYS  92  -6.696  10.451 -24.860
  712    HZ2  LYS  92           1HZ      LYS  92  -7.629  11.777 -24.560
  713    HZ3  LYS  92           2HZ      LYS  92  -6.811  11.657 -25.985
  714    HA   PRO  93           HA       PRO  93  -5.252  11.114 -15.990
  715    HB2  PRO  93           2HB      PRO  93  -8.113  10.573 -16.804
  716    HB3  PRO  93           3HB      PRO  93  -7.494  11.517 -15.426
  717    HG2  PRO  93           2HG      PRO  93  -8.360  12.805 -17.665
  718    HG3  PRO  93           3HG      PRO  93  -6.879  13.366 -16.847
  719    HD2  PRO  93           2HD      PRO  93  -7.117  11.602 -19.327
  720    HD3  PRO  93           3HD      PRO  93  -5.963  12.921 -19.005
  721    H    LYS  94           H        LYS  94  -5.604   9.300 -14.577
  722    HA   LYS  94           HA       LYS  94  -5.315   6.644 -15.603
  723    HB2  LYS  94           2HB      LYS  94  -6.340   7.638 -12.917
  724    HB3  LYS  94           3HB      LYS  94  -5.886   5.960 -13.282
  725    HG2  LYS  94           2HG      LYS  94  -3.574   6.547 -13.570
  726    HG3  LYS  94           3HG      LYS  94  -3.944   8.286 -13.586
  727    HD2  LYS  94           2HD      LYS  94  -4.659   8.167 -11.219
  728    HD3  LYS  94           3HD      LYS  94  -4.302   6.423 -11.196
  729    HE2  LYS  94           2HE      LYS  94  -1.949   6.826 -11.577
  730    HE3  LYS  94           3HE      LYS  94  -2.242   8.557 -11.875
  731    HZ1  LYS  94           3HZ      LYS  94  -2.926   8.781  -9.581
  732    HZ2  LYS  94           1HZ      LYS  94  -2.660   7.175  -9.305
  733    HZ3  LYS  94           2HZ      LYS  94  -1.401   8.174  -9.661
  734    H    ALA  95           H        ALA  95  -8.091   8.255 -14.104
  735    HA   ALA  95           HA       ALA  95  -9.981   7.442 -16.196
  736    HB1  ALA  95           1HB      ALA  95 -10.345   6.487 -13.322
  737    HB2  ALA  95           2HB      ALA  95 -11.574   6.415 -14.605
  738    HB3  ALA  95           3HB      ALA  95 -10.090   5.445 -14.740
  739    H    ALA  96           H        ALA  96 -11.839   8.768 -16.124
  740    HA   ALA  96           HA       ALA  96 -11.403  11.425 -15.255
  741    HB1  ALA  96           1HB      ALA  96 -14.026  10.016 -15.910
  742    HB2  ALA  96           2HB      ALA  96 -13.775  11.776 -15.847
  743    HB3  ALA  96           3HB      ALA  96 -12.945  10.804 -17.085
  744    H    GLN  97           H        GLN  97 -11.801  12.484 -13.527
  745    HA   GLN  97           HA       GLN  97 -12.151  13.105 -11.337
  746    HB2  GLN  97           2HB      GLN  97 -14.515  12.891 -12.096
  747    HB3  GLN  97           3HB      GLN  97 -14.513  11.220 -11.494
  748    HG2  GLN  97           2HG      GLN  97 -15.635  12.711  -9.898
  749    HG3  GLN  97           3HG      GLN  97 -14.154  12.034  -9.193
  750   HE21  GLN  97          2HE2      GLN  97 -12.315  13.436  -8.849
  751   HE22  GLN  97          1HE2      GLN  97 -12.518  15.182  -8.832
  752    H    VAL  98           H        VAL  98 -11.824   9.632 -11.753
  753    HA   VAL  98           HA       VAL  98 -11.198   9.132  -8.965
  754    HB   VAL  98           HB       VAL  98 -10.379   7.662 -11.498
  755   HG11  VAL  98          1HG1      VAL  98 -10.546   6.670  -8.613
  756   HG12  VAL  98          2HG1      VAL  98 -10.170   5.666 -10.034
  757   HG13  VAL  98          3HG1      VAL  98  -9.046   6.947  -9.528
  758   HG21  VAL  98          3HG2      VAL  98 -12.783   7.196  -9.698
  759   HG22  VAL  98          1HG2      VAL  98 -12.817   7.816 -11.364
  760   HG23  VAL  98          2HG2      VAL  98 -12.280   6.153 -11.049
  761    H    SER  99           H        SER  99  -9.218  10.110 -11.783
  762    HA   SER  99           HA       SER  99  -6.680   9.816 -10.532
  763    HB2  SER  99           2HB      SER  99  -7.376  11.968 -12.540
  764    HB3  SER  99           3HB      SER  99  -5.824  11.135 -12.301
  765    HG   SER  99           HG       SER  99  -6.998  10.357 -14.134
  766    H    GLU 100           H        GLU 100  -5.429  11.127  -9.258
  767    HA   GLU 100           HA       GLU 100  -6.585  13.350  -7.826
  768    HB2  GLU 100           2HB      GLU 100  -4.388  13.656  -6.904
  769    HB3  GLU 100           3HB      GLU 100  -4.840  11.938  -6.887
  770    HG2  GLU 100           2HG      GLU 100  -3.183  12.976  -9.160
  771    HG3  GLU 100           3HG      GLU 100  -2.382  12.741  -7.594
  772    H    GLU 101           H        GLU 101  -5.200  13.168 -10.921
  773    HA   GLU 101           HA       GLU 101  -5.379  16.128 -11.250
  774    HB2  GLU 101           2HB      GLU 101  -2.995  15.285 -10.872
  775    HB3  GLU 101           3HB      GLU 101  -3.161  14.420 -12.415
  776    HG2  GLU 101           2HG      GLU 101  -3.573  16.566 -13.584
  777    HG3  GLU 101           3HG      GLU 101  -3.490  17.422 -12.030
  778    H    ALA 102           H        ALA 102  -7.493  14.745 -11.714
  779    HA   ALA 102           HA       ALA 102  -7.750  13.523 -14.274
  780    HB1  ALA 102           1HB      ALA 102  -9.860  14.900 -12.557
  781    HB2  ALA 102           2HB      ALA 102 -10.175  13.757 -13.883
  782    HB3  ALA 102           3HB      ALA 102  -9.347  13.202 -12.408
  783    H    SER 103           H        SER 103  -7.154  16.748 -13.624
  784    HA   SER 103           HA       SER 103  -8.636  18.278 -15.455
  785    HB2  SER 103           2HB      SER 103  -5.675  18.630 -14.926
  786    HB3  SER 103           3HB      SER 103  -6.913  19.877 -15.200
  787    HG   SER 103           HG       SER 103  -6.335  19.667 -12.964
  788    H    THR 104           H        THR 104  -8.247  19.043 -17.544
  789    HA   THR 104           HA       THR 104  -7.219  17.319 -19.551
  790    HB   THR 104           HB       THR 104  -7.165  19.639 -20.817
  791    HG1  THR 104           1HG      THR 104  -8.528  21.162 -19.747
  792   HG21  THR 104          1HG2      THR 104  -9.739  18.515 -19.614
  793   HG22  THR 104          2HG2      THR 104  -9.634  19.551 -21.057
  794   HG23  THR 104          3HG2      THR 104  -8.933  17.917 -21.083
  795    HA   PRO 105           HA       PRO 105  -2.845  17.994 -19.486
  796    HB2  PRO 105           2HB      PRO 105  -2.212  18.026 -22.175
  797    HB3  PRO 105           3HB      PRO 105  -2.508  16.541 -21.234
  798    HG2  PRO 105           2HG      PRO 105  -4.389  18.114 -23.070
  799    HG3  PRO 105           3HG      PRO 105  -4.212  16.346 -22.932
  800    HD2  PRO 105           2HD      PRO 105  -6.248  17.723 -21.663
  801    HD3  PRO 105           3HD      PRO 105  -5.523  16.258 -20.953
  802    H    GLN 106           H        GLN 106  -1.252  19.645 -19.905
  803    HA   GLN 106           HA       GLN 106  -2.213  22.296 -19.755
  804    HB2  GLN 106           2HB      GLN 106  -0.036  21.482 -18.907
  805    HB3  GLN 106           3HB      GLN 106   0.531  21.298 -20.582
  806    HG2  GLN 106           2HG      GLN 106   1.413  23.382 -19.572
  807    HG3  GLN 106           3HG      GLN 106   0.331  23.723 -20.937
  808   HE21  GLN 106          2HE2      GLN 106   0.808  24.072 -17.457
  809   HE22  GLN 106          1HE2      GLN 106  -0.597  25.081 -17.180
  810    H    GLY 107           H        GLY 107  -2.590  23.886 -21.122
  811    HA2  GLY 107           2HA      GLY 107  -3.260  24.904 -23.047
  812    HA3  GLY 107           3HA      GLY 107  -1.800  24.201 -23.780
  813    H    PHE 108           H        PHE 108  -4.197  22.010 -22.557
  814    HA   PHE 108           HA       PHE 108  -5.169  20.190 -23.581
  815    HB2  PHE 108           2HB      PHE 108  -6.846  22.121 -23.978
  816    HB3  PHE 108           3HB      PHE 108  -6.232  22.147 -25.644
  817    HD1  PHE 108           HD1      PHE 108  -7.576  19.717 -23.104
  818    HD2  PHE 108           HD2      PHE 108  -7.361  20.907 -27.246
  819    HE1  PHE 108           HE1      PHE 108  -9.173  17.903 -23.707
  820    HE2  PHE 108           HE2      PHE 108  -8.960  19.094 -27.848
  821    HZ   PHE 108           HZ       PHE 108  -9.863  17.589 -26.083
  822    H    ASN 109           H        ASN 109  -2.434  20.717 -24.271
  823    HA   ASN 109           HA       ASN 109  -1.988  19.959 -27.007
  824    HB2  ASN 109           2HB      ASN 109  -0.224  20.898 -25.663
  825    HB3  ASN 109           3HB      ASN 109  -0.287  19.565 -24.488
  826   HD21  ASN 109          2HD2      ASN 109   1.652  18.497 -24.777
  827   HD22  ASN 109          1HD2      ASN 109   2.222  17.900 -26.329
  828    H    THR 110           H        THR 110  -1.724  17.957 -27.947
  829    HA   THR 110           HA       THR 110  -2.453  15.501 -26.401
  830    HB   THR 110           HB       THR 110  -3.943  14.976 -28.440
  831    HG1  THR 110           1HG      THR 110  -4.784  16.857 -29.468
  832   HG21  THR 110          1HG2      THR 110  -4.781  17.263 -26.598
  833   HG22  THR 110          2HG2      THR 110  -5.883  16.221 -27.523
  834   HG23  THR 110          3HG2      THR 110  -4.894  15.531 -26.216
  835    H    LEU 111           H        LEU 111   0.033  16.746 -27.947
  836    HA   LEU 111           HA       LEU 111   0.930  14.065 -28.844
  837    HB2  LEU 111           2HB      LEU 111   1.891  15.043 -30.887
  838    HB3  LEU 111           3HB      LEU 111   0.122  14.890 -30.883
  839    HG   LEU 111           HG       LEU 111  -0.009  17.365 -30.389
  840   HD11  LEU 111          1HD1      LEU 111   2.930  17.372 -31.229
  841   HD12  LEU 111          2HD1      LEU 111   1.903  18.810 -31.021
  842   HD13  LEU 111          3HD1      LEU 111   2.311  17.808 -29.621
  843   HD21  LEU 111          3HD2      LEU 111   1.342  16.497 -32.985
  844   HD22  LEU 111          1HD2      LEU 111  -0.402  16.451 -32.634
  845   HD23  LEU 111          2HD2      LEU 111   0.437  18.013 -32.761
  846    H    LYS 112           H        LYS 112   3.232  13.851 -29.057
  847    HA   LYS 112           HA       LYS 112   4.802  15.379 -27.188
  848    HB2  LYS 112           2HB      LYS 112   5.341  13.097 -27.827
  849    HB3  LYS 112           3HB      LYS 112   5.559  13.598 -29.518
  850    HG2  LYS 112           2HG      LYS 112   7.711  13.228 -28.365
  851    HG3  LYS 112           3HG      LYS 112   7.521  14.898 -28.943
  852    HD2  LYS 112           2HD      LYS 112   7.131  15.725 -26.715
  853    HD3  LYS 112           3HD      LYS 112   6.942  14.078 -26.065
  854    HE2  LYS 112           2HE      LYS 112   9.282  13.583 -26.523
  855    HE3  LYS 112           3HE      LYS 112   9.497  15.161 -27.318
  856    HZ1  LYS 112           3HZ      LYS 112   9.069  16.225 -25.210
  857    HZ2  LYS 112           1HZ      LYS 112   8.864  14.757 -24.464
  858    HZ3  LYS 112           2HZ      LYS 112  10.334  15.186 -25.074
  859    H    ASP 113           H        ASP 113   5.291  17.465 -27.433
  860    HA   ASP 113           HA       ASP 113   4.721  19.007 -29.717
  861    HB2  ASP 113           2HB      ASP 113   4.908  19.917 -27.484
  862    HB3  ASP 113           3HB      ASP 113   6.657  19.602 -27.434
  863    H    LYS 114           H        LYS 114   5.713  19.551 -31.519
  864    HA   LYS 114           HA       LYS 114   7.975  17.974 -32.397
  865    HB2  LYS 114           2HB      LYS 114   6.707  20.390 -33.712
  866    HB3  LYS 114           3HB      LYS 114   7.723  19.155 -34.488
  867    HG2  LYS 114           2HG      LYS 114   4.920  18.782 -33.368
  868    HG3  LYS 114           3HG      LYS 114   5.382  18.816 -35.083
  869    HD2  LYS 114           2HD      LYS 114   6.728  16.733 -34.733
  870    HD3  LYS 114           3HD      LYS 114   6.176  16.687 -33.040
  871    HE2  LYS 114           2HE      LYS 114   3.830  16.558 -33.808
  872    HE3  LYS 114           3HE      LYS 114   4.382  16.602 -35.500
  873    HZ1  LYS 114           3HZ      LYS 114   5.528  14.527 -35.111
  874    HZ2  LYS 114           1HZ      LYS 114   5.017  14.488 -33.542
  875    HZ3  LYS 114           2HZ      LYS 114   3.923  14.361 -34.770
  876    H    LEU 115           H        LEU 115   9.929  18.725 -33.228
  877    HA   LEU 115           HA       LEU 115  12.028  19.605 -32.822
  878    HB2  LEU 115           2HB      LEU 115  10.637  21.345 -34.266
  879    HB3  LEU 115           3HB      LEU 115  10.871  22.370 -32.837
  880    HG   LEU 115           HG       LEU 115  13.188  21.017 -34.305
  881   HD11  LEU 115          1HD1      LEU 115  12.085  23.844 -34.652
  882   HD12  LEU 115          2HD1      LEU 115  13.575  23.215 -35.394
  883   HD13  LEU 115          3HD1      LEU 115  11.997  22.540 -35.858
  884   HD21  LEU 115          3HD2      LEU 115  13.201  23.385 -32.423
  885   HD22  LEU 115          1HD2      LEU 115  13.769  21.744 -32.051
  886   HD23  LEU 115          2HD2      LEU 115  14.602  22.705 -33.287
  887    H    GLU 116           H        GLU 116  10.968  18.555 -30.652
  888    HA   GLU 116           HA       GLU 116  11.347  20.105 -28.284
  889    HB2  GLU 116           2HB      GLU 116  10.424  17.783 -28.493
  890    HB3  GLU 116           3HB      GLU 116  12.075  17.210 -28.811
  891    HG2  GLU 116           2HG      GLU 116  11.655  16.758 -26.539
  892    HG3  GLU 116           3HG      GLU 116  12.725  18.174 -26.532
  893    H    GLU 117           H        GLU 117  13.581  18.524 -30.477
  894    HA   GLU 117           HA       GLU 117  15.793  20.299 -29.607
  895    HB2  GLU 117           2HB      GLU 117  16.004  17.312 -30.108
  896    HB3  GLU 117           3HB      GLU 117  17.388  18.421 -29.992
  897    HG2  GLU 117           2HG      GLU 117  16.665  18.990 -27.642
  898    HG3  GLU 117           3HG      GLU 117  15.385  17.767 -27.801
  899    H    TRP 118           H        TRP 118  17.378  20.498 -31.447
  900    HA   TRP 118           HA       TRP 118  16.158  20.829 -34.007
  901    HB2  TRP 118           2HB      TRP 118  19.124  20.616 -33.302
  902    HB3  TRP 118           3HB      TRP 118  18.419  21.313 -34.775
  903    HD1  TRP 118           HD1      TRP 118  17.162  23.522 -34.546
  904    HE1  TRP 118           HE1      TRP 118  17.393  25.570 -32.878
  905    HE3  TRP 118           HE3      TRP 118  19.753  21.199 -30.793
  906    HZ2  TRP 118           HZ2      TRP 118  18.535  26.012 -30.309
  907    HZ3  TRP 118           HZ3      TRP 118  20.398  22.376 -28.797
  908    HH2  TRP 118           HH2      TRP 118  19.823  24.786 -28.465
  909    H    ILE 119           H        ILE 119  16.846  19.877 -36.004
  910    HA   ILE 119           HA       ILE 119  17.354  16.915 -35.971
  911    HB   ILE 119           HB       ILE 119  15.435  16.669 -37.560
  912   HG12  ILE 119          2HG1      ILE 119  14.751  19.509 -36.881
  913   HG13  ILE 119          3HG1      ILE 119  15.374  18.902 -38.431
  914   HG21  ILE 119          1HG2      ILE 119  14.650  17.853 -34.848
  915   HG22  ILE 119          2HG2      ILE 119  13.616  16.825 -35.863
  916   HG23  ILE 119          3HG2      ILE 119  15.097  16.159 -35.152
  917   HD11  ILE 119          3HD1      ILE 119  13.324  17.535 -38.724
  918   HD12  ILE 119          1HD1      ILE 119  12.695  18.146 -37.177
  919   HD13  ILE 119          2HD1      ILE 119  12.925  19.258 -38.538
  920    H    GLU 120           H        GLU 120  18.038  16.027 -37.895
  921    HA   GLU 120           HA       GLU 120  19.892  17.638 -39.384
  922    HB2  GLU 120           2HB      GLU 120  20.082  15.213 -38.936
  923    HB3  GLU 120           3HB      GLU 120  18.674  14.926 -39.981
  924    HG2  GLU 120           2HG      GLU 120  20.806  14.407 -41.120
  925    HG3  GLU 120           3HG      GLU 120  19.903  15.699 -41.934
  926    H    MET 121           H        MET 121  19.836  18.362 -41.530
  927    HA   MET 121           HA       MET 121  17.394  19.511 -42.433
  928    HB2  MET 121           2HB      MET 121  19.957  18.874 -43.936
  929    HB3  MET 121           3HB      MET 121  18.632  19.877 -44.570
  930    HG2  MET 121           2HG      MET 121  18.915  21.444 -42.702
  931    HG3  MET 121           3HG      MET 121  20.231  20.440 -42.055
  932    HE1  MET 121           3HE      MET 121  19.407  21.611 -45.797
  933    HE2  MET 121           1HE      MET 121  19.111  23.044 -44.785
  934    HE3  MET 121           2HE      MET 121  20.476  23.026 -45.926
  935    H    SER 122           H        SER 122  18.872  16.386 -43.240
  936    HA   SER 122           HA       SER 122  17.030  15.712 -45.366
  937    HB2  SER 122           2HB      SER 122  18.597  13.809 -43.605
  938    HB3  SER 122           3HB      SER 122  18.100  13.594 -45.300
  939    HG   SER 122           HG       SER 122  20.329  14.201 -45.093
  940    H    ASN 123           H        ASN 123  16.309  16.032 -42.073
  941    HA   ASN 123           HA       ASN 123  14.602  13.644 -41.874
  942    HB2  ASN 123           2HB      ASN 123  15.972  14.749 -39.964
  943    HB3  ASN 123           3HB      ASN 123  14.701  15.989 -39.964
  944   HD21  ASN 123          2HD2      ASN 123  13.393  15.596 -38.190
  945   HD22  ASN 123          1HD2      ASN 123  12.773  14.018 -37.754
  946    H    ARG 124           H        ARG 124  13.992  16.100 -43.800
  947    HA   ARG 124           HA       ARG 124  11.069  15.759 -43.358
  948    HB2  ARG 124           2HB      ARG 124  12.275  18.333 -44.335
  949    HB3  ARG 124           3HB      ARG 124  10.576  17.981 -43.981
  950    HG2  ARG 124           2HG      ARG 124  11.190  19.380 -42.254
  951    HG3  ARG 124           3HG      ARG 124  11.277  17.755 -41.546
  952    HD2  ARG 124           2HD      ARG 124  13.140  19.526 -40.990
  953    HD3  ARG 124           3HD      ARG 124  13.586  17.835 -41.294
  954    HE   ARG 124           HE       ARG 124  14.867  18.518 -42.986
  955   HH11  ARG 124          1HH2      ARG 124  12.532  21.163 -42.561
  956   HH12  ARG 124          2HH2      ARG 124  13.152  22.060 -43.929
  957   HH21  ARG 124          1HH1      ARG 124  15.523  19.613 -44.812
  958   HH22  ARG 124          2HH1      ARG 124  14.848  21.180 -45.228
  959    H    LYS 125           H        LYS 125   9.863  15.997 -45.388
  960    HA   LYS 125           HA       LYS 125  10.959  14.863 -47.735
  961    HB2  LYS 125           2HB      LYS 125   8.536  15.190 -47.001
  962    HB3  LYS 125           3HB      LYS 125   8.685  16.851 -47.616
  963    HG2  LYS 125           2HG      LYS 125   7.609  15.585 -49.327
  964    HG3  LYS 125           3HG      LYS 125   9.276  15.868 -49.870
  965    HD2  LYS 125           2HD      LYS 125   9.909  13.578 -49.218
  966    HD3  LYS 125           3HD      LYS 125   8.275  13.289 -48.573
  967    HE2  LYS 125           2HE      LYS 125   7.349  13.735 -50.857
  968    HE3  LYS 125           3HE      LYS 125   9.013  13.884 -51.468
  969    HZ1  LYS 125           3HZ      LYS 125   9.390  11.604 -50.808
  970    HZ2  LYS 125           1HZ      LYS 125   7.846  11.466 -50.241
  971    HZ3  LYS 125           2HZ      LYS 125   8.117  11.690 -51.851
  972    H    ASP 126           H        ASP 126  11.056  18.179 -46.679
  973    HA   ASP 126           HA       ASP 126  11.739  19.583 -49.025
  974    HB2  ASP 126           2HB      ASP 126  11.203  20.631 -46.969
  975    HB3  ASP 126           3HB      ASP 126  12.608  19.948 -46.126
  976    H    LEU 127           H        LEU 127  13.862  17.339 -47.257
  977    HA   LEU 127           HA       LEU 127  15.736  17.623 -49.545
  978    HB2  LEU 127           2HB      LEU 127  16.676  19.022 -47.813
  979    HB3  LEU 127           3HB      LEU 127  16.535  17.717 -46.615
  980    HG   LEU 127           HG       LEU 127  18.156  16.355 -47.910
  981   HD11  LEU 127          1HD1      LEU 127  18.481  18.850 -49.645
  982   HD12  LEU 127          2HD1      LEU 127  19.496  17.390 -49.722
  983   HD13  LEU 127          3HD1      LEU 127  17.783  17.303 -50.177
  984   HD21  LEU 127          3HD2      LEU 127  19.147  19.144 -47.205
  985   HD22  LEU 127          1HD2      LEU 127  18.964  17.771 -46.088
  986   HD23  LEU 127          2HD2      LEU 127  20.170  17.698 -47.389
  987    H    ILE 128           H        ILE 128  15.655  15.746 -50.444
  988    HA   ILE 128           HA       ILE 128  16.095  13.199 -48.929
  989    HB   ILE 128           HB       ILE 128  14.326  12.125 -50.343
  990   HG12  ILE 128          2HG1      ILE 128  13.485  14.897 -51.131
  991   HG13  ILE 128          3HG1      ILE 128  14.352  13.736 -52.162
  992   HG21  ILE 128          1HG2      ILE 128  13.283  14.406 -48.591
  993   HG22  ILE 128          2HG2      ILE 128  12.358  12.970 -49.073
  994   HG23  ILE 128          3HG2      ILE 128  13.772  12.797 -48.018
  995   HD11  ILE 128          3HD1      ILE 128  12.445  12.158 -51.999
  996   HD12  ILE 128          1HD1      ILE 128  11.571  13.320 -50.974
  997   HD13  ILE 128          2HD1      ILE 128  11.927  13.726 -52.663
  998    H    LYS 129           H        LYS 129  16.768  11.453 -50.298
  999    HA   LYS 129           HA       LYS 129  18.809  12.069 -52.158
 1000    HB2  LYS 129           2HB      LYS 129  18.663   9.953 -51.027
 1001    HB3  LYS 129           3HB      LYS 129  17.082   9.616 -51.767
 1002    HG2  LYS 129           2HG      LYS 129  18.894   8.287 -52.786
 1003    HG3  LYS 129           3HG      LYS 129  18.092   9.362 -53.952
 1004    HD2  LYS 129           2HD      LYS 129  19.955  10.929 -53.863
 1005    HD3  LYS 129           3HD      LYS 129  20.734   9.979 -52.578
 1006    HE2  LYS 129           2HE      LYS 129  21.794   9.616 -54.782
 1007    HE3  LYS 129           3HE      LYS 129  21.103   8.125 -54.103
 1008    HZ1  LYS 129           3HZ      LYS 129  19.214   8.421 -55.567
 1009    HZ2  LYS 129           1HZ      LYS 129  19.842   9.800 -56.192
 1010    HZ3  LYS 129           2HZ      LYS 129  20.608   8.352 -56.444
 1011    H    LYS 130           H        LYS 130  18.623  13.158 -53.990
 1012    HA   LYS 130           HA       LYS 130  16.288  13.336 -55.623
 1013    HB2  LYS 130           2HB      LYS 130  19.201  13.638 -56.403
 1014    HB3  LYS 130           3HB      LYS 130  17.798  14.188 -57.344
 1015    HG2  LYS 130           2HG      LYS 130  18.661  15.242 -54.620
 1016    HG3  LYS 130           3HG      LYS 130  18.910  16.058 -56.178
 1017    HD2  LYS 130           2HD      LYS 130  16.414  16.171 -56.468
 1018    HD3  LYS 130           3HD      LYS 130  16.227  15.470 -54.842
 1019    HE2  LYS 130           2HE      LYS 130  17.453  17.356 -53.861
 1020    HE3  LYS 130           3HE      LYS 130  17.719  18.046 -55.480
 1021    HZ1  LYS 130           3HZ      LYS 130  15.340  18.314 -55.684
 1022    HZ2  LYS 130           1HZ      LYS 130  15.094  17.675 -54.185
 1023    HZ3  LYS 130           2HZ      LYS 130  15.887  19.113 -54.349
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1   1.114 -25.563   1.335
    2    H2   MET   1           H2       MET   1   1.759 -26.899   2.062
    3    H3   MET   1           H3       MET   1   0.405 -27.035   1.107
    4    HA   MET   1           HA       MET   1   3.052 -27.280   0.390
    5    HB2  MET   1           2HB      MET   1   0.438 -27.273  -1.182
    6    HB3  MET   1           3HB      MET   1   2.017 -27.598  -1.911
    7    HG2  MET   1           2HG      MET   1   1.051 -29.699  -1.503
    8    HG3  MET   1           3HG      MET   1   2.327 -29.493  -0.304
    9    HE1  MET   1           3HE      MET   1   0.074 -31.785  -0.238
   10    HE2  MET   1           1HE      MET   1   1.364 -31.633   0.975
   11    HE3  MET   1           2HE      MET   1  -0.328 -31.795   1.491
   12    H    ALA   2           H        ALA   2   4.484 -25.943  -0.655
   13    HA   ALA   2           HA       ALA   2   3.961 -23.181  -1.026
   14    HB1  ALA   2           1HB      ALA   2   6.100 -24.981  -2.248
   15    HB2  ALA   2           2HB      ALA   2   6.135 -23.213  -2.207
   16    HB3  ALA   2           3HB      ALA   2   6.220 -24.123  -0.687
   17    H    ALA   3           H        ALA   3   3.874 -21.981  -3.006
   18    HA   ALA   3           HA       ALA   3   2.231 -23.014  -5.122
   19    HB1  ALA   3           1HB      ALA   3   4.030 -20.545  -5.006
   20    HB2  ALA   3           2HB      ALA   3   2.757 -20.855  -6.211
   21    HB3  ALA   3           3HB      ALA   3   2.320 -20.618  -4.512
   22    H    LYS   4           H        LYS   4   2.902 -23.065  -7.434
   23    HA   LYS   4           HA       LYS   4   5.201 -24.667  -7.960
   24    HB2  LYS   4           2HB      LYS   4   4.705 -24.329 -10.303
   25    HB3  LYS   4           3HB      LYS   4   3.203 -24.591  -9.407
   26    HG2  LYS   4           2HG      LYS   4   2.744 -22.141  -9.458
   27    HG3  LYS   4           3HG      LYS   4   4.260 -21.880 -10.334
   28    HD2  LYS   4           2HD      LYS   4   2.467 -21.801 -11.916
   29    HD3  LYS   4           3HD      LYS   4   3.407 -23.275 -12.209
   30    HE2  LYS   4           2HE      LYS   4   1.711 -24.603 -10.976
   31    HE3  LYS   4           3HE      LYS   4   0.784 -23.128 -10.644
   32    HZ1  LYS   4           3HZ      LYS   4   0.450 -22.875 -13.014
   33    HZ2  LYS   4           1HZ      LYS   4   1.312 -24.238 -13.331
   34    HZ3  LYS   4           2HZ      LYS   4  -0.124 -24.322 -12.522
   35    H    PHE   5           H        PHE   5   4.899 -21.202  -7.752
   36    HA   PHE   5           HA       PHE   5   7.301 -20.534  -9.178
   37    HB2  PHE   5           2HB      PHE   5   5.696 -19.020  -7.073
   38    HB3  PHE   5           3HB      PHE   5   6.898 -18.284  -8.126
   39    HD1  PHE   5           HD2      PHE   5   6.474 -18.276 -10.672
   40    HD2  PHE   5           HD1      PHE   5   3.462 -19.288  -7.769
   41    HE1  PHE   5           HE2      PHE   5   4.711 -18.072 -12.410
   42    HE2  PHE   5           HE1      PHE   5   1.709 -19.135  -9.533
   43    HZ   PHE   5           HZ       PHE   5   2.346 -18.551 -11.866
   44    H    GLU   6           H        GLU   6   9.313 -20.136  -8.405
   45    HA   GLU   6           HA       GLU   6   9.964 -20.442  -5.548
   46    HB2  GLU   6           2HB      GLU   6  11.207 -21.996  -7.853
   47    HB3  GLU   6           3HB      GLU   6  11.960 -21.808  -6.260
   48    HG2  GLU   6           2HG      GLU   6   9.936 -22.890  -5.227
   49    HG3  GLU   6           3HG      GLU   6   9.313 -23.182  -6.854
   50    H    VAL   7           H        VAL   7  11.912 -19.311  -5.059
   51    HA   VAL   7           HA       VAL   7  12.310 -16.860  -6.355
   52    HB   VAL   7           HB       VAL   7  14.320 -18.330  -4.595
   53   HG11  VAL   7          1HG1      VAL   7  13.753 -15.359  -5.034
   54   HG12  VAL   7          2HG1      VAL   7  14.944 -16.025  -3.896
   55   HG13  VAL   7          3HG1      VAL   7  15.165 -16.240  -5.637
   56   HG21  VAL   7          3HG2      VAL   7  11.933 -16.634  -3.776
   57   HG22  VAL   7          1HG2      VAL   7  12.106 -18.367  -3.487
   58   HG23  VAL   7          2HG2      VAL   7  13.194 -17.246  -2.676
   59    H    GLY   8           H        GLY   8  13.390 -16.183  -8.030
   60    HA2  GLY   8           2HA      GLY   8  15.201 -16.052  -9.497
   61    HA3  GLY   8           3HA      GLY   8  15.654 -17.727  -9.134
   62    H    SER   9           H        SER   9  12.514 -18.319  -9.587
   63    HA   SER   9           HA       SER   9  12.669 -19.016 -12.347
   64    HB2  SER   9           2HB      SER   9  10.143 -18.564 -10.717
   65    HB3  SER   9           3HB      SER   9  10.361 -19.606 -12.140
   66    HG   SER   9           HG       SER   9  10.417 -20.797 -10.137
   67    H    VAL  10           H        VAL  10  11.119 -18.188 -14.049
   68    HA   VAL  10           HA       VAL  10  10.473 -15.313 -13.827
   69    HB   VAL  10           HB       VAL  10  12.013 -16.559 -16.143
   70   HG11  VAL  10          1HG1      VAL  10  11.139 -13.670 -15.654
   71   HG12  VAL  10          2HG1      VAL  10  12.134 -14.237 -17.011
   72   HG13  VAL  10          3HG1      VAL  10  10.457 -14.767 -16.871
   73   HG21  VAL  10          3HG2      VAL  10  12.955 -14.505 -14.106
   74   HG22  VAL  10          1HG2      VAL  10  13.527 -16.187 -14.232
   75   HG23  VAL  10          2HG2      VAL  10  13.856 -15.045 -15.538
   76    H    TYR  11           H        TYR  11   8.491 -14.951 -14.568
   77    HA   TYR  11           HA       TYR  11   7.144 -16.776 -16.471
   78    HB2  TYR  11           2HB      TYR  11   6.347 -16.253 -13.594
   79    HB3  TYR  11           3HB      TYR  11   5.153 -16.718 -14.791
   80    HD1  TYR  11           HD1      TYR  11   5.261 -18.960 -15.921
   81    HD2  TYR  11           HD2      TYR  11   7.869 -17.906 -12.656
   82    HE1  TYR  11           HE1      TYR  11   5.691 -21.360 -15.503
   83    HE2  TYR  11           HE2      TYR  11   8.254 -20.324 -12.189
   84    HH   TYR  11           HH       TYR  11   6.779 -22.919 -14.166
   85    H    THR  12           H        THR  12   4.785 -15.743 -16.807
   86    HA   THR  12           HA       THR  12   5.080 -12.781 -16.918
   87    HB   THR  12           HB       THR  12   3.907 -14.566 -19.071
   88    HG1  THR  12           1HG      THR  12   5.821 -14.155 -20.191
   89   HG21  THR  12          1HG2      THR  12   4.846 -11.664 -19.164
   90   HG22  THR  12          2HG2      THR  12   4.192 -12.590 -20.529
   91   HG23  THR  12          3HG2      THR  12   3.156 -12.203 -19.152
   92    H    GLY  13           H        GLY  13   3.183 -11.579 -16.668
   93    HA2  GLY  13           2HA      GLY  13   0.677 -12.936 -15.976
   94    HA3  GLY  13           3HA      GLY  13   1.562 -12.199 -14.628
   95    H    LYS  14           H        LYS  14  -0.729 -11.052 -14.803
   96    HA   LYS  14           HA       LYS  14  -0.459  -8.634 -16.569
   97    HB2  LYS  14           2HB      LYS  14  -2.835 -10.254 -15.671
   98    HB3  LYS  14           3HB      LYS  14  -3.016  -8.504 -15.791
   99    HG2  LYS  14           2HG      LYS  14  -3.752  -9.413 -17.843
  100    HG3  LYS  14           3HG      LYS  14  -2.231  -8.569 -18.152
  101    HD2  LYS  14           2HD      LYS  14  -1.024 -10.622 -18.429
  102    HD3  LYS  14           3HD      LYS  14  -2.335 -11.581 -17.698
  103    HE2  LYS  14           2HE      LYS  14  -3.831 -10.915 -19.585
  104    HE3  LYS  14           3HE      LYS  14  -2.469 -10.052 -20.332
  105    HZ1  LYS  14           3HZ      LYS  14  -1.302 -12.139 -20.541
  106    HZ2  LYS  14           1HZ      LYS  14  -2.547 -12.967 -19.815
  107    HZ3  LYS  14           2HZ      LYS  14  -2.732 -12.233 -21.285
  108    H    VAL  15           H        VAL  15  -0.377  -6.662 -15.593
  109    HA   VAL  15           HA       VAL  15   0.028  -6.521 -12.746
  110    HB   VAL  15           HB       VAL  15  -0.540  -4.218 -14.629
  111   HG11  VAL  15          1HG1      VAL  15   1.167  -4.462 -12.097
  112   HG12  VAL  15          2HG1      VAL  15   0.963  -2.986 -13.062
  113   HG13  VAL  15          3HG1      VAL  15  -0.423  -3.672 -12.200
  114   HG21  VAL  15          3HG2      VAL  15   2.153  -5.551 -14.189
  115   HG22  VAL  15          1HG2      VAL  15   1.230  -5.521 -15.702
  116   HG23  VAL  15          2HG2      VAL  15   1.869  -4.025 -15.062
  117    H    THR  16           H        THR  16  -1.444  -6.267 -11.197
  118    HA   THR  16           HA       THR  16  -4.279  -5.772 -11.945
  119    HB   THR  16           HB       THR  16  -4.588  -7.237  -9.784
  120    HG1  THR  16           1HG      THR  16  -2.923  -8.743  -9.536
  121   HG21  THR  16          1HG2      THR  16  -3.595  -8.430 -12.410
  122   HG22  THR  16          2HG2      THR  16  -4.587  -9.253 -11.184
  123   HG23  THR  16          3HG2      THR  16  -5.258  -7.898 -12.071
  124    H    GLY  17           H        GLY  17  -1.704  -4.345 -10.147
  125    HA2  GLY  17           2HA      GLY  17  -3.470  -2.183  -9.597
  126    HA3  GLY  17           3HA      GLY  17  -3.159  -3.070  -8.096
  127    H    LEU  18           H        LEU  18  -2.350  -0.419  -8.450
  128    HA   LEU  18           HA       LEU  18   0.595  -0.737  -8.118
  129    HB2  LEU  18           2HB      LEU  18  -0.958   1.663  -9.145
  130    HB3  LEU  18           3HB      LEU  18   0.739   1.716  -8.682
  131    HG   LEU  18           HG       LEU  18  -0.422   0.110 -10.977
  132   HD11  LEU  18          1HD1      LEU  18   1.353   2.581 -10.975
  133   HD12  LEU  18          2HD1      LEU  18   0.842   1.686 -12.413
  134   HD13  LEU  18          3HD1      LEU  18  -0.362   2.532 -11.425
  135   HD21  LEU  18          3HD2      LEU  18   2.469   0.382 -10.174
  136   HD22  LEU  18          1HD2      LEU  18   1.457  -1.083 -10.086
  137   HD23  LEU  18          2HD2      LEU  18   1.856  -0.391 -11.654
  138    H    GLN  19           H        GLN  19   1.438   0.307  -6.361
  139    HA   GLN  19           HA       GLN  19  -0.279   1.771  -4.452
  140    HB2  GLN  19           2HB      GLN  19   1.565  -0.537  -3.696
  141    HB3  GLN  19           3HB      GLN  19   0.607   0.463  -2.600
  142    HG2  GLN  19           2HG      GLN  19  -1.484  -0.451  -3.657
  143    HG3  GLN  19           3HG      GLN  19  -0.477  -1.561  -4.605
  144   HE21  GLN  19          2HE2      GLN  19   1.085  -2.979  -3.281
  145   HE22  GLN  19          1HE2      GLN  19   0.455  -3.543  -1.736
  146    H    ALA  20           H        ALA  20   1.166   2.974  -2.921
  147    HA   ALA  20           HA       ALA  20   3.332   4.242  -4.182
  148    HB1  ALA  20           1HB      ALA  20   2.645   4.131  -1.212
  149    HB2  ALA  20           2HB      ALA  20   3.648   5.358  -2.015
  150    HB3  ALA  20           3HB      ALA  20   1.922   5.243  -2.407
  151    H    TYR  21           H        TYR  21   3.471   1.136  -2.914
  152    HA   TYR  21           HA       TYR  21   6.435   1.256  -2.722
  153    HB2  TYR  21           2HB      TYR  21   6.393  -0.243  -0.842
  154    HB3  TYR  21           3HB      TYR  21   5.465   1.203  -0.485
  155    HD1  TYR  21           HD2      TYR  21   2.964   1.107  -0.322
  156    HD2  TYR  21           HD1      TYR  21   5.343  -2.444  -0.901
  157    HE1  TYR  21           HE2      TYR  21   1.036  -0.300   0.383
  158    HE2  TYR  21           HE1      TYR  21   3.447  -3.843  -0.146
  159    HH   TYR  21           HH       TYR  21   1.280  -3.877   0.588
  160    H    GLY  22           H        GLY  22   3.977   0.006  -4.640
  161    HA2  GLY  22           2HA      GLY  22   5.761  -1.568  -6.053
  162    HA3  GLY  22           3HA      GLY  22   5.007  -2.673  -4.906
  163    H    ALA  23           H        ALA  23   4.650  -3.391  -7.341
  164    HA   ALA  23           HA       ALA  23   1.930  -2.544  -8.262
  165    HB1  ALA  23           1HB      ALA  23   4.337  -3.488  -9.887
  166    HB2  ALA  23           2HB      ALA  23   2.712  -3.192 -10.524
  167    HB3  ALA  23           3HB      ALA  23   3.673  -1.847  -9.873
  168    H    PHE  24           H        PHE  24   0.478  -4.171  -8.010
  169    HA   PHE  24           HA       PHE  24   1.380  -6.885  -7.397
  170    HB2  PHE  24           2HB      PHE  24  -1.352  -5.596  -7.797
  171    HB3  PHE  24           3HB      PHE  24  -1.131  -7.330  -7.625
  172    HD1  PHE  24           HD2      PHE  24   0.529  -7.971  -5.540
  173    HD2  PHE  24           HD1      PHE  24  -2.022  -4.504  -5.835
  174    HE1  PHE  24           HE2      PHE  24   0.405  -7.848  -3.066
  175    HE2  PHE  24           HE1      PHE  24  -2.152  -4.396  -3.362
  176    HZ   PHE  24           HZ       PHE  24  -0.947  -6.054  -1.973
  177    H    VAL  25           H        VAL  25   1.454  -8.590  -8.800
  178    HA   VAL  25           HA       VAL  25   0.286  -8.275 -11.509
  179    HB   VAL  25           HB       VAL  25   3.014  -9.495 -10.923
  180   HG11  VAL  25          1HG1      VAL  25   1.572  -8.901 -13.542
  181   HG12  VAL  25          2HG1      VAL  25   3.205  -9.565 -13.393
  182   HG13  VAL  25          3HG1      VAL  25   1.819 -10.515 -12.840
  183   HG21  VAL  25          3HG2      VAL  25   2.356  -6.846 -12.274
  184   HG22  VAL  25          1HG2      VAL  25   3.147  -7.041 -10.702
  185   HG23  VAL  25          2HG2      VAL  25   3.969  -7.588 -12.157
  186    H    ALA  26           H        ALA  26  -1.267  -9.688 -11.605
  187    HA   ALA  26           HA       ALA  26  -1.354 -12.114 -10.002
  188    HB1  ALA  26           1HB      ALA  26  -3.128 -11.127 -12.261
  189    HB2  ALA  26           2HB      ALA  26  -3.456 -12.524 -11.204
  190    HB3  ALA  26           3HB      ALA  26  -3.396 -10.902 -10.507
  191    H    LEU  27           H        LEU  27  -1.294 -14.184 -10.779
  192    HA   LEU  27           HA       LEU  27   0.398 -14.628 -13.210
  193    HB2  LEU  27           2HB      LEU  27   0.664 -15.598 -10.342
  194    HB3  LEU  27           3HB      LEU  27   1.468 -16.410 -11.680
  195    HG   LEU  27           HG       LEU  27   1.889 -13.452 -11.093
  196   HD11  LEU  27          1HD1      LEU  27   3.551 -15.823 -10.144
  197   HD12  LEU  27          2HD1      LEU  27   3.981 -14.109  -9.966
  198   HD13  LEU  27          3HD1      LEU  27   2.569 -14.758  -9.120
  199   HD21  LEU  27          3HD2      LEU  27   3.525 -15.482 -12.680
  200   HD22  LEU  27          1HD2      LEU  27   2.517 -14.190 -13.368
  201   HD23  LEU  27          2HD2      LEU  27   3.941 -13.772 -12.417
  202    H    ASP  28           H        ASP  28  -2.136 -15.725 -11.027
  203    HA   ASP  28           HA       ASP  28  -3.209 -17.576 -13.019
  204    HB2  ASP  28           2HB      ASP  28  -1.703 -19.043 -11.772
  205    HB3  ASP  28           3HB      ASP  28  -2.338 -18.446 -10.237
  206    H    GLU  29           H        GLU  29  -5.514 -18.072 -12.321
  207    HA   GLU  29           HA       GLU  29  -6.872 -15.892 -11.166
  208    HB2  GLU  29           2HB      GLU  29  -8.835 -17.298 -11.212
  209    HB3  GLU  29           3HB      GLU  29  -7.902 -17.467 -12.702
  210    HG2  GLU  29           2HG      GLU  29  -6.971 -19.613 -11.901
  211    HG3  GLU  29           3HG      GLU  29  -7.876 -19.455 -10.391
  212    H    GLU  30           H        GLU  30  -5.208 -18.433  -9.475
  213    HA   GLU  30           HA       GLU  30  -6.068 -17.140  -6.933
  214    HB2  GLU  30           2HB      GLU  30  -5.665 -20.097  -7.510
  215    HB3  GLU  30           3HB      GLU  30  -5.846 -19.406  -5.889
  216    HG2  GLU  30           2HG      GLU  30  -8.084 -18.524  -6.523
  217    HG3  GLU  30           3HG      GLU  30  -7.951 -19.348  -8.076
  218    H    THR  31           H        THR  31  -3.601 -16.705  -8.758
  219    HA   THR  31           HA       THR  31  -1.892 -16.556  -6.351
  220    HB   THR  31           HB       THR  31  -0.750 -17.654  -8.948
  221    HG1  THR  31           1HG      THR  31  -0.653 -19.648  -7.807
  222   HG21  THR  31          1HG2      THR  31   0.390 -17.525  -6.114
  223   HG22  THR  31          2HG2      THR  31   1.180 -18.261  -7.516
  224   HG23  THR  31          3HG2      THR  31   0.900 -16.518  -7.490
  225    H    GLN  32           H        GLN  32  -0.637 -14.792  -6.244
  226    HA   GLN  32           HA       GLN  32  -0.190 -12.977  -8.503
  227    HB2  GLN  32           2HB      GLN  32  -2.415 -12.340  -7.744
  228    HB3  GLN  32           3HB      GLN  32  -1.898 -12.356  -6.053
  229    HG2  GLN  32           2HG      GLN  32  -0.590 -10.372  -6.320
  230    HG3  GLN  32           3HG      GLN  32  -0.756 -10.394  -8.074
  231   HE21  GLN  32          2HE2      GLN  32  -1.949  -8.910  -5.295
  232   HE22  GLN  32          1HE2      GLN  32  -3.465  -8.368  -5.962
  233    H    GLY  33           H        GLY  33   1.467 -11.417  -7.935
  234    HA2  GLY  33           2HA      GLY  33   2.693 -11.650  -5.246
  235    HA3  GLY  33           3HA      GLY  33   3.718 -11.923  -6.667
  236    H    LEU  34           H        LEU  34   4.616  -9.940  -5.261
  237    HA   LEU  34           HA       LEU  34   3.407  -7.391  -6.250
  238    HB2  LEU  34           2HB      LEU  34   2.874  -7.775  -3.908
  239    HB3  LEU  34           3HB      LEU  34   4.575  -8.095  -3.533
  240    HG   LEU  34           HG       LEU  34   5.148  -5.742  -4.152
  241   HD11  LEU  34          1HD1      LEU  34   2.123  -5.374  -4.400
  242   HD12  LEU  34          2HD1      LEU  34   3.343  -4.084  -4.434
  243   HD13  LEU  34          3HD1      LEU  34   3.301  -5.274  -5.724
  244   HD21  LEU  34          3HD2      LEU  34   2.944  -6.010  -2.069
  245   HD22  LEU  34          1HD2      LEU  34   4.686  -6.301  -1.821
  246   HD23  LEU  34          2HD2      LEU  34   4.119  -4.674  -2.204
  247    H    VAL  35           H        VAL  35   4.774  -6.689  -7.801
  248    HA   VAL  35           HA       VAL  35   7.657  -6.846  -7.617
  249    HB   VAL  35           HB       VAL  35   5.921  -4.870  -9.154
  250   HG11  VAL  35          1HG1      VAL  35   8.819  -5.751  -9.527
  251   HG12  VAL  35          2HG1      VAL  35   7.930  -4.628 -10.579
  252   HG13  VAL  35          3HG1      VAL  35   8.288  -4.175  -8.915
  253   HG21  VAL  35          3HG2      VAL  35   7.061  -7.517 -10.128
  254   HG22  VAL  35          1HG2      VAL  35   5.335  -7.156  -9.841
  255   HG23  VAL  35          2HG2      VAL  35   6.211  -6.308 -11.111
  256    H    HIS  36           H        HIS  36   8.778  -5.783  -6.000
  257    HA   HIS  36           HA       HIS  36   7.512  -3.619  -4.497
  258    HB2  HIS  36           2HB      HIS  36  10.273  -4.903  -4.436
  259    HB3  HIS  36           3HB      HIS  36   9.795  -3.554  -3.400
  260    HD1  HIS  36           HD1      HIS  36   7.654  -6.752  -4.150
  261    HD2  HIS  36           HD2      HIS  36   9.582  -4.669  -1.022
  262    HE1  HIS  36           HE1      HIS  36   7.007  -7.904  -2.014
  263    H    ILE  37           H        ILE  37   8.088  -1.430  -4.564
  264    HA   ILE  37           HA       ILE  37   8.272  -0.366  -7.119
  265    HB   ILE  37           HB       ILE  37   7.285   0.735  -5.157
  266   HG12  ILE  37          2HG1      ILE  37   9.303   2.481  -6.559
  267   HG13  ILE  37          3HG1      ILE  37   7.796   1.879  -7.280
  268   HG21  ILE  37          1HG2      ILE  37  10.156   1.412  -4.364
  269   HG22  ILE  37          2HG2      ILE  37   8.712   2.078  -3.617
  270   HG23  ILE  37          3HG2      ILE  37   9.045   0.356  -3.459
  271   HD11  ILE  37          3HD1      ILE  37   6.474   3.063  -5.555
  272   HD12  ILE  37          1HD1      ILE  37   7.970   3.698  -4.837
  273   HD13  ILE  37          2HD1      ILE  37   7.511   4.180  -6.468
  274    H    SER  38           H        SER  38  11.095  -0.706  -4.934
  275    HA   SER  38           HA       SER  38  12.884   0.648  -6.675
  276    HB2  SER  38           2HB      SER  38  13.537  -1.512  -4.645
  277    HB3  SER  38           3HB      SER  38  14.575  -0.179  -5.194
  278    HG   SER  38           HG       SER  38  13.578   0.243  -3.161
  279    H    GLU  39           H        GLU  39  11.419  -2.388  -7.053
  280    HA   GLU  39           HA       GLU  39  13.477  -3.322  -8.965
  281    HB2  GLU  39           2HB      GLU  39  11.462  -4.750  -7.206
  282    HB3  GLU  39           3HB      GLU  39  12.176  -5.523  -8.614
  283    HG2  GLU  39           2HG      GLU  39  13.484  -6.212  -6.760
  284    HG3  GLU  39           3HG      GLU  39  14.433  -5.119  -7.741
  285    H    VAL  40           H        VAL  40  10.893  -1.403  -9.212
  286    HA   VAL  40           HA       VAL  40   9.543  -2.702 -11.433
  287    HB   VAL  40           HB       VAL  40   9.608   0.149 -10.404
  288   HG11  VAL  40          1HG1      VAL  40   7.748  -1.041 -12.494
  289   HG12  VAL  40          2HG1      VAL  40   7.592   0.574 -11.756
  290   HG13  VAL  40          3HG1      VAL  40   8.973   0.201 -12.793
  291   HG21  VAL  40          3HG2      VAL  40   7.524  -2.087 -10.205
  292   HG22  VAL  40          1HG2      VAL  40   8.559  -1.519  -8.890
  293   HG23  VAL  40          2HG2      VAL  40   7.341  -0.440  -9.569
  294    H    THR  41           H        THR  41  12.351  -0.515 -11.187
  295    HA   THR  41           HA       THR  41  13.394  -1.410 -13.722
  296    HB   THR  41           HB       THR  41  11.682   0.091 -14.629
  297    HG1  THR  41           1HG      THR  41  13.028   1.415 -15.823
  298   HG21  THR  41          1HG2      THR  41  13.019   2.314 -13.028
  299   HG22  THR  41          2HG2      THR  41  11.753   2.511 -14.258
  300   HG23  THR  41          3HG2      THR  41  11.383   1.655 -12.767
  301    H    HIS  42           H        HIS  42  15.074   0.854 -14.062
  302    HA   HIS  42           HA       HIS  42  17.302  -0.029 -12.701
  303    HB2  HIS  42           2HB      HIS  42  17.077   1.470 -14.772
  304    HB3  HIS  42           3HB      HIS  42  16.891   2.823 -13.652
  305    HD1  HIS  42           HD1      HIS  42  19.293   2.111 -11.654
  306    HD2  HIS  42           HD2      HIS  42  19.421   2.072 -15.869
  307    HE1  HIS  42           HE1      HIS  42  21.719   2.448 -12.311
  308    H    GLY  43           H        GLY  43  15.063   2.462 -11.446
  309    HA2  GLY  43           2HA      GLY  43  15.194   2.007  -8.873
  310    HA3  GLY  43           3HA      GLY  43  16.786   2.765  -9.040
  311    H    PHE  44           H        PHE  44  15.327   4.466 -11.280
  312    HA   PHE  44           HA       PHE  44  14.975   6.777  -9.615
  313    HB2  PHE  44           2HB      PHE  44  14.333   6.524 -12.569
  314    HB3  PHE  44           3HB      PHE  44  14.865   7.964 -11.701
  315    HD1  PHE  44           HD2      PHE  44  17.291   7.581 -10.438
  316    HD2  PHE  44           HD1      PHE  44  15.887   5.550 -13.983
  317    HE1  PHE  44           HE2      PHE  44  19.628   7.048 -11.067
  318    HE2  PHE  44           HE1      PHE  44  18.238   5.026 -14.603
  319    HZ   PHE  44           HZ       PHE  44  20.103   5.762 -13.143
  320    H    VAL  45           H        VAL  45  12.998   4.719  -9.117
  321    HA   VAL  45           HA       VAL  45  10.484   5.425 -10.338
  322    HB   VAL  45           HB       VAL  45  10.883   3.440  -8.079
  323   HG11  VAL  45          1HG1      VAL  45   9.035   3.524 -10.522
  324   HG12  VAL  45          2HG1      VAL  45   9.049   2.260  -9.273
  325   HG13  VAL  45          3HG1      VAL  45   8.559   3.910  -8.854
  326   HG21  VAL  45          3HG2      VAL  45  11.405   2.955 -11.032
  327   HG22  VAL  45          1HG2      VAL  45  12.635   2.903  -9.747
  328   HG23  VAL  45          2HG2      VAL  45  11.359   1.704  -9.767
  329    H    LYS  46           H        LYS  46  11.171   7.645  -9.375
  330    HA   LYS  46           HA       LYS  46  10.409   8.473  -6.804
  331    HB2  LYS  46           2HB      LYS  46  10.168  10.681  -7.791
  332    HB3  LYS  46           3HB      LYS  46  11.573   9.857  -8.466
  333    HG2  LYS  46           2HG      LYS  46  10.084   9.215 -10.470
  334    HG3  LYS  46           3HG      LYS  46   8.867  10.303  -9.792
  335    HD2  LYS  46           2HD      LYS  46  10.057  11.478 -11.513
  336    HD3  LYS  46           3HD      LYS  46  10.474  12.183  -9.950
  337    HE2  LYS  46           2HE      LYS  46  12.471  12.055 -11.294
  338    HE3  LYS  46           3HE      LYS  46  12.619  10.927  -9.943
  339    HZ1  LYS  46           3HZ      LYS  46  12.062   9.117 -11.466
  340    HZ2  LYS  46           1HZ      LYS  46  11.912  10.185 -12.719
  341    HZ3  LYS  46           2HZ      LYS  46  13.364   9.938 -11.995
  342    H    ASP  47           H        ASP  47   8.297   7.650  -9.526
  343    HA   ASP  47           HA       ASP  47   6.150   7.226  -7.595
  344    HB2  ASP  47           2HB      ASP  47   5.586   9.458  -8.375
  345    HB3  ASP  47           3HB      ASP  47   5.754   8.968 -10.069
  346    H    ILE  48           H        ILE  48   4.960   5.408  -8.273
  347    HA   ILE  48           HA       ILE  48   6.395   3.705 -10.141
  348    HB   ILE  48           HB       ILE  48   5.517   3.034  -7.897
  349   HG12  ILE  48          2HG1      ILE  48   4.497   1.364 -10.200
  350   HG13  ILE  48          3HG1      ILE  48   6.183   1.479  -9.675
  351   HG21  ILE  48          1HG2      ILE  48   2.786   3.137  -9.254
  352   HG22  ILE  48          2HG2      ILE  48   3.110   2.442  -7.668
  353   HG23  ILE  48          3HG2      ILE  48   3.329   4.166  -7.915
  354   HD11  ILE  48          3HD1      ILE  48   5.573   0.607  -7.435
  355   HD12  ILE  48          1HD1      ILE  48   3.880   0.467  -7.956
  356   HD13  ILE  48          2HD1      ILE  48   5.119  -0.524  -8.724
  357    H    ASN  49           H        ASN  49   3.340   5.525 -10.400
  358    HA   ASN  49           HA       ASN  49   2.440   4.032 -12.697
  359    HB2  ASN  49           2HB      ASN  49   0.592   5.223 -12.416
  360    HB3  ASN  49           3HB      ASN  49   1.343   6.014 -11.027
  361   HD21  ASN  49          2HD2      ASN  49   2.695   8.008 -11.551
  362   HD22  ASN  49          1HD2      ASN  49   2.178   9.009 -12.898
  363    H    GLU  50           H        GLU  50   4.853   6.505 -12.335
  364    HA   GLU  50           HA       GLU  50   4.915   7.191 -15.161
  365    HB2  GLU  50           2HB      GLU  50   6.981   7.523 -12.950
  366    HB3  GLU  50           3HB      GLU  50   7.081   8.250 -14.553
  367    HG2  GLU  50           2HG      GLU  50   4.982   8.836 -12.425
  368    HG3  GLU  50           3HG      GLU  50   6.316   9.868 -12.899
  369    H    HIS  51           H        HIS  51   5.683   4.278 -13.624
  370    HA   HIS  51           HA       HIS  51   7.780   3.607 -15.648
  371    HB2  HIS  51           2HB      HIS  51   7.905   2.977 -12.673
  372    HB3  HIS  51           3HB      HIS  51   9.062   2.477 -13.908
  373    HD1  HIS  51           HD1      HIS  51   8.053   5.556 -11.862
  374    HD2  HIS  51           HD2      HIS  51  10.738   4.432 -14.916
  375    HE1  HIS  51           HE1      HIS  51   9.709   7.422 -12.087
  376    H    LEU  52           H        LEU  52   4.934   2.509 -13.892
  377    HA   LEU  52           HA       LEU  52   4.819   0.250 -15.769
  378    HB2  LEU  52           2HB      LEU  52   5.733  -0.352 -13.294
  379    HB3  LEU  52           3HB      LEU  52   4.012  -0.361 -12.941
  380    HG   LEU  52           HG       LEU  52   3.822  -1.938 -15.049
  381   HD11  LEU  52          1HD1      LEU  52   6.788  -2.242 -14.387
  382   HD12  LEU  52          2HD1      LEU  52   5.857  -3.265 -15.491
  383   HD13  LEU  52          3HD1      LEU  52   6.131  -1.564 -15.889
  384   HD21  LEU  52          3HD2      LEU  52   5.174  -2.904 -12.506
  385   HD22  LEU  52          1HD2      LEU  52   3.427  -2.693 -12.766
  386   HD23  LEU  52          2HD2      LEU  52   4.306  -3.920 -13.687
  387    H    SER  53           H        SER  53   2.464  -0.857 -15.287
  388    HA   SER  53           HA       SER  53   0.424   1.281 -15.056
  389    HB2  SER  53           2HB      SER  53   1.010  -0.393 -17.539
  390    HB3  SER  53           3HB      SER  53  -0.427   0.623 -17.306
  391    HG   SER  53           HG       SER  53   1.188   1.709 -18.485
  392    H    VAL  54           H        VAL  54  -1.485   0.346 -14.221
  393    HA   VAL  54           HA       VAL  54  -1.775  -2.522 -13.919
  394    HB   VAL  54           HB       VAL  54  -3.950  -0.391 -13.761
  395   HG11  VAL  54          1HG1      VAL  54  -3.691  -3.140 -12.446
  396   HG12  VAL  54          2HG1      VAL  54  -5.021  -1.990 -12.196
  397   HG13  VAL  54          3HG1      VAL  54  -4.792  -2.734 -13.774
  398   HG21  VAL  54          3HG2      VAL  54  -2.120  -1.386 -11.548
  399   HG22  VAL  54          1HG2      VAL  54  -2.138   0.254 -12.245
  400   HG23  VAL  54          2HG2      VAL  54  -3.532  -0.319 -11.329
  401    H    GLY  55           H        GLY  55  -3.228  -3.888 -15.098
  402    HA2  GLY  55           2HA      GLY  55  -4.313  -4.648 -16.966
  403    HA3  GLY  55           3HA      GLY  55  -4.697  -2.964 -17.393
  404    H    ASP  56           H        ASP  56  -1.431  -4.332 -16.889
  405    HA   ASP  56           HA       ASP  56  -0.979  -4.424 -19.833
  406    HB2  ASP  56           2HB      ASP  56   0.149  -2.469 -18.800
  407    HB3  ASP  56           3HB      ASP  56   1.015  -3.553 -17.705
  408    H    GLU  57           H        GLU  57   0.551  -6.120 -20.438
  409    HA   GLU  57           HA       GLU  57   0.706  -8.352 -18.478
  410    HB2  GLU  57           2HB      GLU  57  -0.293  -8.910 -20.631
  411    HB3  GLU  57           3HB      GLU  57   1.105  -8.235 -21.489
  412    HG2  GLU  57           2HG      GLU  57   2.570  -9.960 -20.525
  413    HG3  GLU  57           3HG      GLU  57   1.233 -10.587 -19.555
  414    H    VAL  58           H        VAL  58   2.673  -8.889 -17.631
  415    HA   VAL  58           HA       VAL  58   5.137  -7.623 -18.700
  416    HB   VAL  58           HB       VAL  58   5.753  -6.923 -16.414
  417   HG11  VAL  58          1HG1      VAL  58   3.142  -5.657 -17.364
  418   HG12  VAL  58          2HG1      VAL  58   4.288  -4.933 -16.232
  419   HG13  VAL  58          3HG1      VAL  58   4.768  -5.227 -17.910
  420   HG21  VAL  58          3HG2      VAL  58   2.892  -7.589 -15.625
  421   HG22  VAL  58          1HG2      VAL  58   4.370  -8.391 -15.054
  422   HG23  VAL  58          2HG2      VAL  58   4.081  -6.705 -14.637
  423    H    GLN  59           H        GLN  59   6.945  -8.809 -18.401
  424    HA   GLN  59           HA       GLN  59   6.639 -11.531 -17.298
  425    HB2  GLN  59           2HB      GLN  59   7.644 -11.105 -19.556
  426    HB3  GLN  59           3HB      GLN  59   8.984 -10.260 -18.761
  427    HG2  GLN  59           2HG      GLN  59   9.788 -12.244 -17.750
  428    HG3  GLN  59           3HG      GLN  59   8.253 -13.095 -17.957
  429   HE21  GLN  59          2HE2      GLN  59   7.608 -13.760 -20.109
  430   HE22  GLN  59          1HE2      GLN  59   8.853 -14.064 -21.338
  431    H    VAL  60           H        VAL  60   7.597 -12.111 -15.398
  432    HA   VAL  60           HA       VAL  60   8.943 -10.016 -13.770
  433    HB   VAL  60           HB       VAL  60   7.605 -11.104 -11.860
  434   HG11  VAL  60          1HG1      VAL  60   6.085  -9.472 -13.922
  435   HG12  VAL  60          2HG1      VAL  60   5.619  -9.671 -12.227
  436   HG13  VAL  60          3HG1      VAL  60   7.134  -8.859 -12.610
  437   HG21  VAL  60          3HG2      VAL  60   5.784 -12.037 -14.114
  438   HG22  VAL  60          1HG2      VAL  60   6.702 -13.074 -12.994
  439   HG23  VAL  60          2HG2      VAL  60   5.410 -12.035 -12.387
  440    H    LYS  61           H        LYS  61  10.571 -10.704 -12.486
  441    HA   LYS  61           HA       LYS  61  11.264 -13.608 -12.526
  442    HB2  LYS  61           2HB      LYS  61  13.037 -11.966 -13.065
  443    HB3  LYS  61           3HB      LYS  61  12.801 -11.195 -11.484
  444    HG2  LYS  61           2HG      LYS  61  13.496 -13.242 -10.332
  445    HG3  LYS  61           3HG      LYS  61  13.598 -14.115 -11.873
  446    HD2  LYS  61           2HD      LYS  61  15.408 -12.598 -12.620
  447    HD3  LYS  61           3HD      LYS  61  15.311 -11.726 -11.069
  448    HE2  LYS  61           2HE      LYS  61  15.880 -13.813  -9.863
  449    HE3  LYS  61           3HE      LYS  61  15.960 -14.694 -11.400
  450    HZ1  LYS  61           3HZ      LYS  61  17.792 -13.255 -12.053
  451    HZ2  LYS  61           1HZ      LYS  61  17.719 -12.450 -10.615
  452    HZ3  LYS  61           2HZ      LYS  61  18.146 -14.036 -10.646
  453    H    VAL  62           H        VAL  62  10.764 -14.837 -10.745
  454    HA   VAL  62           HA       VAL  62   9.381 -13.763  -8.472
  455    HB   VAL  62           HB       VAL  62  10.810 -16.430  -8.776
  456   HG11  VAL  62          1HG1      VAL  62   8.532 -15.524  -6.943
  457   HG12  VAL  62          2HG1      VAL  62   9.186 -17.172  -7.041
  458   HG13  VAL  62          3HG1      VAL  62  10.196 -15.855  -6.431
  459   HG21  VAL  62          3HG2      VAL  62   7.906 -15.706  -9.392
  460   HG22  VAL  62          1HG2      VAL  62   9.146 -16.144 -10.589
  461   HG23  VAL  62          2HG2      VAL  62   8.608 -17.341  -9.412
  462    H    LEU  63           H        LEU  63  10.217 -12.551  -6.944
  463    HA   LEU  63           HA       LEU  63  13.152 -12.424  -6.570
  464    HB2  LEU  63           2HB      LEU  63  11.843 -10.400  -7.120
  465    HB3  LEU  63           3HB      LEU  63  10.870 -10.637  -5.664
  466    HG   LEU  63           HG       LEU  63  12.921 -10.320  -4.263
  467   HD11  LEU  63          1HD1      LEU  63  14.203  -9.497  -6.912
  468   HD12  LEU  63          2HD1      LEU  63  14.923  -9.310  -5.300
  469   HD13  LEU  63          3HD1      LEU  63  14.651 -10.930  -5.946
  470   HD21  LEU  63          3HD2      LEU  63  12.215  -8.068  -6.189
  471   HD22  LEU  63          1HD2      LEU  63  11.358  -8.476  -4.694
  472   HD23  LEU  63          2HD2      LEU  63  13.017  -7.870  -4.618
  473    H    ALA  64           H        ALA  64  10.149 -13.200  -4.797
  474    HA   ALA  64           HA       ALA  64  11.683 -14.770  -2.885
  475    HB1  ALA  64           1HB      ALA  64  10.031 -12.417  -1.898
  476    HB2  ALA  64           2HB      ALA  64  10.709 -13.688  -0.884
  477    HB3  ALA  64           3HB      ALA  64  11.795 -12.590  -1.757
  478    H    VAL  65           H        VAL  65  10.210 -16.145  -1.616
  479    HA   VAL  65           HA       VAL  65   7.321 -16.008  -2.237
  480    HB   VAL  65           HB       VAL  65   9.025 -18.541  -2.306
  481   HG11  VAL  65          1HG1      VAL  65   6.024 -18.173  -2.761
  482   HG12  VAL  65          2HG1      VAL  65   6.927 -19.689  -2.958
  483   HG13  VAL  65          3HG1      VAL  65   6.773 -18.964  -1.358
  484   HG21  VAL  65          3HG2      VAL  65   7.523 -17.169  -4.577
  485   HG22  VAL  65          1HG2      VAL  65   9.288 -17.282  -4.404
  486   HG23  VAL  65          2HG2      VAL  65   8.342 -18.746  -4.668
  487    H    ASP  66           H        ASP  66   6.103 -16.488  -0.412
  488    HA   ASP  66           HA       ASP  66   7.498 -17.139   2.138
  489    HB2  ASP  66           2HB      ASP  66   7.505 -14.729   1.947
  490    HB3  ASP  66           3HB      ASP  66   5.767 -14.690   1.652
  491    H    GLU  67           H        GLU  67   6.524 -19.146   1.588
  492    HA   GLU  67           HA       GLU  67   3.773 -19.587   1.174
  493    HB2  GLU  67           2HB      GLU  67   4.273 -21.912   1.522
  494    HB3  GLU  67           3HB      GLU  67   5.575 -21.165   0.590
  495    HG2  GLU  67           2HG      GLU  67   6.945 -21.005   2.692
  496    HG3  GLU  67           3HG      GLU  67   5.632 -21.798   3.572
  497    H    GLU  68           H        GLU  68   5.395 -18.869   4.179
  498    HA   GLU  68           HA       GLU  68   3.503 -20.007   5.983
  499    HB2  GLU  68           2HB      GLU  68   5.174 -17.478   6.237
  500    HB3  GLU  68           3HB      GLU  68   4.365 -18.310   7.563
  501    HG2  GLU  68           2HG      GLU  68   6.597 -19.500   5.858
  502    HG3  GLU  68           3HG      GLU  68   6.800 -18.771   7.446
  503    H    LYS  69           H        LYS  69   3.394 -17.188   3.919
  504    HA   LYS  69           HA       LYS  69   0.736 -16.381   5.062
  505    HB2  LYS  69           2HB      LYS  69   2.919 -14.679   3.792
  506    HB3  LYS  69           3HB      LYS  69   1.329 -14.079   4.264
  507    HG2  LYS  69           2HG      LYS  69   3.470 -15.180   6.130
  508    HG3  LYS  69           3HG      LYS  69   3.069 -13.483   5.896
  509    HD2  LYS  69           2HD      LYS  69   1.248 -15.600   7.117
  510    HD3  LYS  69           3HD      LYS  69   2.141 -14.355   7.995
  511    HE2  LYS  69           2HE      LYS  69   0.866 -12.593   6.769
  512    HE3  LYS  69           3HE      LYS  69  -0.067 -13.864   5.950
  513    HZ1  LYS  69           3HZ      LYS  69  -0.880 -14.566   8.104
  514    HZ2  LYS  69           1HZ      LYS  69  -0.019 -13.386   8.863
  515    HZ3  LYS  69           2HZ      LYS  69  -1.252 -12.986   7.847
  516    H    GLY  70           H        GLY  70   2.209 -17.812   2.418
  517    HA2  GLY  70           2HA      GLY  70   1.501 -18.256   0.281
  518    HA3  GLY  70           3HA      GLY  70  -0.098 -17.618   0.721
  519    H    LYS  71           H        LYS  71   3.075 -15.913   0.766
  520    HA   LYS  71           HA       LYS  71   1.972 -13.965  -1.228
  521    HB2  LYS  71           2HB      LYS  71   3.849 -13.562   1.137
  522    HB3  LYS  71           3HB      LYS  71   3.540 -12.337  -0.106
  523    HG2  LYS  71           2HG      LYS  71   1.137 -12.327   0.472
  524    HG3  LYS  71           3HG      LYS  71   1.413 -13.584   1.683
  525    HD2  LYS  71           2HD      LYS  71   1.246 -11.486   2.824
  526    HD3  LYS  71           3HD      LYS  71   2.929 -12.042   2.925
  527    HE2  LYS  71           2HE      LYS  71   3.556 -10.514   1.086
  528    HE3  LYS  71           3HE      LYS  71   1.869  -9.992   0.922
  529    HZ1  LYS  71           3HZ      LYS  71   2.003  -9.087   3.157
  530    HZ2  LYS  71           1HZ      LYS  71   3.576  -9.583   3.300
  531    HZ3  LYS  71           2HZ      LYS  71   3.166  -8.427   2.209
  532    H    ILE  72           H        ILE  72   3.522 -12.951  -2.623
  533    HA   ILE  72           HA       ILE  72   6.095 -14.328  -3.082
  534    HB   ILE  72           HB       ILE  72   3.883 -13.917  -5.161
  535   HG12  ILE  72          2HG1      ILE  72   5.137 -16.457  -4.073
  536   HG13  ILE  72          3HG1      ILE  72   3.480 -15.895  -3.802
  537   HG21  ILE  72          1HG2      ILE  72   6.721 -14.977  -5.526
  538   HG22  ILE  72          2HG2      ILE  72   5.482 -14.901  -6.795
  539   HG23  ILE  72          3HG2      ILE  72   6.114 -13.421  -6.121
  540   HD11  ILE  72          3HD1      ILE  72   2.962 -16.165  -6.195
  541   HD12  ILE  72          1HD1      ILE  72   4.601 -16.791  -6.486
  542   HD13  ILE  72          2HD1      ILE  72   3.502 -17.689  -5.454
  543    H    SER  73           H        SER  73   7.631 -12.860  -3.678
  544    HA   SER  73           HA       SER  73   6.766 -10.073  -4.318
  545    HB2  SER  73           2HB      SER  73   9.468 -10.981  -3.293
  546    HB3  SER  73           3HB      SER  73   8.899  -9.323  -3.496
  547    HG   SER  73           HG       SER  73   8.738 -10.046  -1.301
  548    H    LEU  74           H        LEU  74   7.884  -9.087  -6.106
  549    HA   LEU  74           HA       LEU  74   9.022 -11.025  -8.078
  550    HB2  LEU  74           2HB      LEU  74   6.797  -9.014  -8.471
  551    HB3  LEU  74           3HB      LEU  74   7.529  -9.966  -9.763
  552    HG   LEU  74           HG       LEU  74   5.934 -11.105  -7.420
  553   HD11  LEU  74          1HD1      LEU  74   5.152 -10.712 -10.329
  554   HD12  LEU  74          2HD1      LEU  74   4.173 -11.527  -9.108
  555   HD13  LEU  74          3HD1      LEU  74   4.522  -9.794  -8.950
  556   HD21  LEU  74          3HD2      LEU  74   6.973 -12.475  -9.940
  557   HD22  LEU  74          1HD2      LEU  74   7.572 -12.715  -8.283
  558   HD23  LEU  74          2HD2      LEU  74   5.934 -13.199  -8.692
  559    H    SER  75           H        SER  75   9.959  -9.845  -9.963
  560    HA   SER  75           HA       SER  75  10.787  -7.044  -9.433
  561    HB2  SER  75           2HB      SER  75  12.615  -8.449  -8.640
  562    HB3  SER  75           3HB      SER  75  12.588  -9.391 -10.141
  563    HG   SER  75           HG       SER  75  14.229  -7.741 -10.074
  564    H    ILE  76           H        ILE  76  11.052  -5.857 -11.211
  565    HA   ILE  76           HA       ILE  76  10.580  -6.994 -13.931
  566    HB   ILE  76           HB       ILE  76   9.628  -4.412 -12.657
  567   HG12  ILE  76          2HG1      ILE  76   8.194  -6.348 -12.202
  568   HG13  ILE  76          3HG1      ILE  76   7.405  -5.053 -13.107
  569   HG21  ILE  76          1HG2      ILE  76   9.431  -5.222 -15.587
  570   HG22  ILE  76          2HG2      ILE  76   8.614  -3.823 -14.839
  571   HG23  ILE  76          3HG2      ILE  76  10.368  -3.897 -14.898
  572   HD11  ILE  76          3HD1      ILE  76   7.644  -6.370 -15.206
  573   HD12  ILE  76          1HD1      ILE  76   8.452  -7.651 -14.268
  574   HD13  ILE  76          2HD1      ILE  76   6.745  -7.228 -13.983
  575    H    ARG  77           H        ARG  77  12.519  -4.782 -11.858
  576    HA   ARG  77           HA       ARG  77  14.179  -3.842 -13.963
  577    HB2  ARG  77           2HB      ARG  77  15.786  -3.292 -12.356
  578    HB3  ARG  77           3HB      ARG  77  14.227  -3.092 -11.547
  579    HG2  ARG  77           2HG      ARG  77  14.541  -5.227 -10.367
  580    HG3  ARG  77           3HG      ARG  77  16.083  -5.489 -11.195
  581    HD2  ARG  77           2HD      ARG  77  15.453  -3.256  -9.230
  582    HD3  ARG  77           3HD      ARG  77  16.430  -4.675  -8.900
  583    HE   ARG  77           HE       ARG  77  18.004  -3.847 -10.663
  584   HH11  ARG  77          1HH2      ARG  77  15.945  -1.487  -8.859
  585   HH12  ARG  77          2HH2      ARG  77  17.039  -0.189  -9.174
  586   HH21  ARG  77          1HH1      ARG  77  19.364  -2.049 -11.043
  587   HH22  ARG  77          2HH1      ARG  77  18.944  -0.491 -10.385
  588    H    ALA  78           H        ALA  78  14.006  -7.024 -12.507
  589    HA   ALA  78           HA       ALA  78  16.353  -8.126 -13.705
  590    HB1  ALA  78           1HB      ALA  78  13.680  -9.422 -13.004
  591    HB2  ALA  78           2HB      ALA  78  15.209 -10.276 -13.306
  592    HB3  ALA  78           3HB      ALA  78  15.054  -9.213 -11.890
  593    H    THR  79           H        THR  79  13.155  -7.384 -15.135
  594    HA   THR  79           HA       THR  79  13.818  -9.047 -17.499
  595    HB   THR  79           HB       THR  79  11.364  -9.062 -17.842
  596    HG1  THR  79           1HG      THR  79  10.070  -8.304 -16.129
  597   HG21  THR  79          1HG2      THR  79  12.193  -9.922 -15.023
  598   HG22  THR  79          2HG2      THR  79  10.790 -10.514 -15.917
  599   HG23  THR  79          3HG2      THR  79  12.409 -10.883 -16.505
  600    H    GLN  80           H        GLN  80  13.208  -5.730 -16.535
  601    HA   GLN  80           HA       GLN  80  14.059  -4.934 -19.274
  602    HB2  GLN  80           2HB      GLN  80  12.894  -2.788 -18.948
  603    HB3  GLN  80           3HB      GLN  80  11.839  -4.190 -19.139
  604    HG2  GLN  80           2HG      GLN  80  11.348  -4.200 -16.764
  605    HG3  GLN  80           3HG      GLN  80  12.463  -2.863 -16.468
  606   HE21  GLN  80          2HE2      GLN  80  10.445  -1.819 -15.447
  607   HE22  GLN  80          1HE2      GLN  80   9.344  -0.980 -16.529
  608    H    ALA  81           H        ALA  81  15.965  -5.689 -18.036
  609    HA   ALA  81           HA       ALA  81  17.260  -3.970 -16.152
  610    HB1  ALA  81           1HB      ALA  81  18.372  -6.176 -17.941
  611    HB2  ALA  81           2HB      ALA  81  19.187  -5.466 -16.534
  612    HB3  ALA  81           3HB      ALA  81  17.694  -6.397 -16.311
  613    H    ALA  82           H        ALA  82  16.571  -2.122 -17.758
  614    HA   ALA  82           HA       ALA  82  16.983  -0.550 -19.288
  615    HB1  ALA  82           1HB      ALA  82  19.804  -0.744 -18.187
  616    HB2  ALA  82           2HB      ALA  82  19.088   0.656 -19.011
  617    HB3  ALA  82           3HB      ALA  82  18.451   0.137 -17.436
  618    HA   PRO  83           HA       PRO  83  18.831  -3.178 -22.680
  619    HB2  PRO  83           2HB      PRO  83  16.540  -3.678 -24.102
  620    HB3  PRO  83           3HB      PRO  83  17.091  -4.739 -22.772
  621    HG2  PRO  83           2HG      PRO  83  15.019  -2.510 -22.686
  622    HG3  PRO  83           3HG      PRO  83  14.882  -4.156 -22.004
  623    HD2  PRO  83           2HD      PRO  83  15.613  -1.974 -20.482
  624    HD3  PRO  83           3HD      PRO  83  16.259  -3.614 -20.174
  625    H    GLU  84           H        GLU  84  16.827  -0.458 -22.148
  626    HA   GLU  84           HA       GLU  84  17.808   0.988 -24.526
  627    HB2  GLU  84           2HB      GLU  84  14.960   1.010 -23.444
  628    HB3  GLU  84           3HB      GLU  84  15.593   2.071 -24.715
  629    HG2  GLU  84           2HG      GLU  84  16.006   0.091 -26.156
  630    HG3  GLU  84           3HG      GLU  84  15.293  -0.954 -24.919
  631    H    LYS  85           H        LYS  85  16.926   3.492 -23.850
  632    HA   LYS  85           HA       LYS  85  18.171   4.295 -21.398
  633    HB2  LYS  85           2HB      LYS  85  16.069   5.558 -23.209
  634    HB3  LYS  85           3HB      LYS  85  16.546   6.323 -21.696
  635    HG2  LYS  85           2HG      LYS  85  17.791   7.352 -23.446
  636    HG3  LYS  85           3HG      LYS  85  18.905   6.406 -22.449
  637    HD2  LYS  85           2HD      LYS  85  19.052   4.668 -24.152
  638    HD3  LYS  85           3HD      LYS  85  17.746   5.416 -25.086
  639    HE2  LYS  85           2HE      LYS  85  19.812   5.945 -26.173
  640    HE3  LYS  85           3HE      LYS  85  19.181   7.429 -25.442
  641    HZ1  LYS  85           3HZ      LYS  85  20.745   7.111 -23.626
  642    HZ2  LYS  85           1HZ      LYS  85  21.327   5.732 -24.316
  643    HZ3  LYS  85           2HZ      LYS  85  21.542   7.185 -25.061
  644    H    LYS  86           H        LYS  86  17.136   5.066 -19.420
  645    HA   LYS  86           HA       LYS  86  15.381   3.287 -18.229
  646    HB2  LYS  86           2HB      LYS  86  15.164   4.853 -16.409
  647    HB3  LYS  86           3HB      LYS  86  16.817   4.853 -17.009
  648    HG2  LYS  86           2HG      LYS  86  16.526   7.106 -16.730
  649    HG3  LYS  86           3HG      LYS  86  16.014   6.956 -18.415
  650    HD2  LYS  86           2HD      LYS  86  13.626   6.919 -17.664
  651    HD3  LYS  86           3HD      LYS  86  14.159   7.029 -15.989
  652    HE2  LYS  86           2HE      LYS  86  13.478   9.217 -16.682
  653    HE3  LYS  86           3HE      LYS  86  15.247   9.228 -16.518
  654    HZ1  LYS  86           3HZ      LYS  86  15.381   8.986 -18.914
  655    HZ2  LYS  86           1HZ      LYS  86  13.744   8.973 -19.051
  656    HZ3  LYS  86           2HZ      LYS  86  14.519  10.334 -18.529
  657    H    GLU  87           H        GLU  87  13.209   3.419 -17.505
  658    HA   GLU  87           HA       GLU  87  11.488   3.958 -19.734
  659    HB2  GLU  87           2HB      GLU  87  10.761   3.029 -16.936
  660    HB3  GLU  87           3HB      GLU  87   9.772   2.899 -18.393
  661    HG2  GLU  87           2HG      GLU  87  12.348   1.441 -17.718
  662    HG3  GLU  87           3HG      GLU  87  10.738   0.748 -17.876
  663    H    SER  88           H        SER  88  11.761   6.280 -19.900
  664    HA   SER  88           HA       SER  88  11.011   8.214 -18.000
  665    HB2  SER  88           2HB      SER  88  10.515   8.316 -20.998
  666    HB3  SER  88           3HB      SER  88  10.726   9.693 -19.904
  667    HG   SER  88           HG       SER  88  12.629   9.103 -21.109
  668    H    LYS  89           H        LYS  89   8.911   6.202 -19.993
  669    HA   LYS  89           HA       LYS  89   6.737   6.740 -18.138
  670    HB2  LYS  89           2HB      LYS  89   5.064   6.979 -19.915
  671    HB3  LYS  89           3HB      LYS  89   6.218   8.302 -19.890
  672    HG2  LYS  89           2HG      LYS  89   7.382   7.368 -21.865
  673    HG3  LYS  89           3HG      LYS  89   6.278   5.972 -21.870
  674    HD2  LYS  89           2HD      LYS  89   4.360   7.437 -22.253
  675    HD3  LYS  89           3HD      LYS  89   5.375   8.881 -22.094
  676    HE2  LYS  89           2HE      LYS  89   6.610   8.313 -24.113
  677    HE3  LYS  89           3HE      LYS  89   5.754   6.764 -24.256
  678    HZ1  LYS  89           3HZ      LYS  89   3.705   8.039 -24.555
  679    HZ2  LYS  89           1HZ      LYS  89   4.471   9.440 -24.392
  680    HZ3  LYS  89           2HZ      LYS  89   4.815   8.460 -25.704
  681    HA   PRO  90           HA       PRO  90   6.374   2.416 -18.217
  682    HB2  PRO  90           2HB      PRO  90   3.478   2.531 -19.043
  683    HB3  PRO  90           3HB      PRO  90   4.222   1.666 -17.667
  684    HG2  PRO  90           2HG      PRO  90   2.876   4.001 -17.267
  685    HG3  PRO  90           3HG      PRO  90   4.407   3.682 -16.403
  686    HD2  PRO  90           2HD      PRO  90   3.971   5.353 -18.886
  687    HD3  PRO  90           3HD      PRO  90   4.974   5.717 -17.454
  688    H    ARG  91           H        ARG  91   6.096   0.431 -19.524
  689    HA   ARG  91           HA       ARG  91   6.524   0.728 -22.338
  690    HB2  ARG  91           2HB      ARG  91   5.541  -1.742 -20.865
  691    HB3  ARG  91           3HB      ARG  91   6.328  -1.687 -22.444
  692    HG2  ARG  91           2HG      ARG  91   7.579  -1.099 -19.739
  693    HG3  ARG  91           3HG      ARG  91   7.899  -2.482 -20.777
  694    HD2  ARG  91           2HD      ARG  91   8.593   0.415 -21.453
  695    HD3  ARG  91           3HD      ARG  91   9.714  -0.776 -20.799
  696    HE   ARG  91           HE       ARG  91   8.487  -1.764 -23.201
  697   HH11  ARG  91          1HH1      ARG  91  10.966   0.622 -22.089
  698   HH12  ARG  91          2HH1      ARG  91  11.889   0.421 -23.576
  699   HH21  ARG  91          1HH2      ARG  91   9.855  -1.926 -25.119
  700   HH22  ARG  91          2HH2      ARG  91  11.307  -0.915 -25.178
  701    H    LYS  92           H        LYS  92   3.552   0.494 -20.508
  702    HA   LYS  92           HA       LYS  92   2.018   0.880 -23.038
  703    HB2  LYS  92           2HB      LYS  92   1.745  -1.435 -22.240
  704    HB3  LYS  92           3HB      LYS  92   1.248  -0.844 -20.652
  705    HG2  LYS  92           2HG      LYS  92  -0.782   0.165 -21.617
  706    HG3  LYS  92           3HG      LYS  92  -0.261  -0.294 -23.254
  707    HD2  LYS  92           2HD      LYS  92  -0.323  -2.675 -22.612
  708    HD3  LYS  92           3HD      LYS  92  -0.807  -2.246 -20.973
  709    HE2  LYS  92           2HE      LYS  92  -2.467  -1.533 -23.419
  710    HE3  LYS  92           3HE      LYS  92  -2.634  -3.069 -22.551
  711    HZ1  LYS  92           3HZ      LYS  92  -3.192  -1.864 -20.569
  712    HZ2  LYS  92           1HZ      LYS  92  -3.051  -0.396 -21.355
  713    HZ3  LYS  92           2HZ      LYS  92  -4.223  -1.458 -21.775
  714    HA   PRO  93           HA       PRO  93   1.789   4.409 -20.056
  715    HB2  PRO  93           2HB      PRO  93   0.959   5.789 -22.605
  716    HB3  PRO  93           3HB      PRO  93   2.043   6.367 -21.307
  717    HG2  PRO  93           2HG      PRO  93   3.071   5.413 -23.647
  718    HG3  PRO  93           3HG      PRO  93   3.836   4.993 -22.086
  719    HD2  PRO  93           2HD      PRO  93   1.940   3.316 -23.756
  720    HD3  PRO  93           3HD      PRO  93   3.428   2.821 -22.904
  721    H    LYS  94           H        LYS  94  -0.534   3.594 -22.632
  722    HA   LYS  94           HA       LYS  94  -2.725   3.523 -20.652
  723    HB2  LYS  94           2HB      LYS  94  -2.806   5.787 -21.577
  724    HB3  LYS  94           3HB      LYS  94  -2.815   5.159 -23.229
  725    HG2  LYS  94           2HG      LYS  94  -4.989   4.134 -22.911
  726    HG3  LYS  94           3HG      LYS  94  -4.978   4.518 -21.182
  727    HD2  LYS  94           2HD      LYS  94  -4.983   6.612 -23.414
  728    HD3  LYS  94           3HD      LYS  94  -6.434   6.034 -22.565
  729    HE2  LYS  94           2HE      LYS  94  -5.352   6.719 -20.392
  730    HE3  LYS  94           3HE      LYS  94  -4.042   7.452 -21.320
  731    HZ1  LYS  94           3HZ      LYS  94  -5.655   8.963 -22.318
  732    HZ2  LYS  94           1HZ      LYS  94  -6.881   8.265 -21.469
  733    HZ3  LYS  94           2HZ      LYS  94  -5.633   9.075 -20.720
  734    H    ALA  95           H        ALA  95  -2.265   3.299 -24.219
  735    HA   ALA  95           HA       ALA  95  -2.467   0.379 -24.176
  736    HB1  ALA  95           1HB      ALA  95  -4.460   2.145 -25.666
  737    HB2  ALA  95           2HB      ALA  95  -4.293   0.387 -25.874
  738    HB3  ALA  95           3HB      ALA  95  -4.841   1.052 -24.322
  739    H    ALA  96           H        ALA  96  -2.060  -0.422 -26.467
  740    HA   ALA  96           HA       ALA  96   0.280   0.876 -27.509
  741    HB1  ALA  96           1HB      ALA  96  -1.373  -1.442 -28.614
  742    HB2  ALA  96           2HB      ALA  96   0.274  -1.002 -29.103
  743    HB3  ALA  96           3HB      ALA  96  -0.023  -1.584 -27.456
  744    H    GLN  97           H        GLN  97  -2.972   1.575 -28.077
  745    HA   GLN  97           HA       GLN  97  -2.285   3.208 -30.441
  746    HB2  GLN  97           2HB      GLN  97  -4.795   1.521 -30.077
  747    HB3  GLN  97           3HB      GLN  97  -4.598   2.767 -31.311
  748    HG2  GLN  97           2HG      GLN  97  -2.924   0.230 -31.073
  749    HG3  GLN  97           3HG      GLN  97  -4.254   0.468 -32.197
  750   HE21  GLN  97          2HE2      GLN  97  -1.555  -0.232 -32.962
  751   HE22  GLN  97          1HE2      GLN  97  -0.943   1.105 -33.916
  752    H    VAL  98           H        VAL  98  -3.664   5.111 -30.498
  753    HA   VAL  98           HA       VAL  98  -4.093   7.070 -29.411
  754    HB   VAL  98           HB       VAL  98  -6.274   7.202 -28.283
  755   HG11  VAL  98          1HG1      VAL  98  -6.279   5.490 -30.810
  756   HG12  VAL  98          2HG1      VAL  98  -7.642   6.443 -30.202
  757   HG13  VAL  98          3HG1      VAL  98  -6.168   7.264 -30.735
  758   HG21  VAL  98          3HG2      VAL  98  -6.474   4.181 -28.578
  759   HG22  VAL  98          1HG2      VAL  98  -6.368   5.093 -27.052
  760   HG23  VAL  98          2HG2      VAL  98  -7.774   5.294 -28.106
  761    H    SER  99           H        SER  99  -2.006   5.724 -28.309
  762    HA   SER  99           HA       SER  99  -1.927   5.587 -25.531
  763    HB2  SER  99           2HB      SER  99   0.365   6.528 -27.283
  764    HB3  SER  99           3HB      SER  99   0.430   5.520 -25.818
  765    HG   SER  99           HG       SER  99   0.679   4.261 -27.751
  766    H    GLU 100           H        GLU 100  -1.295   7.080 -23.896
  767    HA   GLU 100           HA       GLU 100  -0.964   9.913 -24.530
  768    HB2  GLU 100           2HB      GLU 100  -3.415   9.499 -24.628
  769    HB3  GLU 100           3HB      GLU 100  -3.362   8.831 -22.986
  770    HG2  GLU 100           2HG      GLU 100  -2.749  11.006 -22.077
  771    HG3  GLU 100           3HG      GLU 100  -2.475  11.651 -23.699
  772    H    GLU 101           H        GLU 101  -0.374  11.089 -22.573
  773    HA   GLU 101           HA       GLU 101   1.555   9.612 -21.053
  774    HB2  GLU 101           2HB      GLU 101   0.517  12.447 -20.717
  775    HB3  GLU 101           3HB      GLU 101   2.002  11.800 -20.019
  776    HG2  GLU 101           2HG      GLU 101   1.454  12.148 -23.000
  777    HG3  GLU 101           3HG      GLU 101   2.401  13.226 -21.991
  778    H    ALA 102           H        ALA 102  -1.804  10.325 -20.384
  779    HA   ALA 102           HA       ALA 102  -1.543   9.311 -17.631
  780    HB1  ALA 102           1HB      ALA 102  -2.614  12.106 -18.253
  781    HB2  ALA 102           2HB      ALA 102  -2.676  11.303 -16.667
  782    HB3  ALA 102           3HB      ALA 102  -1.113  11.728 -17.377
  783    H    SER 103           H        SER 103  -3.638   9.065 -16.610
  784    HA   SER 103           HA       SER 103  -5.917   8.535 -18.464
  785    HB2  SER 103           2HB      SER 103  -4.786   6.645 -16.360
  786    HB3  SER 103           3HB      SER 103  -6.176   6.337 -17.423
  787    HG   SER 103           HG       SER 103  -4.186   5.407 -18.192
  788    H    THR 104           H        THR 104  -7.905   7.864 -17.016
  789    HA   THR 104           HA       THR 104  -8.699  10.043 -15.469
  790    HB   THR 104           HB       THR 104 -10.609   8.465 -14.893
  791    HG1  THR 104           1HG      THR 104 -10.523   6.453 -15.962
  792   HG21  THR 104          1HG2      THR 104  -9.717   8.490 -17.831
  793   HG22  THR 104          2HG2      THR 104 -11.362   8.217 -17.246
  794   HG23  THR 104          3HG2      THR 104 -10.606   9.790 -17.019
  795    HA   PRO 105           HA       PRO 105  -6.804   9.491 -11.616
  796    HB2  PRO 105           2HB      PRO 105  -8.466  10.596  -9.773
  797    HB3  PRO 105           3HB      PRO 105  -7.690  11.556 -11.060
  798    HG2  PRO 105           2HG      PRO 105 -10.503  10.423 -10.997
  799    HG3  PRO 105           3HG      PRO 105  -9.986  12.056 -11.509
  800    HD2  PRO 105           2HD      PRO 105 -10.471   9.967 -13.275
  801    HD3  PRO 105           3HD      PRO 105  -9.307  11.272 -13.617
  802    H    GLN 106           H        GLN 106  -9.725   7.853 -12.117
  803    HA   GLN 106           HA       GLN 106  -8.961   5.725 -10.213
  804    HB2  GLN 106           2HB      GLN 106 -11.757   6.755 -10.834
  805    HB3  GLN 106           3HB      GLN 106 -11.425   5.219 -10.025
  806    HG2  GLN 106           2HG      GLN 106 -10.354   6.444  -8.140
  807    HG3  GLN 106           3HG      GLN 106 -10.759   7.972  -8.935
  808   HE21  GLN 106          2HE2      GLN 106 -11.846   7.982  -6.520
  809   HE22  GLN 106          1HE2      GLN 106 -13.503   7.491  -6.525
  810    H    GLY 107           H        GLY 107 -10.103   3.628 -11.056
  811    HA2  GLY 107           2HA      GLY 107 -11.052   3.606 -13.816
  812    HA3  GLY 107           3HA      GLY 107  -9.616   2.617 -13.471
  813    H    PHE 108           H        PHE 108 -11.696   1.119 -14.161
  814    HA   PHE 108           HA       PHE 108 -13.317   0.311 -11.882
  815    HB2  PHE 108           2HB      PHE 108 -12.982  -0.954 -14.636
  816    HB3  PHE 108           3HB      PHE 108 -14.202  -1.362 -13.427
  817    HD1  PHE 108           HD1      PHE 108 -15.902   0.361 -12.723
  818    HD2  PHE 108           HD2      PHE 108 -13.290   0.949 -16.105
  819    HE1  PHE 108           HE1      PHE 108 -17.355   2.209 -13.533
  820    HE2  PHE 108           HE2      PHE 108 -14.735   2.811 -16.896
  821    HZ   PHE 108           HZ       PHE 108 -16.756   3.444 -15.620
  822    H    ASN 109           H        ASN 109 -11.018   0.300 -10.838
  823    HA   ASN 109           HA       ASN 109 -10.222  -2.434 -10.199
  824    HB2  ASN 109           2HB      ASN 109  -8.872  -2.145 -12.198
  825    HB3  ASN 109           3HB      ASN 109  -8.365  -0.527 -11.696
  826   HD21  ASN 109          2HD2      ASN 109  -8.000  -4.007 -11.012
  827   HD22  ASN 109          1HD2      ASN 109  -6.502  -3.818 -10.101
  828    H    THR 110           H        THR 110  -9.615   1.109  -9.935
  829    HA   THR 110           HA       THR 110  -8.033   0.914  -7.548
  830    HB   THR 110           HB       THR 110  -8.500   3.442  -7.535
  831    HG1  THR 110           1HG      THR 110  -9.435   4.235  -9.424
  832   HG21  THR 110          1HG2      THR 110  -7.448   2.248 -10.142
  833   HG22  THR 110          2HG2      THR 110  -7.152   3.906  -9.552
  834   HG23  THR 110          3HG2      THR 110  -6.500   2.510  -8.667
  835    H    LEU 111           H        LEU 111  -8.617   1.998  -5.480
  836    HA   LEU 111           HA       LEU 111 -11.487   2.275  -4.887
  837    HB2  LEU 111           2HB      LEU 111 -10.950   0.032  -4.123
  838    HB3  LEU 111           3HB      LEU 111  -9.499   0.613  -3.291
  839    HG   LEU 111           HG       LEU 111 -10.909   1.931  -1.726
  840   HD11  LEU 111          1HD1      LEU 111 -13.272   0.592  -3.127
  841   HD12  LEU 111          2HD1      LEU 111 -13.354   1.572  -1.644
  842   HD13  LEU 111          3HD1      LEU 111 -12.897   2.326  -3.168
  843   HD21  LEU 111          3HD2      LEU 111 -11.678  -1.008  -1.935
  844   HD22  LEU 111          1HD2      LEU 111 -10.241  -0.347  -1.124
  845   HD23  LEU 111          2HD2      LEU 111 -11.857   0.010  -0.488
  846    H    LYS 112           H        LYS 112 -11.663   4.326  -4.186
  847    HA   LYS 112           HA       LYS 112  -9.637   5.536  -2.396
  848    HB2  LYS 112           2HB      LYS 112 -10.636   6.744  -5.016
  849    HB3  LYS 112           3HB      LYS 112  -9.820   7.657  -3.737
  850    HG2  LYS 112           2HG      LYS 112  -7.812   6.209  -3.993
  851    HG3  LYS 112           3HG      LYS 112  -8.618   5.351  -5.321
  852    HD2  LYS 112           2HD      LYS 112  -8.741   7.462  -6.622
  853    HD3  LYS 112           3HD      LYS 112  -7.919   8.322  -5.300
  854    HE2  LYS 112           2HE      LYS 112  -5.956   6.867  -5.525
  855    HE3  LYS 112           3HE      LYS 112  -6.776   5.919  -6.786
  856    HZ1  LYS 112           3HZ      LYS 112  -6.786   7.929  -8.178
  857    HZ2  LYS 112           1HZ      LYS 112  -6.023   8.788  -7.009
  858    HZ3  LYS 112           2HZ      LYS 112  -5.248   7.549  -7.704
  859    H    ASP 113           H        ASP 113 -10.612   7.099  -1.030
  860    HA   ASP 113           HA       ASP 113 -13.452   6.807  -0.529
  861    HB2  ASP 113           2HB      ASP 113 -11.780   7.340   1.230
  862    HB3  ASP 113           3HB      ASP 113 -11.457   8.886   0.440
  863    H    LYS 114           H        LYS 114 -11.593   8.961  -2.543
  864    HA   LYS 114           HA       LYS 114 -14.022  10.511  -3.278
  865    HB2  LYS 114           2HB      LYS 114 -11.321  11.816  -2.794
  866    HB3  LYS 114           3HB      LYS 114 -12.870  12.608  -3.122
  867    HG2  LYS 114           2HG      LYS 114 -13.693  11.668  -0.898
  868    HG3  LYS 114           3HG      LYS 114 -12.017  11.156  -0.587
  869    HD2  LYS 114           2HD      LYS 114 -11.358  13.608  -0.995
  870    HD3  LYS 114           3HD      LYS 114 -13.087  13.978  -0.897
  871    HE2  LYS 114           2HE      LYS 114 -11.313  12.747   1.254
  872    HE3  LYS 114           3HE      LYS 114 -12.042  14.363   1.266
  873    HZ1  LYS 114           3HZ      LYS 114 -14.217  13.279   1.405
  874    HZ2  LYS 114           1HZ      LYS 114 -13.509  11.779   1.423
  875    HZ3  LYS 114           2HZ      LYS 114 -13.248  12.794   2.652
  876    H    LEU 115           H        LEU 115 -13.371  11.934  -5.292
  877    HA   LEU 115           HA       LEU 115 -12.766  10.214  -7.409
  878    HB2  LEU 115           2HB      LEU 115 -14.033  12.295  -7.631
  879    HB3  LEU 115           3HB      LEU 115 -12.577  13.244  -7.285
  880    HG   LEU 115           HG       LEU 115 -11.515  12.401  -9.363
  881   HD11  LEU 115          1HD1      LEU 115 -14.210  11.059  -9.895
  882   HD12  LEU 115          2HD1      LEU 115 -12.851  11.180 -11.040
  883   HD13  LEU 115          3HD1      LEU 115 -12.671  10.209  -9.576
  884   HD21  LEU 115          3HD2      LEU 115 -14.284  13.607  -9.774
  885   HD22  LEU 115          1HD2      LEU 115 -12.787  14.498  -9.427
  886   HD23  LEU 115          2HD2      LEU 115 -12.951  13.633 -10.951
  887    H    GLU 116           H        GLU 116 -10.551  12.368  -5.626
  888    HA   GLU 116           HA       GLU 116  -8.346  10.632  -6.513
  889    HB2  GLU 116           2HB      GLU 116  -8.287  12.577  -8.007
  890    HB3  GLU 116           3HB      GLU 116  -8.355  13.670  -6.622
  891    HG2  GLU 116           2HG      GLU 116  -6.091  13.527  -7.553
  892    HG3  GLU 116           3HG      GLU 116  -6.135  12.951  -5.891
  893    H    GLU 117           H        GLU 117  -6.663  10.608  -4.951
  894    HA   GLU 117           HA       GLU 117  -7.381  11.528  -2.203
  895    HB2  GLU 117           2HB      GLU 117  -8.204   9.195  -2.838
  896    HB3  GLU 117           3HB      GLU 117  -6.505   8.715  -2.960
  897    HG2  GLU 117           2HG      GLU 117  -6.186   9.270  -0.563
  898    HG3  GLU 117           3HG      GLU 117  -7.856   9.845  -0.467
  899    H    TRP 118           H        TRP 118  -4.970  11.221  -4.665
  900    HA   TRP 118           HA       TRP 118  -2.944  12.175  -2.728
  901    HB2  TRP 118           2HB      TRP 118  -2.503   9.787  -2.991
  902    HB3  TRP 118           3HB      TRP 118  -2.540   9.929  -4.750
  903    HD1  TRP 118           HD1      TRP 118  -0.378  10.447  -1.756
  904    HE1  TRP 118           HE1      TRP 118   2.053  10.990  -2.460
  905    HE3  TRP 118           HE3      TRP 118  -1.130  11.134  -6.770
  906    HZ2  TRP 118           HZ2      TRP 118   3.458  11.613  -4.897
  907    HZ3  TRP 118           HZ3      TRP 118   0.745  11.735  -8.253
  908    HH2  TRP 118           HH2      TRP 118   3.047  11.967  -7.348
  909    H    ILE 119           H        ILE 119  -1.710  13.824  -3.567
  910    HA   ILE 119           HA       ILE 119  -1.151  14.048  -6.404
  911    HB   ILE 119           HB       ILE 119  -3.247  15.235  -6.403
  912   HG12  ILE 119          2HG1      ILE 119  -1.083  17.348  -6.279
  913   HG13  ILE 119          3HG1      ILE 119  -1.239  16.169  -7.591
  914   HG21  ILE 119          1HG2      ILE 119  -2.228  16.892  -4.048
  915   HG22  ILE 119          2HG2      ILE 119  -3.734  17.190  -4.935
  916   HG23  ILE 119          3HG2      ILE 119  -3.556  15.714  -4.000
  917   HD11  ILE 119          3HD1      ILE 119  -3.507  17.014  -8.116
  918   HD12  ILE 119          1HD1      ILE 119  -3.361  18.219  -6.817
  919   HD13  ILE 119          2HD1      ILE 119  -2.286  18.300  -8.215
  920    H    GLU 120           H        GLU 120   0.835  14.876  -6.672
  921    HA   GLU 120           HA       GLU 120   1.987  16.781  -4.773
  922    HB2  GLU 120           2HB      GLU 120   2.518  14.488  -3.807
  923    HB3  GLU 120           3HB      GLU 120   3.391  14.130  -5.296
  924    HG2  GLU 120           2HG      GLU 120   4.984  14.785  -3.650
  925    HG3  GLU 120           3HG      GLU 120   4.904  16.079  -4.836
  926    H    MET 121           H        MET 121   2.579  14.523  -7.510
  927    HA   MET 121           HA       MET 121   3.308  16.694  -9.327
  928    HB2  MET 121           2HB      MET 121   5.484  15.695  -9.912
  929    HB3  MET 121           3HB      MET 121   5.461  16.275  -8.241
  930    HG2  MET 121           2HG      MET 121   5.058  13.944  -7.462
  931    HG3  MET 121           3HG      MET 121   5.146  13.384  -9.137
  932    HE1  MET 121           3HE      MET 121   6.795  12.188  -6.676
  933    HE2  MET 121           1HE      MET 121   6.880  11.550  -8.337
  934    HE3  MET 121           2HE      MET 121   8.371  11.930  -7.443
  935    H    SER 122           H        SER 122   3.292  15.911 -11.538
  936    HA   SER 122           HA       SER 122   2.489  14.680 -13.285
  937    HB2  SER 122           2HB      SER 122   3.811  12.383 -11.811
  938    HB3  SER 122           3HB      SER 122   3.573  12.549 -13.558
  939    HG   SER 122           HG       SER 122   5.676  13.121 -12.930
  940    H    ASN 123           H        ASN 123   0.478  15.088 -11.351
  941    HA   ASN 123           HA       ASN 123  -0.821  12.666 -10.630
  942    HB2  ASN 123           2HB      ASN 123  -1.167  14.841  -9.458
  943    HB3  ASN 123           3HB      ASN 123  -1.993  15.465 -10.902
  944   HD21  ASN 123          2HD2      ASN 123  -2.163  12.391  -8.931
  945   HD22  ASN 123          1HD2      ASN 123  -3.909  12.437  -8.809
  946    H    ARG 124           H        ARG 124  -2.780  11.818 -11.299
  947    HA   ARG 124           HA       ARG 124  -3.089  11.347 -14.094
  948    HB2  ARG 124           2HB      ARG 124  -4.797  10.756 -11.631
  949    HB3  ARG 124           3HB      ARG 124  -5.194  10.139 -13.241
  950    HG2  ARG 124           2HG      ARG 124  -3.167   8.856 -13.382
  951    HG3  ARG 124           3HG      ARG 124  -2.473   9.656 -11.974
  952    HD2  ARG 124           2HD      ARG 124  -3.073   7.531 -11.221
  953    HD3  ARG 124           3HD      ARG 124  -4.303   8.624 -10.558
  954    HE   ARG 124           HE       ARG 124  -5.549   7.849 -12.791
  955   HH11  ARG 124          1HH1      ARG 124  -3.779   5.791 -10.469
  956   HH12  ARG 124          2HH1      ARG 124  -4.782   4.417 -10.764
  957   HH21  ARG 124          1HH2      ARG 124  -6.826   6.045 -13.139
  958   HH22  ARG 124          2HH2      ARG 124  -6.521   4.527 -12.336
  959    H    LYS 125           H        LYS 125  -5.324  11.531 -15.165
  960    HA   LYS 125           HA       LYS 125  -5.886  14.286 -15.674
  961    HB2  LYS 125           2HB      LYS 125  -7.602  11.810 -16.132
  962    HB3  LYS 125           3HB      LYS 125  -7.920  13.384 -16.845
  963    HG2  LYS 125           2HG      LYS 125  -5.382  11.786 -17.394
  964    HG3  LYS 125           3HG      LYS 125  -6.852  11.674 -18.362
  965    HD2  LYS 125           2HD      LYS 125  -6.659  14.218 -18.713
  966    HD3  LYS 125           3HD      LYS 125  -5.022  14.079 -18.020
  967    HE2  LYS 125           2HE      LYS 125  -4.393  12.455 -19.750
  968    HE3  LYS 125           3HE      LYS 125  -6.043  12.436 -20.388
  969    HZ1  LYS 125           3HZ      LYS 125  -5.779  14.726 -21.037
  970    HZ2  LYS 125           1HZ      LYS 125  -4.229  14.763 -20.449
  971    HZ3  LYS 125           2HZ      LYS 125  -4.650  13.785 -21.733
  972    H    ASP 126           H        ASP 126  -7.830  15.518 -15.178
  973    HA   ASP 126           HA       ASP 126  -9.092  14.983 -12.600
  974    HB2  ASP 126           2HB      ASP 126  -8.584  17.248 -13.316
  975    HB3  ASP 126           3HB      ASP 126  -9.593  17.075 -14.753
  976    H    LEU 127           H        LEU 127  -9.805  14.373 -15.955
  977    HA   LEU 127           HA       LEU 127 -12.610  14.267 -15.920
  978    HB2  LEU 127           2HB      LEU 127 -10.935  14.385 -17.826
  979    HB3  LEU 127           3HB      LEU 127 -10.761  12.635 -17.710
  980    HG   LEU 127           HG       LEU 127 -12.216  13.405 -19.558
  981   HD11  LEU 127          1HD1      LEU 127 -13.796  11.837 -17.492
  982   HD12  LEU 127          2HD1      LEU 127 -14.172  11.944 -19.197
  983   HD13  LEU 127          3HD1      LEU 127 -12.676  11.161 -18.681
  984   HD21  LEU 127          3HD2      LEU 127 -14.082  14.489 -17.424
  985   HD22  LEU 127          1HD2      LEU 127 -13.157  15.413 -18.632
  986   HD23  LEU 127          2HD2      LEU 127 -14.451  14.319 -19.144
  987    H    ILE 128           H        ILE 128 -14.023  12.846 -15.128
  988    HA   ILE 128           HA       ILE 128 -13.300  10.769 -13.372
  989    HB   ILE 128           HB       ILE 128 -15.708  10.269 -13.286
  990   HG12  ILE 128          2HG1      ILE 128 -16.039  12.147 -15.655
  991   HG13  ILE 128          3HG1      ILE 128 -16.207  10.386 -15.696
  992   HG21  ILE 128          1HG2      ILE 128 -15.134  13.274 -13.454
  993   HG22  ILE 128          2HG2      ILE 128 -16.496  12.544 -12.606
  994   HG23  ILE 128          3HG2      ILE 128 -14.867  12.235 -12.050
  995   HD11  ILE 128          3HD1      ILE 128 -18.102  10.512 -14.105
  996   HD12  ILE 128          1HD1      ILE 128 -17.979  12.284 -14.092
  997   HD13  ILE 128          2HD1      ILE 128 -18.409  11.457 -15.580
  998    H    LYS 129           H        LYS 129 -13.772   8.510 -13.371
  999    HA   LYS 129           HA       LYS 129 -12.636   7.225 -15.632
 1000    HB2  LYS 129           2HB      LYS 129 -12.926   5.166 -14.442
 1001    HB3  LYS 129           3HB      LYS 129 -12.402   6.413 -13.309
 1002    HG2  LYS 129           2HG      LYS 129 -14.674   6.619 -12.406
 1003    HG3  LYS 129           3HG      LYS 129 -15.297   5.479 -13.619
 1004    HD2  LYS 129           2HD      LYS 129 -13.869   3.695 -12.713
 1005    HD3  LYS 129           3HD      LYS 129 -13.211   4.802 -11.502
 1006    HE2  LYS 129           2HE      LYS 129 -16.134   3.973 -11.738
 1007    HE3  LYS 129           3HE      LYS 129 -14.962   3.257 -10.620
 1008    HZ1  LYS 129           3HZ      LYS 129 -14.719   5.410  -9.552
 1009    HZ2  LYS 129           1HZ      LYS 129 -15.798   6.087 -10.574
 1010    HZ3  LYS 129           2HZ      LYS 129 -16.283   4.926  -9.517
 1011    H    LYS 130           H        LYS 130 -15.940   8.026 -15.183
 1012    HA   LYS 130           HA       LYS 130 -17.183   5.830 -16.487
 1013    HB2  LYS 130           2HB      LYS 130 -18.010   8.767 -16.442
 1014    HB3  LYS 130           3HB      LYS 130 -19.022   7.419 -16.976
 1015    HG2  LYS 130           2HG      LYS 130 -18.795   6.409 -14.661
 1016    HG3  LYS 130           3HG      LYS 130 -17.964   7.894 -14.155
 1017    HD2  LYS 130           2HD      LYS 130 -19.979   9.219 -14.809
 1018    HD3  LYS 130           3HD      LYS 130 -20.803   7.712 -15.262
 1019    HE2  LYS 130           2HE      LYS 130 -20.546   6.878 -12.936
 1020    HE3  LYS 130           3HE      LYS 130 -19.735   8.394 -12.486
 1021    HZ1  LYS 130           3HZ      LYS 130 -21.779   9.567 -13.020
 1022    HZ2  LYS 130           1HZ      LYS 130 -22.532   8.162 -13.432
 1023    HZ3  LYS 130           2HZ      LYS 130 -22.061   8.420 -11.883
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1   8.450 -23.985   1.214
    2    H2   MET   1           H2       MET   1   8.488 -22.974   2.510
    3    H3   MET   1           H3       MET   1   9.741 -24.126   2.224
    4    HA   MET   1           HA       MET   1   9.588 -21.482   1.483
    5    HB2  MET   1           2HB      MET   1  11.576 -22.921   2.216
    6    HB3  MET   1           3HB      MET   1  11.587 -23.565   0.561
    7    HG2  MET   1           2HG      MET   1  11.755 -20.619   1.213
    8    HG3  MET   1           3HG      MET   1  13.187 -21.662   1.090
    9    HE1  MET   1           3HE      MET   1  12.969 -18.959  -0.484
   10    HE2  MET   1           1HE      MET   1  14.346 -20.078  -0.621
   11    HE3  MET   1           2HE      MET   1  13.569 -19.440  -2.088
   12    H    ALA   2           H        ALA   2  10.245 -24.088  -0.921
   13    HA   ALA   2           HA       ALA   2   9.291 -22.591  -3.132
   14    HB1  ALA   2           1HB      ALA   2   9.368 -25.609  -2.705
   15    HB2  ALA   2           2HB      ALA   2   9.217 -24.782  -4.271
   16    HB3  ALA   2           3HB      ALA   2  10.709 -24.610  -3.319
   17    H    ALA   3           H        ALA   3   7.410 -22.732  -4.333
   18    HA   ALA   3           HA       ALA   3   4.967 -24.087  -3.279
   19    HB1  ALA   3           1HB      ALA   3   5.202 -21.091  -3.816
   20    HB2  ALA   3           2HB      ALA   3   3.695 -21.969  -3.470
   21    HB3  ALA   3           3HB      ALA   3   4.953 -21.846  -2.224
   22    H    LYS   4           H        LYS   4   3.323 -22.669  -5.221
   23    HA   LYS   4           HA       LYS   4   3.804 -23.990  -7.692
   24    HB2  LYS   4           2HB      LYS   4   2.336 -21.395  -7.091
   25    HB3  LYS   4           3HB      LYS   4   2.267 -22.260  -8.643
   26    HG2  LYS   4           2HG      LYS   4   1.238 -24.191  -7.594
   27    HG3  LYS   4           3HG      LYS   4   1.456 -23.483  -5.978
   28    HD2  LYS   4           2HD      LYS   4  -0.853 -23.226  -6.606
   29    HD3  LYS   4           3HD      LYS   4  -0.075 -21.627  -6.619
   30    HE2  LYS   4           2HE      LYS   4   0.148 -21.776  -9.098
   31    HE3  LYS   4           3HE      LYS   4  -0.674 -23.353  -9.065
   32    HZ1  LYS   4           3HZ      LYS   4  -2.607 -22.252  -8.154
   33    HZ2  LYS   4           1HZ      LYS   4  -1.855 -20.793  -8.186
   34    HZ3  LYS   4           2HZ      LYS   4  -2.200 -21.563  -9.601
   35    H    PHE   5           H        PHE   5   5.441 -21.279  -6.397
   36    HA   PHE   5           HA       PHE   5   7.021 -20.960  -8.907
   37    HB2  PHE   5           2HB      PHE   5   5.999 -18.800  -7.022
   38    HB3  PHE   5           3HB      PHE   5   7.213 -18.497  -8.279
   39    HD1  PHE   5           HD1      PHE   5   3.667 -19.255  -7.597
   40    HD2  PHE   5           HD2      PHE   5   6.596 -18.303 -10.622
   41    HE1  PHE   5           HE1      PHE   5   1.846 -18.974  -9.275
   42    HE2  PHE   5           HE2      PHE   5   4.762 -17.973 -12.272
   43    HZ   PHE   5           HZ       PHE   5   2.401 -18.361 -11.622
   44    H    GLU   6           H        GLU   6   9.190 -20.115  -8.395
   45    HA   GLU   6           HA       GLU   6  10.232 -20.638  -5.666
   46    HB2  GLU   6           2HB      GLU   6  11.158 -21.978  -8.225
   47    HB3  GLU   6           3HB      GLU   6  12.149 -21.882  -6.751
   48    HG2  GLU   6           2HG      GLU   6  10.380 -23.092  -5.502
   49    HG3  GLU   6           3HG      GLU   6   9.432 -23.245  -6.998
   50    H    VAL   7           H        VAL   7  12.061 -19.368  -5.267
   51    HA   VAL   7           HA       VAL   7  12.419 -16.927  -6.654
   52    HB   VAL   7           HB       VAL   7  14.382 -16.613  -5.230
   53   HG11  VAL   7          1HG1      VAL   7  12.161 -18.124  -3.772
   54   HG12  VAL   7          2HG1      VAL   7  13.329 -17.022  -3.016
   55   HG13  VAL   7          3HG1      VAL   7  12.147 -16.401  -4.191
   56   HG21  VAL   7          3HG2      VAL   7  14.199 -19.532  -4.466
   57   HG22  VAL   7          1HG2      VAL   7  15.489 -18.764  -5.419
   58   HG23  VAL   7          2HG2      VAL   7  15.248 -18.302  -3.721
   59    H    GLY   8           H        GLY   8  13.568 -16.099  -8.091
   60    HA2  GLY   8           2HA      GLY   8  15.293 -15.889  -9.645
   61    HA3  GLY   8           3HA      GLY   8  15.723 -17.598  -9.414
   62    H    SER   9           H        SER   9  12.673 -18.240  -9.795
   63    HA   SER   9           HA       SER   9  12.736 -18.804 -12.592
   64    HB2  SER   9           2HB      SER   9  10.244 -18.529 -10.893
   65    HB3  SER   9           3HB      SER   9  10.499 -19.556 -12.323
   66    HG   SER   9           HG       SER   9  10.631 -20.741 -10.340
   67    H    VAL  10           H        VAL  10  11.067 -18.052 -14.176
   68    HA   VAL  10           HA       VAL  10  10.388 -15.166 -13.938
   69    HB   VAL  10           HB       VAL  10  11.873 -16.408 -16.292
   70   HG11  VAL  10          1HG1      VAL  10  10.981 -13.526 -15.789
   71   HG12  VAL  10          2HG1      VAL  10  11.945 -14.085 -17.176
   72   HG13  VAL  10          3HG1      VAL  10  10.268 -14.637 -16.980
   73   HG21  VAL  10          3HG2      VAL  10  12.855 -14.333 -14.304
   74   HG22  VAL  10          1HG2      VAL  10  13.429 -16.011 -14.441
   75   HG23  VAL  10          2HG2      VAL  10  13.712 -14.864 -15.768
   76    H    TYR  11           H        TYR  11   8.353 -14.897 -14.523
   77    HA   TYR  11           HA       TYR  11   7.052 -16.702 -16.511
   78    HB2  TYR  11           2HB      TYR  11   6.206 -16.147 -13.670
   79    HB3  TYR  11           3HB      TYR  11   5.040 -16.670 -14.902
   80    HD1  TYR  11           HD1      TYR  11   5.205 -18.928 -15.929
   81    HD2  TYR  11           HD2      TYR  11   7.798 -17.728 -12.699
   82    HE1  TYR  11           HE1      TYR  11   5.753 -21.313 -15.497
   83    HE2  TYR  11           HE2      TYR  11   8.308 -20.122 -12.216
   84    HH   TYR  11           HH       TYR  11   6.896 -22.790 -14.186
   85    H    THR  12           H        THR  12   4.737 -15.757 -16.890
   86    HA   THR  12           HA       THR  12   4.933 -12.778 -17.110
   87    HB   THR  12           HB       THR  12   3.496 -14.674 -18.987
   88    HG1  THR  12           1HG      THR  12   5.320 -14.343 -20.358
   89   HG21  THR  12          1HG2      THR  12   4.444 -11.792 -19.320
   90   HG22  THR  12          2HG2      THR  12   3.618 -12.762 -20.561
   91   HG23  THR  12          3HG2      THR  12   2.763 -12.305 -19.072
   92    H    GLY  13           H        GLY  13   3.085 -11.592 -16.727
   93    HA2  GLY  13           2HA      GLY  13   0.674 -12.878 -15.661
   94    HA3  GLY  13           3HA      GLY  13   1.690 -12.049 -14.461
   95    H    LYS  14           H        LYS  14  -0.580 -10.901 -14.468
   96    HA   LYS  14           HA       LYS  14  -0.346  -8.501 -16.237
   97    HB2  LYS  14           2HB      LYS  14  -2.764 -10.205 -15.624
   98    HB3  LYS  14           3HB      LYS  14  -2.952  -8.464 -15.945
   99    HG2  LYS  14           2HG      LYS  14  -1.805  -8.705 -18.089
  100    HG3  LYS  14           3HG      LYS  14  -1.524 -10.430 -17.769
  101    HD2  LYS  14           2HD      LYS  14  -3.368 -10.188 -19.334
  102    HD3  LYS  14           3HD      LYS  14  -3.974 -10.818 -17.784
  103    HE2  LYS  14           2HE      LYS  14  -4.753  -8.566 -17.156
  104    HE3  LYS  14           3HE      LYS  14  -4.111  -7.907 -18.679
  105    HZ1  LYS  14           3HZ      LYS  14  -5.671  -9.301 -19.861
  106    HZ2  LYS  14           1HZ      LYS  14  -6.265  -9.912 -18.449
  107    HZ3  LYS  14           2HZ      LYS  14  -6.475  -8.316 -18.809
  108    H    VAL  15           H        VAL  15  -0.551  -6.603 -15.327
  109    HA   VAL  15           HA       VAL  15  -0.115  -6.467 -12.465
  110    HB   VAL  15           HB       VAL  15  -0.660  -4.161 -14.361
  111   HG11  VAL  15          1HG1      VAL  15   1.057  -4.439 -11.849
  112   HG12  VAL  15          2HG1      VAL  15   0.868  -2.957 -12.814
  113   HG13  VAL  15          3HG1      VAL  15  -0.523  -3.629 -11.937
  114   HG21  VAL  15          3HG2      VAL  15   1.999  -5.556 -13.946
  115   HG22  VAL  15          1HG2      VAL  15   1.044  -5.535 -15.442
  116   HG23  VAL  15          2HG2      VAL  15   1.742  -4.032 -14.823
  117    H    THR  16           H        THR  16  -1.523  -6.271 -10.917
  118    HA   THR  16           HA       THR  16  -4.416  -5.831 -11.598
  119    HB   THR  16           HB       THR  16  -4.622  -7.329  -9.445
  120    HG1  THR  16           1HG      THR  16  -2.891  -8.824  -9.303
  121   HG21  THR  16          1HG2      THR  16  -3.676  -8.480 -12.109
  122   HG22  THR  16          2HG2      THR  16  -4.585  -9.359 -10.859
  123   HG23  THR  16          3HG2      THR  16  -5.345  -8.006 -11.716
  124    H    GLY  17           H        GLY  17  -1.829  -4.431  -9.803
  125    HA2  GLY  17           2HA      GLY  17  -3.622  -2.288  -9.152
  126    HA3  GLY  17           3HA      GLY  17  -3.192  -3.206  -7.692
  127    H    LEU  18           H        LEU  18  -2.491  -0.589  -7.918
  128    HA   LEU  18           HA       LEU  18   0.484  -0.753  -7.911
  129    HB2  LEU  18           2HB      LEU  18  -1.241   1.521  -8.885
  130    HB3  LEU  18           3HB      LEU  18   0.498   1.677  -8.555
  131    HG   LEU  18           HG       LEU  18  -0.739  -0.119 -10.692
  132   HD11  LEU  18          1HD1      LEU  18   0.831   2.487 -10.940
  133   HD12  LEU  18          2HD1      LEU  18   0.284   1.474 -12.295
  134   HD13  LEU  18          3HD1      LEU  18  -0.908   2.288 -11.256
  135   HD21  LEU  18          3HD2      LEU  18   2.174   0.479 -10.132
  136   HD22  LEU  18          1HD2      LEU  18   1.338  -1.065  -9.858
  137   HD23  LEU  18          2HD2      LEU  18   1.536  -0.453 -11.509
  138    H    GLN  19           H        GLN  19   1.386   0.393  -6.276
  139    HA   GLN  19           HA       GLN  19  -0.240   1.738  -4.184
  140    HB2  GLN  19           2HB      GLN  19   1.688  -0.558  -3.748
  141    HB3  GLN  19           3HB      GLN  19   1.009   0.466  -2.465
  142    HG2  GLN  19           2HG      GLN  19  -0.767  -1.165  -4.295
  143    HG3  GLN  19           3HG      GLN  19  -0.038  -1.890  -2.851
  144   HE21  GLN  19          2HE2      GLN  19  -1.698  -2.127  -1.401
  145   HE22  GLN  19          1HE2      GLN  19  -2.806  -0.853  -0.942
  146    H    ALA  20           H        ALA  20   1.261   3.084  -2.838
  147    HA   ALA  20           HA       ALA  20   3.453   4.239  -4.191
  148    HB1  ALA  20           1HB      ALA  20   2.825   4.245  -1.209
  149    HB2  ALA  20           2HB      ALA  20   3.887   5.393  -2.057
  150    HB3  ALA  20           3HB      ALA  20   2.145   5.362  -2.418
  151    H    TYR  21           H        TYR  21   3.426   1.188  -2.790
  152    HA   TYR  21           HA       TYR  21   6.411   1.138  -2.560
  153    HB2  TYR  21           2HB      TYR  21   4.877   0.998  -0.410
  154    HB3  TYR  21           3HB      TYR  21   4.619  -0.666  -0.974
  155    HD1  TYR  21           HD2      TYR  21   7.321   1.803  -0.144
  156    HD2  TYR  21           HD1      TYR  21   6.205  -2.356  -0.417
  157    HE1  TYR  21           HE2      TYR  21   9.506   1.158   0.866
  158    HE2  TYR  21           HE1      TYR  21   8.379  -3.015   0.595
  159    HH   TYR  21           HH       TYR  21  10.373  -2.296   1.445
  160    H    GLY  22           H        GLY  22   4.018   0.110  -4.649
  161    HA2  GLY  22           2HA      GLY  22   5.738  -1.479  -6.068
  162    HA3  GLY  22           3HA      GLY  22   4.982  -2.603  -4.919
  163    H    ALA  23           H        ALA  23   4.588  -3.352  -7.278
  164    HA   ALA  23           HA       ALA  23   1.828  -2.554  -8.192
  165    HB1  ALA  23           1HB      ALA  23   4.226  -3.474  -9.830
  166    HB2  ALA  23           2HB      ALA  23   2.582  -3.209 -10.450
  167    HB3  ALA  23           3HB      ALA  23   3.532  -1.839  -9.833
  168    H    PHE  24           H        PHE  24   0.433  -4.161  -7.727
  169    HA   PHE  24           HA       PHE  24   1.370  -6.859  -7.202
  170    HB2  PHE  24           2HB      PHE  24  -1.370  -5.586  -7.497
  171    HB3  PHE  24           3HB      PHE  24  -1.162  -7.334  -7.285
  172    HD1  PHE  24           HD1      PHE  24   0.337  -8.066  -5.248
  173    HD2  PHE  24           HD2      PHE  24  -1.637  -4.243  -5.619
  174    HE1  PHE  24           HE1      PHE  24   0.404  -7.788  -2.774
  175    HE2  PHE  24           HE2      PHE  24  -1.563  -3.969  -3.148
  176    HZ   PHE  24           HZ       PHE  24  -0.543  -5.737  -1.722
  177    H    VAL  25           H        VAL  25   1.388  -8.579  -8.595
  178    HA   VAL  25           HA       VAL  25   0.222  -8.265 -11.320
  179    HB   VAL  25           HB       VAL  25   2.983  -9.420 -10.755
  180   HG11  VAL  25          1HG1      VAL  25   1.506  -8.743 -13.339
  181   HG12  VAL  25          2HG1      VAL  25   3.159  -9.384 -13.230
  182   HG13  VAL  25          3HG1      VAL  25   1.786 -10.380 -12.703
  183   HG21  VAL  25          3HG2      VAL  25   2.301  -6.739 -12.005
  184   HG22  VAL  25          1HG2      VAL  25   3.076  -6.990 -10.426
  185   HG23  VAL  25          2HG2      VAL  25   3.918  -7.473 -11.911
  186    H    ALA  26           H        ALA  26  -1.344  -9.669 -11.325
  187    HA   ALA  26           HA       ALA  26  -1.293 -12.201  -9.900
  188    HB1  ALA  26           1HB      ALA  26  -3.057 -11.203 -12.166
  189    HB2  ALA  26           2HB      ALA  26  -3.342 -12.659 -11.182
  190    HB3  ALA  26           3HB      ALA  26  -3.401 -11.054 -10.425
  191    H    LEU  27           H        LEU  27  -0.997 -14.218 -10.704
  192    HA   LEU  27           HA       LEU  27   0.848 -14.365 -13.074
  193    HB2  LEU  27           2HB      LEU  27   0.952 -15.848 -10.455
  194    HB3  LEU  27           3HB      LEU  27   2.108 -16.033 -11.792
  195    HG   LEU  27           HG       LEU  27   1.737 -13.513 -10.104
  196   HD11  LEU  27          1HD1      LEU  27   3.993 -15.567 -10.174
  197   HD12  LEU  27          2HD1      LEU  27   3.983 -14.069  -9.217
  198   HD13  LEU  27          3HD1      LEU  27   2.816 -15.359  -8.857
  199   HD21  LEU  27          3HD2      LEU  27   3.785 -14.081 -12.257
  200   HD22  LEU  27          1HD2      LEU  27   2.433 -12.930 -12.360
  201   HD23  LEU  27          2HD2      LEU  27   3.738 -12.658 -11.188
  202    H    ASP  28           H        ASP  28  -1.683 -15.803 -11.169
  203    HA   ASP  28           HA       ASP  28  -2.525 -17.593 -13.350
  204    HB2  ASP  28           2HB      ASP  28  -0.943 -18.969 -12.048
  205    HB3  ASP  28           3HB      ASP  28  -1.846 -18.595 -10.564
  206    H    GLU  29           H        GLU  29  -4.706 -18.500 -12.685
  207    HA   GLU  29           HA       GLU  29  -6.509 -16.454 -11.877
  208    HB2  GLU  29           2HB      GLU  29  -6.751 -19.471 -12.096
  209    HB3  GLU  29           3HB      GLU  29  -8.130 -18.391 -11.782
  210    HG2  GLU  29           2HG      GLU  29  -7.656 -17.189 -13.892
  211    HG3  GLU  29           3HG      GLU  29  -6.325 -18.313 -14.248
  212    H    GLU  30           H        GLU  30  -4.600 -18.453  -9.859
  213    HA   GLU  30           HA       GLU  30  -6.153 -17.606  -7.439
  214    HB2  GLU  30           2HB      GLU  30  -4.895 -20.307  -8.006
  215    HB3  GLU  30           3HB      GLU  30  -5.630 -19.808  -6.468
  216    HG2  GLU  30           2HG      GLU  30  -7.039 -20.069  -9.119
  217    HG3  GLU  30           3HG      GLU  30  -7.140 -21.288  -7.834
  218    H    THR  31           H        THR  31  -3.343 -16.884  -8.945
  219    HA   THR  31           HA       THR  31  -1.875 -16.631  -6.365
  220    HB   THR  31           HB       THR  31  -0.588 -17.848  -8.828
  221    HG1  THR  31           1HG      THR  31  -0.719 -19.828  -7.670
  222   HG21  THR  31          1HG2      THR  31   0.256 -17.801  -5.895
  223   HG22  THR  31          2HG2      THR  31   1.149 -18.580  -7.220
  224   HG23  THR  31          3HG2      THR  31   0.963 -16.814  -7.196
  225    H    GLN  32           H        GLN  32  -0.511 -14.985  -6.241
  226    HA   GLN  32           HA       GLN  32  -0.097 -13.076  -8.467
  227    HB2  GLN  32           2HB      GLN  32  -2.297 -12.509  -7.696
  228    HB3  GLN  32           3HB      GLN  32  -1.784 -12.604  -5.997
  229    HG2  GLN  32           2HG      GLN  32  -0.567 -10.584  -6.128
  230    HG3  GLN  32           3HG      GLN  32  -0.628 -10.521  -7.898
  231   HE21  GLN  32          2HE2      GLN  32  -1.906  -9.099  -5.173
  232   HE22  GLN  32          1HE2      GLN  32  -3.433  -8.563  -5.836
  233    H    GLY  33           H        GLY  33   1.538 -11.553  -7.938
  234    HA2  GLY  33           2HA      GLY  33   2.801 -11.736  -5.250
  235    HA3  GLY  33           3HA      GLY  33   3.809 -11.885  -6.707
  236    H    LEU  34           H        LEU  34   4.692  -9.946  -5.395
  237    HA   LEU  34           HA       LEU  34   3.378  -7.388  -6.242
  238    HB2  LEU  34           2HB      LEU  34   2.806  -7.854  -3.953
  239    HB3  LEU  34           3HB      LEU  34   4.503  -8.174  -3.535
  240    HG   LEU  34           HG       LEU  34   5.083  -5.829  -3.912
  241   HD11  LEU  34          1HD1      LEU  34   2.124  -5.381  -4.514
  242   HD12  LEU  34          2HD1      LEU  34   3.353  -4.110  -4.342
  243   HD13  LEU  34          3HD1      LEU  34   3.453  -5.258  -5.687
  244   HD21  LEU  34          3HD2      LEU  34   2.621  -6.148  -2.148
  245   HD22  LEU  34          1HD2      LEU  34   4.306  -6.478  -1.680
  246   HD23  LEU  34          2HD2      LEU  34   3.796  -4.816  -2.047
  247    H    VAL  35           H        VAL  35   4.761  -6.744  -7.820
  248    HA   VAL  35           HA       VAL  35   7.630  -6.815  -7.572
  249    HB   VAL  35           HB       VAL  35   5.884  -4.866  -9.136
  250   HG11  VAL  35          1HG1      VAL  35   8.818  -5.666  -9.435
  251   HG12  VAL  35          2HG1      VAL  35   7.930  -4.563 -10.511
  252   HG13  VAL  35          3HG1      VAL  35   8.229  -4.106  -8.821
  253   HG21  VAL  35          3HG2      VAL  35   7.137  -7.458 -10.086
  254   HG22  VAL  35          1HG2      VAL  35   5.399  -7.155  -9.850
  255   HG23  VAL  35          2HG2      VAL  35   6.293  -6.265 -11.097
  256    H    HIS  36           H        HIS  36   8.669  -5.767  -5.876
  257    HA   HIS  36           HA       HIS  36   7.336  -3.648  -4.391
  258    HB2  HIS  36           2HB      HIS  36  10.160  -4.813  -4.324
  259    HB3  HIS  36           3HB      HIS  36   9.587  -3.519  -3.250
  260    HD1  HIS  36           HD1      HIS  36   7.584  -6.757  -4.092
  261    HD2  HIS  36           HD2      HIS  36   9.540  -4.776  -0.899
  262    HE1  HIS  36           HE1      HIS  36   7.026  -8.019  -2.041
  263    H    ILE  37           H        ILE  37   7.900  -1.415  -4.408
  264    HA   ILE  37           HA       ILE  37   8.414  -0.302  -7.017
  265    HB   ILE  37           HB       ILE  37   7.142   0.814  -5.167
  266   HG12  ILE  37          2HG1      ILE  37   9.365   2.528  -6.201
  267   HG13  ILE  37          3HG1      ILE  37   8.022   1.918  -7.194
  268   HG21  ILE  37          1HG2      ILE  37   9.917   1.351  -3.997
  269   HG22  ILE  37          2HG2      ILE  37   8.404   2.089  -3.439
  270   HG23  ILE  37          3HG2      ILE  37   8.655   0.343  -3.252
  271   HD11  ILE  37          3HD1      ILE  37   6.396   3.051  -5.700
  272   HD12  ILE  37          1HD1      ILE  37   7.736   3.668  -4.707
  273   HD13  ILE  37          2HD1      ILE  37   7.554   4.214  -6.384
  274    H    SER  38           H        SER  38  10.762  -0.908  -4.521
  275    HA   SER  38           HA       SER  38  12.992   0.259  -5.916
  276    HB2  SER  38           2HB      SER  38  13.078  -2.061  -3.970
  277    HB3  SER  38           3HB      SER  38  14.288  -0.781  -4.229
  278    HG   SER  38           HG       SER  38  13.014  -0.432  -2.326
  279    H    GLU  39           H        GLU  39  11.177  -2.319  -6.887
  280    HA   GLU  39           HA       GLU  39  13.421  -3.735  -8.279
  281    HB2  GLU  39           2HB      GLU  39  10.800  -4.787  -7.182
  282    HB3  GLU  39           3HB      GLU  39  11.945  -5.719  -8.154
  283    HG2  GLU  39           2HG      GLU  39  12.660  -4.451  -5.505
  284    HG3  GLU  39           3HG      GLU  39  12.029  -6.103  -5.622
  285    H    VAL  40           H        VAL  40  10.833  -1.633  -8.787
  286    HA   VAL  40           HA       VAL  40   9.746  -2.764 -11.225
  287    HB   VAL  40           HB       VAL  40   9.805   0.056 -10.109
  288   HG11  VAL  40          1HG1      VAL  40   8.074  -1.052 -12.372
  289   HG12  VAL  40          2HG1      VAL  40   7.913   0.561 -11.640
  290   HG13  VAL  40          3HG1      VAL  40   9.376   0.145 -12.557
  291   HG21  VAL  40          3HG2      VAL  40   7.604  -2.050 -10.109
  292   HG22  VAL  40          1HG2      VAL  40   8.545  -1.511  -8.705
  293   HG23  VAL  40          2HG2      VAL  40   7.440  -0.384  -9.511
  294    H    THR  41           H        THR  41  12.544  -0.650 -10.552
  295    HA   THR  41           HA       THR  41  13.652  -1.232 -13.225
  296    HB   THR  41           HB       THR  41  12.011   0.655 -13.540
  297    HG1  THR  41           1HG      THR  41  13.541   1.933 -14.677
  298   HG21  THR  41          1HG2      THR  41  14.002   2.228 -11.848
  299   HG22  THR  41          2HG2      THR  41  12.669   2.923 -12.792
  300   HG23  THR  41          3HG2      THR  41  12.321   1.872 -11.402
  301    H    HIS  42           H        HIS  42  15.614   0.093 -13.473
  302    HA   HIS  42           HA       HIS  42  17.641  -0.744 -11.644
  303    HB2  HIS  42           2HB      HIS  42  19.108   0.375 -13.185
  304    HB3  HIS  42           3HB      HIS  42  17.811  -0.344 -14.163
  305    HD1  HIS  42           HD1      HIS  42  15.690   1.755 -14.532
  306    HD2  HIS  42           HD2      HIS  42  19.763   2.785 -14.002
  307    HE1  HIS  42           HE1      HIS  42  15.947   4.053 -15.404
  308    H    GLY  43           H        GLY  43  15.563   1.598 -10.788
  309    HA2  GLY  43           2HA      GLY  43  17.210   2.908  -8.858
  310    HA3  GLY  43           3HA      GLY  43  17.016   3.953 -10.286
  311    H    PHE  44           H        PHE  44  15.860   5.249  -8.419
  312    HA   PHE  44           HA       PHE  44  13.200   4.421  -7.720
  313    HB2  PHE  44           2HB      PHE  44  14.490   6.166  -6.475
  314    HB3  PHE  44           3HB      PHE  44  14.354   7.241  -7.883
  315    HD1  PHE  44           HD1      PHE  44  11.913   5.051  -5.999
  316    HD2  PHE  44           HD2      PHE  44  12.924   8.992  -7.445
  317    HE1  PHE  44           HE1      PHE  44   9.717   5.910  -5.201
  318    HE2  PHE  44           HE2      PHE  44  10.758   9.860  -6.571
  319    HZ   PHE  44           HZ       PHE  44   9.140   8.317  -5.490
  320    H    VAL  45           H        VAL  45  11.270   4.849  -8.554
  321    HA   VAL  45           HA       VAL  45  11.092   5.075 -11.489
  322    HB   VAL  45           HB       VAL  45   8.662   4.597 -10.970
  323   HG11  VAL  45          1HG1      VAL  45  10.678   2.674  -9.719
  324   HG12  VAL  45          2HG1      VAL  45   9.025   2.262 -10.226
  325   HG13  VAL  45          3HG1      VAL  45  10.231   2.741 -11.439
  326   HG21  VAL  45          3HG2      VAL  45   9.622   4.350  -8.100
  327   HG22  VAL  45          1HG2      VAL  45   8.492   5.566  -8.737
  328   HG23  VAL  45          2HG2      VAL  45   8.037   3.850  -8.721
  329    H    LYS  46           H        LYS  46  11.041   7.410  -9.108
  330    HA   LYS  46           HA       LYS  46  10.406   9.613  -8.988
  331    HB2  LYS  46           2HB      LYS  46   9.064   9.440 -11.687
  332    HB3  LYS  46           3HB      LYS  46   9.544  10.891 -10.789
  333    HG2  LYS  46           2HG      LYS  46  11.405   8.880 -12.110
  334    HG3  LYS  46           3HG      LYS  46  11.022  10.507 -12.709
  335    HD2  LYS  46           2HD      LYS  46  12.071  11.478 -10.649
  336    HD3  LYS  46           3HD      LYS  46  12.521   9.834 -10.133
  337    HE2  LYS  46           2HE      LYS  46  13.838   9.535 -12.193
  338    HE3  LYS  46           3HE      LYS  46  13.370  11.163 -12.739
  339    HZ1  LYS  46           3HZ      LYS  46  14.531  12.063 -10.838
  340    HZ2  LYS  46           1HZ      LYS  46  14.964  10.554 -10.332
  341    HZ3  LYS  46           2HZ      LYS  46  15.558  11.151 -11.751
  342    H    ASP  47           H        ASP  47   7.898   7.754 -10.638
  343    HA   ASP  47           HA       ASP  47   6.368   7.437  -8.180
  344    HB2  ASP  47           2HB      ASP  47   5.377   9.537  -8.830
  345    HB3  ASP  47           3HB      ASP  47   5.181   8.999 -10.511
  346    H    ILE  48           H        ILE  48   5.233   5.424  -8.424
  347    HA   ILE  48           HA       ILE  48   6.288   3.654 -10.461
  348    HB   ILE  48           HB       ILE  48   5.570   3.065  -8.099
  349   HG12  ILE  48          2HG1      ILE  48   4.368   1.376 -10.259
  350   HG13  ILE  48          3HG1      ILE  48   6.096   1.472  -9.856
  351   HG21  ILE  48          1HG2      ILE  48   2.763   3.203  -9.307
  352   HG22  ILE  48          2HG2      ILE  48   3.168   2.530  -7.716
  353   HG23  ILE  48          3HG2      ILE  48   3.392   4.259  -8.024
  354   HD11  ILE  48          3HD1      ILE  48   5.608   0.679  -7.556
  355   HD12  ILE  48          1HD1      ILE  48   3.880   0.577  -7.959
  356   HD13  ILE  48          2HD1      ILE  48   5.042  -0.488  -8.771
  357    H    ASN  49           H        ASN  49   3.255   5.444 -10.651
  358    HA   ASN  49           HA       ASN  49   2.465   3.965 -12.996
  359    HB2  ASN  49           2HB      ASN  49   0.610   5.211 -12.899
  360    HB3  ASN  49           3HB      ASN  49   1.239   5.866 -11.372
  361   HD21  ASN  49          2HD2      ASN  49   2.744   7.840 -11.634
  362   HD22  ASN  49          1HD2      ASN  49   2.281   9.015 -12.867
  363    H    GLU  50           H        GLU  50   4.986   6.277 -12.647
  364    HA   GLU  50           HA       GLU  50   4.951   7.048 -15.481
  365    HB2  GLU  50           2HB      GLU  50   7.098   7.422 -13.372
  366    HB3  GLU  50           3HB      GLU  50   7.029   8.202 -14.963
  367    HG2  GLU  50           2HG      GLU  50   5.078   8.629 -12.659
  368    HG3  GLU  50           3HG      GLU  50   6.367   9.725 -13.198
  369    H    HIS  51           H        HIS  51   5.935   4.224 -13.842
  370    HA   HIS  51           HA       HIS  51   7.721   3.473 -16.133
  371    HB2  HIS  51           2HB      HIS  51   8.824   4.274 -13.867
  372    HB3  HIS  51           3HB      HIS  51   8.471   2.622 -13.317
  373    HD1  HIS  51           HD1      HIS  51   9.309   0.845 -15.625
  374    HD2  HIS  51           HD2      HIS  51  11.348   4.422 -14.670
  375    HE1  HIS  51           HE1      HIS  51  11.557   0.664 -16.673
  376    H    LEU  52           H        LEU  52   4.997   2.580 -14.338
  377    HA   LEU  52           HA       LEU  52   4.935   0.099 -15.965
  378    HB2  LEU  52           2HB      LEU  52   5.670  -0.174 -13.409
  379    HB3  LEU  52           3HB      LEU  52   3.916  -0.107 -13.144
  380    HG   LEU  52           HG       LEU  52   3.776  -1.931 -15.004
  381   HD11  LEU  52          1HD1      LEU  52   6.699  -2.240 -14.182
  382   HD12  LEU  52          2HD1      LEU  52   5.776  -3.383 -15.184
  383   HD13  LEU  52          3HD1      LEU  52   6.123  -1.749 -15.791
  384   HD21  LEU  52          3HD2      LEU  52   4.996  -2.586 -12.307
  385   HD22  LEU  52          1HD2      LEU  52   3.266  -2.359 -12.662
  386   HD23  LEU  52          2HD2      LEU  52   4.144  -3.732 -13.373
  387    H    SER  53           H        SER  53   2.576  -0.860 -15.566
  388    HA   SER  53           HA       SER  53   0.552   1.325 -15.624
  389    HB2  SER  53           2HB      SER  53   0.838  -0.837 -17.736
  390    HB3  SER  53           3HB      SER  53  -0.371   0.467 -17.687
  391    HG   SER  53           HG       SER  53   1.378   0.909 -19.134
  392    H    VAL  54           H        VAL  54  -1.289   0.590 -14.475
  393    HA   VAL  54           HA       VAL  54  -1.631  -2.273 -13.776
  394    HB   VAL  54           HB       VAL  54  -2.228  -0.337 -12.278
  395   HG11  VAL  54          1HG1      VAL  54  -4.546   0.041 -14.229
  396   HG12  VAL  54          2HG1      VAL  54  -4.401   0.807 -12.632
  397   HG13  VAL  54          3HG1      VAL  54  -3.247   1.216 -13.920
  398   HG21  VAL  54          3HG2      VAL  54  -4.413  -2.288 -12.934
  399   HG22  VAL  54          1HG2      VAL  54  -3.054  -2.504 -11.806
  400   HG23  VAL  54          2HG2      VAL  54  -4.311  -1.294 -11.465
  401    H    GLY  55           H        GLY  55  -3.188  -3.653 -14.438
  402    HA2  GLY  55           2HA      GLY  55  -4.552  -4.672 -15.965
  403    HA3  GLY  55           3HA      GLY  55  -5.025  -3.058 -16.545
  404    H    ASP  56           H        ASP  56  -1.677  -4.220 -16.522
  405    HA   ASP  56           HA       ASP  56  -1.735  -4.615 -19.494
  406    HB2  ASP  56           2HB      ASP  56  -0.694  -2.430 -18.833
  407    HB3  ASP  56           3HB      ASP  56   0.432  -3.353 -17.812
  408    H    GLU  57           H        GLU  57   0.130  -6.004 -20.190
  409    HA   GLU  57           HA       GLU  57   0.489  -8.278 -18.272
  410    HB2  GLU  57           2HB      GLU  57  -0.773  -8.667 -20.351
  411    HB3  GLU  57           3HB      GLU  57   0.627  -8.105 -21.293
  412    HG2  GLU  57           2HG      GLU  57   1.967  -9.982 -20.501
  413    HG3  GLU  57           3HG      GLU  57   0.651 -10.521 -19.434
  414    H    VAL  58           H        VAL  58   2.500  -8.969 -17.739
  415    HA   VAL  58           HA       VAL  58   4.939  -7.616 -18.812
  416    HB   VAL  58           HB       VAL  58   5.594  -7.027 -16.474
  417   HG11  VAL  58          1HG1      VAL  58   3.031  -5.643 -17.400
  418   HG12  VAL  58          2HG1      VAL  58   4.202  -4.984 -16.238
  419   HG13  VAL  58          3HG1      VAL  58   4.679  -5.241 -17.932
  420   HG21  VAL  58          3HG2      VAL  58   2.726  -7.595 -15.715
  421   HG22  VAL  58          1HG2      VAL  58   4.173  -8.474 -15.173
  422   HG23  VAL  58          2HG2      VAL  58   3.938  -6.778 -14.703
  423    H    GLN  59           H        GLN  59   6.788  -8.784 -18.573
  424    HA   GLN  59           HA       GLN  59   6.527 -11.475 -17.372
  425    HB2  GLN  59           2HB      GLN  59   8.881 -10.180 -18.793
  426    HB3  GLN  59           3HB      GLN  59   8.760 -11.877 -18.275
  427    HG2  GLN  59           2HG      GLN  59   6.552 -11.829 -19.760
  428    HG3  GLN  59           3HG      GLN  59   7.361 -10.457 -20.540
  429   HE21  GLN  59          2HE2      GLN  59   7.015 -13.834 -20.499
  430   HE22  GLN  59          1HE2      GLN  59   8.406 -14.239 -21.493
  431    H    VAL  60           H        VAL  60   7.481 -12.005 -15.474
  432    HA   VAL  60           HA       VAL  60   8.910  -9.896 -13.863
  433    HB   VAL  60           HB       VAL  60   7.566 -10.940 -11.928
  434   HG11  VAL  60          1HG1      VAL  60   6.061  -9.264 -13.983
  435   HG12  VAL  60          2HG1      VAL  60   5.628  -9.434 -12.267
  436   HG13  VAL  60          3HG1      VAL  60   7.150  -8.640 -12.720
  437   HG21  VAL  60          3HG2      VAL  60   5.712 -11.822 -14.144
  438   HG22  VAL  60          1HG2      VAL  60   6.614 -12.868 -13.022
  439   HG23  VAL  60          2HG2      VAL  60   5.342 -11.793 -12.410
  440    H    LYS  61           H        LYS  61  10.540 -10.593 -12.587
  441    HA   LYS  61           HA       LYS  61  11.173 -13.507 -12.611
  442    HB2  LYS  61           2HB      LYS  61  12.921 -11.816 -13.184
  443    HB3  LYS  61           3HB      LYS  61  12.758 -11.148 -11.544
  444    HG2  LYS  61           2HG      LYS  61  13.533 -13.249 -10.556
  445    HG3  LYS  61           3HG      LYS  61  13.554 -14.033 -12.151
  446    HD2  LYS  61           2HD      LYS  61  15.250 -12.385 -12.910
  447    HD3  LYS  61           3HD      LYS  61  15.261 -11.679 -11.278
  448    HE2  LYS  61           2HE      LYS  61  17.162 -13.073 -11.345
  449    HE3  LYS  61           3HE      LYS  61  15.941 -13.987 -10.429
  450    HZ1  LYS  61           3HZ      LYS  61  15.486 -15.258 -12.425
  451    HZ2  LYS  61           1HZ      LYS  61  16.621 -14.402 -13.274
  452    HZ3  LYS  61           2HZ      LYS  61  17.078 -15.376 -12.027
  453    H    VAL  62           H        VAL  62  10.729 -14.743 -10.866
  454    HA   VAL  62           HA       VAL  62   9.465 -13.733  -8.480
  455    HB   VAL  62           HB       VAL  62  10.878 -16.394  -8.925
  456   HG11  VAL  62          1HG1      VAL  62   8.671 -15.547  -6.985
  457   HG12  VAL  62          2HG1      VAL  62   9.329 -17.191  -7.149
  458   HG13  VAL  62          3HG1      VAL  62  10.361 -15.877  -6.547
  459   HG21  VAL  62          3HG2      VAL  62   7.963 -15.674  -9.419
  460   HG22  VAL  62          1HG2      VAL  62   9.173 -16.065 -10.664
  461   HG23  VAL  62          2HG2      VAL  62   8.668 -17.306  -9.503
  462    H    LEU  63           H        LEU  63  10.370 -12.584  -6.961
  463    HA   LEU  63           HA       LEU  63  13.323 -12.582  -6.591
  464    HB2  LEU  63           2HB      LEU  63  12.093 -10.498  -6.944
  465    HB3  LEU  63           3HB      LEU  63  11.099 -10.824  -5.509
  466    HG   LEU  63           HG       LEU  63  13.168 -10.742  -4.103
  467   HD11  LEU  63          1HD1      LEU  63  14.487  -9.706  -6.656
  468   HD12  LEU  63          2HD1      LEU  63  15.220  -9.708  -5.036
  469   HD13  LEU  63          3HD1      LEU  63  14.862 -11.247  -5.848
  470   HD21  LEU  63          3HD2      LEU  63  12.563  -8.286  -5.798
  471   HD22  LEU  63          1HD2      LEU  63  11.683  -8.803  -4.343
  472   HD23  LEU  63          2HD2      LEU  63  13.374  -8.265  -4.215
  473    H    ALA  64           H        ALA  64  10.300 -13.240  -4.825
  474    HA   ALA  64           HA       ALA  64  11.692 -14.983  -2.893
  475    HB1  ALA  64           1HB      ALA  64  10.174 -12.513  -1.980
  476    HB2  ALA  64           2HB      ALA  64  10.753 -13.822  -0.933
  477    HB3  ALA  64           3HB      ALA  64  11.920 -12.789  -1.791
  478    H    VAL  65           H        VAL  65  10.172 -16.359  -1.808
  479    HA   VAL  65           HA       VAL  65   7.245 -15.938  -2.159
  480    HB   VAL  65           HB       VAL  65   7.693 -17.256  -4.099
  481   HG11  VAL  65          1HG1      VAL  65   9.293 -19.190  -2.355
  482   HG12  VAL  65          2HG1      VAL  65   8.860 -19.447  -4.062
  483   HG13  VAL  65          3HG1      VAL  65   9.961 -18.128  -3.616
  484   HG21  VAL  65          3HG2      VAL  65   6.708 -19.062  -1.896
  485   HG22  VAL  65          1HG2      VAL  65   5.752 -17.949  -2.897
  486   HG23  VAL  65          2HG2      VAL  65   6.538 -19.357  -3.641
  487    H    ASP  66           H        ASP  66   6.104 -16.514  -0.491
  488    HA   ASP  66           HA       ASP  66   7.290 -18.250   1.600
  489    HB2  ASP  66           2HB      ASP  66   7.915 -15.895   2.169
  490    HB3  ASP  66           3HB      ASP  66   6.188 -15.482   2.207
  491    H    GLU  67           H        GLU  67   5.816 -19.794   1.713
  492    HA   GLU  67           HA       GLU  67   3.052 -19.393   0.862
  493    HB2  GLU  67           2HB      GLU  67   4.496 -21.382   0.376
  494    HB3  GLU  67           3HB      GLU  67   4.435 -21.789   2.106
  495    HG2  GLU  67           2HG      GLU  67   1.986 -22.105   1.967
  496    HG3  GLU  67           3HG      GLU  67   2.025 -21.555   0.277
  497    H    GLU  68           H        GLU  68   4.664 -19.306   4.001
  498    HA   GLU  68           HA       GLU  68   2.252 -19.859   5.518
  499    HB2  GLU  68           2HB      GLU  68   4.721 -18.331   6.406
  500    HB3  GLU  68           3HB      GLU  68   3.493 -19.094   7.439
  501    HG2  GLU  68           2HG      GLU  68   4.171 -21.330   6.416
  502    HG3  GLU  68           3HG      GLU  68   5.505 -20.461   5.625
  503    H    LYS  69           H        LYS  69   4.039 -16.910   4.568
  504    HA   LYS  69           HA       LYS  69   1.964 -15.033   5.322
  505    HB2  LYS  69           2HB      LYS  69   4.240 -14.926   3.315
  506    HB3  LYS  69           3HB      LYS  69   3.205 -13.541   3.728
  507    HG2  LYS  69           2HG      LYS  69   3.941 -13.694   6.092
  508    HG3  LYS  69           3HG      LYS  69   4.988 -15.071   5.676
  509    HD2  LYS  69           2HD      LYS  69   6.209 -13.609   4.063
  510    HD3  LYS  69           3HD      LYS  69   5.208 -12.235   4.586
  511    HE2  LYS  69           2HE      LYS  69   7.008 -13.863   6.420
  512    HE3  LYS  69           3HE      LYS  69   7.492 -12.337   5.642
  513    HZ1  LYS  69           3HZ      LYS  69   5.716 -11.239   6.831
  514    HZ2  LYS  69           1HZ      LYS  69   5.266 -12.653   7.553
  515    HZ3  LYS  69           2HZ      LYS  69   6.735 -11.983   7.893
  516    H    GLY  70           H        GLY  70   2.356 -17.217   2.613
  517    HA2  GLY  70           2HA      GLY  70   1.148 -17.547   0.679
  518    HA3  GLY  70           3HA      GLY  70  -0.173 -16.612   1.419
  519    H    LYS  71           H        LYS  71   3.198 -15.808   0.416
  520    HA   LYS  71           HA       LYS  71   2.165 -13.638  -1.358
  521    HB2  LYS  71           2HB      LYS  71   4.272 -13.316   0.803
  522    HB3  LYS  71           3HB      LYS  71   3.859 -12.102  -0.426
  523    HG2  LYS  71           2HG      LYS  71   1.974 -13.146   1.708
  524    HG3  LYS  71           3HG      LYS  71   2.886 -11.630   1.821
  525    HD2  LYS  71           2HD      LYS  71   1.634 -10.614   0.075
  526    HD3  LYS  71           3HD      LYS  71   0.961 -12.166  -0.462
  527    HE2  LYS  71           2HE      LYS  71   0.357 -10.870   2.220
  528    HE3  LYS  71           3HE      LYS  71  -0.669 -10.707   0.776
  529    HZ1  LYS  71           3HZ      LYS  71  -0.968 -13.097   0.801
  530    HZ2  LYS  71           1HZ      LYS  71  -0.024 -13.251   2.141
  531    HZ3  LYS  71           2HZ      LYS  71  -1.458 -12.446   2.238
  532    H    ILE  72           H        ILE  72   3.682 -12.881  -2.826
  533    HA   ILE  72           HA       ILE  72   6.251 -14.327  -3.236
  534    HB   ILE  72           HB       ILE  72   4.134 -13.824  -5.390
  535   HG12  ILE  72          2HG1      ILE  72   5.095 -16.445  -4.272
  536   HG13  ILE  72          3HG1      ILE  72   3.510 -15.699  -3.987
  537   HG21  ILE  72          1HG2      ILE  72   6.884 -15.146  -5.555
  538   HG22  ILE  72          2HG2      ILE  72   5.726 -15.010  -6.894
  539   HG23  ILE  72          3HG2      ILE  72   6.462 -13.553  -6.219
  540   HD11  ILE  72          3HD1      ILE  72   2.976 -15.895  -6.397
  541   HD12  ILE  72          1HD1      ILE  72   4.554 -16.660  -6.686
  542   HD13  ILE  72          2HD1      ILE  72   3.347 -17.484  -5.688
  543    H    SER  73           H        SER  73   7.815 -12.809  -3.559
  544    HA   SER  73           HA       SER  73   6.996 -10.029  -4.272
  545    HB2  SER  73           2HB      SER  73   9.698 -11.027  -3.318
  546    HB3  SER  73           3HB      SER  73   9.162  -9.342  -3.473
  547    HG   SER  73           HG       SER  73   9.018 -10.122  -1.297
  548    H    LEU  74           H        LEU  74   8.082  -9.016  -6.052
  549    HA   LEU  74           HA       LEU  74   9.175 -10.908  -8.096
  550    HB2  LEU  74           2HB      LEU  74   6.954  -8.904  -8.414
  551    HB3  LEU  74           3HB      LEU  74   7.661  -9.850  -9.740
  552    HG   LEU  74           HG       LEU  74   6.108 -11.041  -7.391
  553   HD11  LEU  74          1HD1      LEU  74   5.256 -10.542 -10.277
  554   HD12  LEU  74          2HD1      LEU  74   4.299 -11.396  -9.050
  555   HD13  LEU  74          3HD1      LEU  74   4.656  -9.666  -8.852
  556   HD21  LEU  74          3HD2      LEU  74   7.076 -12.318  -9.962
  557   HD22  LEU  74          1HD2      LEU  74   7.726 -12.599  -8.333
  558   HD23  LEU  74          2HD2      LEU  74   6.067 -13.089  -8.718
  559    H    SER  75           H        SER  75  10.129  -9.736  -9.924
  560    HA   SER  75           HA       SER  75  10.791  -6.868  -9.458
  561    HB2  SER  75           2HB      SER  75  12.746  -8.992 -10.403
  562    HB3  SER  75           3HB      SER  75  13.076  -7.256 -10.200
  563    HG   SER  75           HG       SER  75  13.815  -8.500  -8.406
  564    H    ILE  76           H        ILE  76  10.873  -5.650 -11.209
  565    HA   ILE  76           HA       ILE  76  10.555  -6.811 -13.981
  566    HB   ILE  76           HB       ILE  76   9.604  -4.206 -12.730
  567   HG12  ILE  76          2HG1      ILE  76   8.153  -6.082 -12.325
  568   HG13  ILE  76          3HG1      ILE  76   7.414  -4.776 -13.273
  569   HG21  ILE  76          1HG2      ILE  76   9.506  -5.015 -15.673
  570   HG22  ILE  76          2HG2      ILE  76   8.733  -3.575 -14.968
  571   HG23  ILE  76          3HG2      ILE  76  10.503  -3.718 -14.986
  572   HD11  ILE  76          3HD1      ILE  76   7.696  -6.119 -15.342
  573   HD12  ILE  76          1HD1      ILE  76   8.441  -7.422 -14.388
  574   HD13  ILE  76          2HD1      ILE  76   6.734  -6.991 -14.139
  575    H    ARG  77           H        ARG  77  12.541  -4.673 -11.895
  576    HA   ARG  77           HA       ARG  77  14.208  -3.744 -13.990
  577    HB2  ARG  77           2HB      ARG  77  15.866  -3.377 -12.371
  578    HB3  ARG  77           3HB      ARG  77  14.289  -3.033 -11.629
  579    HG2  ARG  77           2HG      ARG  77  14.391  -5.116 -10.332
  580    HG3  ARG  77           3HG      ARG  77  15.905  -5.582 -11.144
  581    HD2  ARG  77           2HD      ARG  77  17.065  -3.656 -10.206
  582    HD3  ARG  77           3HD      ARG  77  15.552  -3.030  -9.511
  583    HE   ARG  77           HE       ARG  77  15.603  -5.357  -8.288
  584   HH11  ARG  77          1HH1      ARG  77  18.517  -3.451  -8.969
  585   HH12  ARG  77          2HH1      ARG  77  19.286  -3.875  -7.464
  586   HH21  ARG  77          1HH2      ARG  77  16.541  -5.760  -6.282
  587   HH22  ARG  77          2HH2      ARG  77  18.166  -5.194  -5.936
  588    H    ALA  78           H        ALA  78  13.996  -6.972 -12.720
  589    HA   ALA  78           HA       ALA  78  16.369  -7.970 -14.009
  590    HB1  ALA  78           1HB      ALA  78  13.807  -9.384 -13.153
  591    HB2  ALA  78           2HB      ALA  78  15.352 -10.170 -13.555
  592    HB3  ALA  78           3HB      ALA  78  15.238  -9.113 -12.129
  593    H    THR  79           H        THR  79  13.049  -7.423 -15.171
  594    HA   THR  79           HA       THR  79  13.628  -8.952 -17.662
  595    HB   THR  79           HB       THR  79  11.152  -8.886 -17.940
  596    HG1  THR  79           1HG      THR  79   9.928  -8.186 -16.120
  597   HG21  THR  79          1HG2      THR  79  12.064  -9.892 -15.200
  598   HG22  THR  79          2HG2      THR  79  10.596 -10.406 -16.056
  599   HG23  THR  79          3HG2      THR  79  12.192 -10.791 -16.729
  600    H    GLN  80           H        GLN  80  13.270  -5.744 -16.539
  601    HA   GLN  80           HA       GLN  80  13.729  -4.699 -19.308
  602    HB2  GLN  80           2HB      GLN  80  12.610  -3.307 -16.846
  603    HB3  GLN  80           3HB      GLN  80  12.973  -2.519 -18.398
  604    HG2  GLN  80           2HG      GLN  80  11.334  -4.202 -19.459
  605    HG3  GLN  80           3HG      GLN  80  10.832  -4.591 -17.799
  606   HE21  GLN  80          2HE2      GLN  80  10.179  -2.551 -16.433
  607   HE22  GLN  80          1HE2      GLN  80   9.238  -1.344 -17.295
  608    H    ALA  81           H        ALA  81  15.733  -6.052 -17.931
  609    HA   ALA  81           HA       ALA  81  17.528  -4.371 -16.480
  610    HB1  ALA  81           1HB      ALA  81  18.116  -6.756 -18.288
  611    HB2  ALA  81           2HB      ALA  81  19.229  -6.054 -17.090
  612    HB3  ALA  81           3HB      ALA  81  17.724  -6.835 -16.554
  613    H    ALA  82           H        ALA  82  17.392  -5.134 -20.008
  614    HA   ALA  82           HA       ALA  82  19.212  -2.983 -20.773
  615    HB1  ALA  82           1HB      ALA  82  17.044  -4.468 -22.313
  616    HB2  ALA  82           2HB      ALA  82  18.254  -3.374 -23.020
  617    HB3  ALA  82           3HB      ALA  82  18.771  -4.899 -22.263
  618    HA   PRO  83           HA       PRO  83  16.658   0.478 -19.881
  619    HB2  PRO  83           2HB      PRO  83  17.557   1.559 -22.539
  620    HB3  PRO  83           3HB      PRO  83  17.467   2.363 -20.950
  621    HG2  PRO  83           2HG      PRO  83  19.866   1.417 -21.813
  622    HG3  PRO  83           3HG      PRO  83  19.388   1.236 -20.104
  623    HD2  PRO  83           2HD      PRO  83  19.289  -0.846 -22.329
  624    HD3  PRO  83           3HD      PRO  83  19.717  -1.059 -20.611
  625    H    GLU  84           H        GLU  84  14.580  -0.005 -19.928
  626    HA   GLU  84           HA       GLU  84  12.948   0.502 -22.331
  627    HB2  GLU  84           2HB      GLU  84  12.871  -2.063 -20.730
  628    HB3  GLU  84           3HB      GLU  84  11.540  -1.505 -21.763
  629    HG2  GLU  84           2HG      GLU  84  14.342  -2.288 -22.694
  630    HG3  GLU  84           3HG      GLU  84  12.839  -3.218 -22.843
  631    H    LYS  85           H        LYS  85  10.732   0.935 -21.648
  632    HA   LYS  85           HA       LYS  85  10.193   1.377 -18.755
  633    HB2  LYS  85           2HB      LYS  85   9.959   3.519 -20.899
  634    HB3  LYS  85           3HB      LYS  85   9.403   3.664 -19.217
  635    HG2  LYS  85           2HG      LYS  85  11.806   3.289 -18.497
  636    HG3  LYS  85           3HG      LYS  85  12.267   3.433 -20.207
  637    HD2  LYS  85           2HD      LYS  85  10.841   5.577 -18.581
  638    HD3  LYS  85           3HD      LYS  85  12.587   5.548 -18.927
  639    HE2  LYS  85           2HE      LYS  85  12.085   5.640 -21.364
  640    HE3  LYS  85           3HE      LYS  85  10.349   5.730 -20.988
  641    HZ1  LYS  85           3HZ      LYS  85  10.769   7.801 -19.843
  642    HZ2  LYS  85           1HZ      LYS  85  12.381   7.718 -20.194
  643    HZ3  LYS  85           2HZ      LYS  85  11.281   7.902 -21.408
  644    H    LYS  86           H        LYS  86   7.779   2.150 -18.568
  645    HA   LYS  86           HA       LYS  86   5.965   0.514 -19.983
  646    HB2  LYS  86           2HB      LYS  86   4.237   1.774 -19.016
  647    HB3  LYS  86           3HB      LYS  86   5.566   1.869 -17.843
  648    HG2  LYS  86           2HG      LYS  86   6.173   4.102 -18.720
  649    HG3  LYS  86           3HG      LYS  86   4.832   4.009 -19.881
  650    HD2  LYS  86           2HD      LYS  86   4.646   4.139 -16.870
  651    HD3  LYS  86           3HD      LYS  86   4.253   5.435 -18.017
  652    HE2  LYS  86           2HE      LYS  86   2.761   2.835 -17.575
  653    HE3  LYS  86           3HE      LYS  86   2.222   4.467 -17.125
  654    HZ1  LYS  86           3HZ      LYS  86   2.073   4.988 -19.475
  655    HZ2  LYS  86           1HZ      LYS  86   2.567   3.474 -19.892
  656    HZ3  LYS  86           2HZ      LYS  86   1.134   3.683 -19.119
  657    H    GLU  87           H        GLU  87   4.248   1.194 -21.418
  658    HA   GLU  87           HA       GLU  87   4.896   3.465 -23.244
  659    HB2  GLU  87           2HB      GLU  87   3.765   0.741 -23.975
  660    HB3  GLU  87           3HB      GLU  87   3.881   2.136 -25.072
  661    HG2  GLU  87           2HG      GLU  87   6.343   2.135 -24.775
  662    HG3  GLU  87           3HG      GLU  87   6.227   0.667 -23.779
  663    H    SER  88           H        SER  88   2.802   4.193 -24.341
  664    HA   SER  88           HA       SER  88   0.363   3.785 -22.670
  665    HB2  SER  88           2HB      SER  88   1.508   6.503 -23.393
  666    HB3  SER  88           3HB      SER  88   0.039   6.172 -22.447
  667    HG   SER  88           HG       SER  88   1.864   6.696 -21.114
  668    H    LYS  89           H        LYS  89   1.748   5.225 -25.678
  669    HA   LYS  89           HA       LYS  89  -0.823   5.447 -26.944
  670    HB2  LYS  89           2HB      LYS  89   0.361   5.990 -28.930
  671    HB3  LYS  89           3HB      LYS  89   1.168   6.780 -27.558
  672    HG2  LYS  89           2HG      LYS  89   2.900   4.984 -27.586
  673    HG3  LYS  89           3HG      LYS  89   2.113   4.276 -29.014
  674    HD2  LYS  89           2HD      LYS  89   3.329   7.050 -28.831
  675    HD3  LYS  89           3HD      LYS  89   4.101   5.635 -29.579
  676    HE2  LYS  89           2HE      LYS  89   1.491   6.884 -30.527
  677    HE3  LYS  89           3HE      LYS  89   3.087   7.261 -31.214
  678    HZ1  LYS  89           3HZ      LYS  89   3.288   4.956 -31.859
  679    HZ2  LYS  89           1HZ      LYS  89   1.806   4.603 -31.219
  680    HZ3  LYS  89           2HZ      LYS  89   1.927   5.614 -32.517
  681    HA   PRO  90           HA       PRO  90  -0.100   1.258 -29.111
  682    HB2  PRO  90           2HB      PRO  90   0.313  -0.343 -26.590
  683    HB3  PRO  90           3HB      PRO  90   0.866  -0.685 -28.250
  684    HG2  PRO  90           2HG      PRO  90   2.613   0.326 -26.421
  685    HG3  PRO  90           3HG      PRO  90   2.638   0.932 -28.099
  686    HD2  PRO  90           2HD      PRO  90   1.294   2.190 -25.656
  687    HD3  PRO  90           3HD      PRO  90   2.248   2.986 -26.932
  688    H    ARG  91           H        ARG  91  -1.921  -0.242 -29.300
  689    HA   ARG  91           HA       ARG  91  -4.310   0.357 -27.869
  690    HB2  ARG  91           2HB      ARG  91  -4.085  -0.846 -30.120
  691    HB3  ARG  91           3HB      ARG  91  -3.647  -2.302 -29.195
  692    HG2  ARG  91           2HG      ARG  91  -5.802  -1.980 -27.888
  693    HG3  ARG  91           3HG      ARG  91  -6.239  -0.719 -29.060
  694    HD2  ARG  91           2HD      ARG  91  -6.132  -2.402 -30.896
  695    HD3  ARG  91           3HD      ARG  91  -5.707  -3.659 -29.711
  696    HE   ARG  91           HE       ARG  91  -8.197  -2.063 -29.462
  697   HH11  ARG  91          1HH1      ARG  91  -6.773  -5.271 -30.018
  698   HH12  ARG  91          2HH1      ARG  91  -8.253  -6.120 -29.618
  699   HH21  ARG  91          1HH2      ARG  91 -10.042  -3.168 -28.859
  700   HH22  ARG  91          2HH2      ARG  91 -10.115  -4.927 -28.958
  701    H    LYS  92           H        LYS  92  -4.658   0.047 -25.730
  702    HA   LYS  92           HA       LYS  92  -3.024  -1.726 -24.157
  703    HB2  LYS  92           2HB      LYS  92  -4.124   0.409 -23.364
  704    HB3  LYS  92           3HB      LYS  92  -5.673  -0.457 -23.373
  705    HG2  LYS  92           2HG      LYS  92  -4.850  -2.059 -21.728
  706    HG3  LYS  92           3HG      LYS  92  -3.220  -1.349 -21.801
  707    HD2  LYS  92           2HD      LYS  92  -4.170   0.814 -20.947
  708    HD3  LYS  92           3HD      LYS  92  -5.754   0.018 -20.778
  709    HE2  LYS  92           2HE      LYS  92  -4.783  -1.628 -19.234
  710    HE3  LYS  92           3HE      LYS  92  -3.177  -0.893 -19.436
  711    HZ1  LYS  92           3HZ      LYS  92  -4.042   1.116 -18.447
  712    HZ2  LYS  92           1HZ      LYS  92  -5.534   0.433 -18.257
  713    HZ3  LYS  92           2HZ      LYS  92  -4.237  -0.163 -17.418
  714    HA   PRO  93           HA       PRO  93  -6.399  -4.970 -24.092
  715    HB2  PRO  93           2HB      PRO  93  -8.442  -4.899 -25.951
  716    HB3  PRO  93           3HB      PRO  93  -8.600  -4.317 -24.273
  717    HG2  PRO  93           2HG      PRO  93  -8.035  -2.757 -26.851
  718    HG3  PRO  93           3HG      PRO  93  -9.124  -2.309 -25.514
  719    HD2  PRO  93           2HD      PRO  93  -6.578  -1.269 -25.714
  720    HD3  PRO  93           3HD      PRO  93  -7.317  -1.608 -24.130
  721    H    LYS  94           H        LYS  94  -6.303  -6.892 -25.364
  722    HA   LYS  94           HA       LYS  94  -5.204  -6.671 -28.143
  723    HB2  LYS  94           2HB      LYS  94  -4.214  -8.486 -25.913
  724    HB3  LYS  94           3HB      LYS  94  -3.675  -8.537 -27.606
  725    HG2  LYS  94           2HG      LYS  94  -2.952  -6.113 -27.327
  726    HG3  LYS  94           3HG      LYS  94  -3.255  -6.306 -25.586
  727    HD2  LYS  94           2HD      LYS  94  -1.305  -7.969 -27.226
  728    HD3  LYS  94           3HD      LYS  94  -0.855  -6.580 -26.209
  729    HE2  LYS  94           2HE      LYS  94  -1.717  -7.772 -24.211
  730    HE3  LYS  94           3HE      LYS  94  -2.139  -9.167 -25.233
  731    HZ1  LYS  94           3HZ      LYS  94   0.190  -9.406 -25.753
  732    HZ2  LYS  94           1HZ      LYS  94   0.583  -8.116 -24.806
  733    HZ3  LYS  94           2HZ      LYS  94  -0.028  -9.487 -24.116
  734    H    ALA  95           H        ALA  95  -7.773  -7.772 -26.388
  735    HA   ALA  95           HA       ALA  95  -8.268 -10.326 -27.623
  736    HB1  ALA  95           1HB      ALA  95 -10.191  -8.208 -26.562
  737    HB2  ALA  95           2HB      ALA  95 -10.602  -9.900 -26.928
  738    HB3  ALA  95           3HB      ALA  95  -9.467  -9.528 -25.611
  739    H    ALA  96           H        ALA  96  -9.791 -10.809 -29.322
  740    HA   ALA  96           HA       ALA  96  -9.760  -9.083 -31.622
  741    HB1  ALA  96           1HB      ALA  96 -11.549 -11.460 -30.954
  742    HB2  ALA  96           2HB      ALA  96 -11.333 -10.735 -32.564
  743    HB3  ALA  96           3HB      ALA  96  -9.966 -11.544 -31.764
  744    H    GLN  97           H        GLN  97 -11.960  -9.358 -28.888
  745    HA   GLN  97           HA       GLN  97 -14.159  -7.807 -29.794
  746    HB2  GLN  97           2HB      GLN  97 -13.927  -9.101 -27.681
  747    HB3  GLN  97           3HB      GLN  97 -12.803  -7.862 -27.085
  748    HG2  GLN  97           2HG      GLN  97 -15.643  -7.191 -27.909
  749    HG3  GLN  97           3HG      GLN  97 -15.263  -7.789 -26.280
  750   HE21  GLN  97          2HE2      GLN  97 -16.354  -5.123 -27.239
  751   HE22  GLN  97          1HE2      GLN  97 -15.269  -3.931 -26.560
  752    H    VAL  98           H        VAL  98 -14.517  -5.626 -29.973
  753    HA   VAL  98           HA       VAL  98 -12.315  -3.672 -29.431
  754    HB   VAL  98           HB       VAL  98 -12.930  -2.611 -31.653
  755   HG11  VAL  98          1HG1      VAL  98 -11.623  -5.367 -31.813
  756   HG12  VAL  98          2HG1      VAL  98 -11.477  -4.078 -33.029
  757   HG13  VAL  98          3HG1      VAL  98 -10.798  -3.845 -31.404
  758   HG21  VAL  98          3HG2      VAL  98 -14.172  -5.288 -32.297
  759   HG22  VAL  98          1HG2      VAL  98 -15.006  -3.722 -32.163
  760   HG23  VAL  98          2HG2      VAL  98 -13.816  -3.987 -33.455
  761    H    SER  99           H        SER  99 -12.903  -1.693 -28.939
  762    HA   SER  99           HA       SER  99 -15.818  -1.035 -28.685
  763    HB2  SER  99           2HB      SER  99 -13.657  -0.459 -26.629
  764    HB3  SER  99           3HB      SER  99 -15.392  -0.097 -26.496
  765    HG   SER  99           HG       SER  99 -14.792  -2.018 -25.360
  766    H    GLU 100           H        GLU 100 -15.791   1.516 -27.952
  767    HA   GLU 100           HA       GLU 100 -14.888   2.996 -30.180
  768    HB2  GLU 100           2HB      GLU 100 -15.584   4.910 -29.084
  769    HB3  GLU 100           3HB      GLU 100 -16.665   3.620 -28.517
  770    HG2  GLU 100           2HG      GLU 100 -14.326   4.772 -26.956
  771    HG3  GLU 100           3HG      GLU 100 -16.017   5.252 -26.721
  772    H    GLU 101           H        GLU 101 -13.279   2.610 -27.073
  773    HA   GLU 101           HA       GLU 101 -11.067   2.869 -26.428
  774    HB2  GLU 101           2HB      GLU 101 -10.680   1.905 -29.289
  775    HB3  GLU 101           3HB      GLU 101  -9.386   1.997 -28.072
  776    HG2  GLU 101           2HG      GLU 101 -10.465   0.417 -26.666
  777    HG3  GLU 101           3HG      GLU 101 -11.940   0.377 -27.653
  778    H    ALA 102           H        ALA 102 -12.409   5.185 -27.215
  779    HA   ALA 102           HA       ALA 102 -10.078   6.978 -27.679
  780    HB1  ALA 102           1HB      ALA 102 -12.740   7.128 -29.162
  781    HB2  ALA 102           2HB      ALA 102 -11.405   8.298 -29.293
  782    HB3  ALA 102           3HB      ALA 102 -11.184   6.629 -29.867
  783    H    SER 103           H        SER 103 -12.152   6.117 -25.472
  784    HA   SER 103           HA       SER 103 -13.648   8.385 -24.653
  785    HB2  SER 103           2HB      SER 103 -12.323   6.345 -22.839
  786    HB3  SER 103           3HB      SER 103 -13.839   7.237 -22.570
  787    HG   SER 103           HG       SER 103 -14.202   5.059 -23.290
  788    H    THR 104           H        THR 104 -13.291   9.903 -22.990
  789    HA   THR 104           HA       THR 104 -10.754  11.172 -22.752
  790    HB   THR 104           HB       THR 104 -11.981  12.139 -20.635
  791    HG1  THR 104           1HG      THR 104 -14.263  11.835 -20.807
  792   HG21  THR 104          1HG2      THR 104 -13.164  12.446 -23.433
  793   HG22  THR 104          2HG2      THR 104 -13.368  13.594 -22.088
  794   HG23  THR 104          3HG2      THR 104 -11.759  13.333 -22.798
  795    HA   PRO 105           HA       PRO 105  -8.483   9.005 -19.587
  796    HB2  PRO 105           2HB      PRO 105  -8.457  11.640 -18.102
  797    HB3  PRO 105           3HB      PRO 105  -7.111  10.513 -18.408
  798    HG2  PRO 105           2HG      PRO 105  -7.400  12.790 -19.897
  799    HG3  PRO 105           3HG      PRO 105  -6.928  11.270 -20.703
  800    HD2  PRO 105           2HD      PRO 105  -9.698  12.548 -20.546
  801    HD3  PRO 105           3HD      PRO 105  -8.919  11.738 -21.930
  802    H    GLN 106           H        GLN 106  -8.907   7.996 -17.638
  803    HA   GLN 106           HA       GLN 106 -11.022   8.978 -15.805
  804    HB2  GLN 106           2HB      GLN 106 -10.974   6.262 -17.145
  805    HB3  GLN 106           3HB      GLN 106 -11.918   6.633 -15.687
  806    HG2  GLN 106           2HG      GLN 106 -12.289   8.059 -18.352
  807    HG3  GLN 106           3HG      GLN 106 -13.244   6.653 -17.845
  808   HE21  GLN 106          2HE2      GLN 106 -12.685  10.111 -17.366
  809   HE22  GLN 106          1HE2      GLN 106 -14.088  10.376 -16.333
  810    H    GLY 107           H        GLY 107 -10.821   7.907 -13.705
  811    HA2  GLY 107           2HA      GLY 107  -8.891   6.006 -12.939
  812    HA3  GLY 107           3HA      GLY 107  -8.134   7.610 -12.804
  813    H    PHE 108           H        PHE 108  -8.142   6.804 -10.484
  814    HA   PHE 108           HA       PHE 108 -10.526   6.930  -8.875
  815    HB2  PHE 108           2HB      PHE 108  -8.936   7.055  -6.998
  816    HB3  PHE 108           3HB      PHE 108  -8.437   5.811  -8.160
  817    HD1  PHE 108           HD1      PHE 108  -7.700   9.232  -6.880
  818    HD2  PHE 108           HD2      PHE 108  -6.323   5.898  -9.250
  819    HE1  PHE 108           HE1      PHE 108  -5.442  10.269  -7.028
  820    HE2  PHE 108           HE2      PHE 108  -4.060   6.932  -9.382
  821    HZ   PHE 108           HZ       PHE 108  -3.619   9.120  -8.280
  822    H    ASN 109           H        ASN 109  -9.183   9.413 -10.584
  823    HA   ASN 109           HA       ASN 109 -10.410  11.520  -8.873
  824    HB2  ASN 109           2HB      ASN 109  -8.057  11.578  -8.323
  825    HB3  ASN 109           3HB      ASN 109  -7.587  11.529 -10.036
  826   HD21  ASN 109          2HD2      ASN 109  -6.921  13.492 -10.785
  827   HD22  ASN 109          1HD2      ASN 109  -7.573  15.034 -10.265
  828    H    THR 110           H        THR 110 -11.042  13.345 -10.125
  829    HA   THR 110           HA       THR 110 -12.333  12.874 -12.569
  830    HB   THR 110           HB       THR 110 -11.271  15.566 -11.670
  831    HG1  THR 110           1HG      THR 110 -13.125  15.615 -10.291
  832   HG21  THR 110          1HG2      THR 110 -13.912  14.706 -12.946
  833   HG22  THR 110          2HG2      THR 110 -13.464  16.372 -12.508
  834   HG23  THR 110          3HG2      THR 110 -12.571  15.521 -13.786
  835    H    LEU 111           H        LEU 111 -11.701  12.492 -14.484
  836    HA   LEU 111           HA       LEU 111 -10.329  12.087 -16.301
  837    HB2  LEU 111           2HB      LEU 111  -9.657  14.995 -15.866
  838    HB3  LEU 111           3HB      LEU 111  -9.392  14.081 -17.368
  839    HG   LEU 111           HG       LEU 111 -12.118  14.766 -16.162
  840   HD11  LEU 111          1HD1      LEU 111 -10.671  15.807 -18.643
  841   HD12  LEU 111          2HD1      LEU 111 -12.323  16.243 -18.147
  842   HD13  LEU 111          3HD1      LEU 111 -10.940  16.718 -17.138
  843   HD21  LEU 111          3HD2      LEU 111 -11.453  13.397 -18.787
  844   HD22  LEU 111          1HD2      LEU 111 -12.193  12.629 -17.365
  845   HD23  LEU 111          2HD2      LEU 111 -13.070  13.901 -18.241
  846    H    LYS 112           H        LYS 112  -9.234  11.349 -13.891
  847    HA   LYS 112           HA       LYS 112  -7.327  10.550 -12.884
  848    HB2  LYS 112           2HB      LYS 112  -7.150   9.421 -15.132
  849    HB3  LYS 112           3HB      LYS 112  -6.088  10.748 -15.653
  850    HG2  LYS 112           2HG      LYS 112  -4.479  10.178 -13.863
  851    HG3  LYS 112           3HG      LYS 112  -5.550   8.869 -13.310
  852    HD2  LYS 112           2HD      LYS 112  -5.310   7.719 -15.457
  853    HD3  LYS 112           3HD      LYS 112  -4.328   9.060 -16.091
  854    HE2  LYS 112           2HE      LYS 112  -2.822   7.289 -15.497
  855    HE3  LYS 112           3HE      LYS 112  -2.630   8.595 -14.304
  856    HZ1  LYS 112           3HZ      LYS 112  -3.999   7.324 -12.794
  857    HZ2  LYS 112           1HZ      LYS 112  -4.180   6.115 -13.899
  858    HZ3  LYS 112           2HZ      LYS 112  -2.690   6.437 -13.260
  859    H    ASP 113           H        ASP 113  -5.767  12.800 -15.140
  860    HA   ASP 113           HA       ASP 113  -4.779  14.429 -12.850
  861    HB2  ASP 113           2HB      ASP 113  -3.195  12.461 -13.231
  862    HB3  ASP 113           3HB      ASP 113  -3.001  13.095 -14.880
  863    H    LYS 114           H        LYS 114  -6.174  14.380 -15.882
  864    HA   LYS 114           HA       LYS 114  -4.847  16.483 -17.259
  865    HB2  LYS 114           2HB      LYS 114  -6.520  15.088 -18.289
  866    HB3  LYS 114           3HB      LYS 114  -7.748  15.647 -17.134
  867    HG2  LYS 114           2HG      LYS 114  -8.089  16.657 -19.332
  868    HG3  LYS 114           3HG      LYS 114  -7.704  17.879 -18.102
  869    HD2  LYS 114           2HD      LYS 114  -5.330  17.915 -18.956
  870    HD3  LYS 114           3HD      LYS 114  -5.818  16.801 -20.253
  871    HE2  LYS 114           2HE      LYS 114  -7.163  18.393 -21.303
  872    HE3  LYS 114           3HE      LYS 114  -7.386  19.339 -19.812
  873    HZ1  LYS 114           3HZ      LYS 114  -5.107  20.064 -19.991
  874    HZ2  LYS 114           1HZ      LYS 114  -4.893  19.185 -21.382
  875    HZ3  LYS 114           2HZ      LYS 114  -5.941  20.460 -21.360
  876    H    LEU 115           H        LEU 115  -4.880  18.595 -17.160
  877    HA   LEU 115           HA       LEU 115  -6.666  20.134 -15.357
  878    HB2  LEU 115           2HB      LEU 115  -4.654  19.501 -14.101
  879    HB3  LEU 115           3HB      LEU 115  -3.632  20.245 -15.351
  880    HG   LEU 115           HG       LEU 115  -4.524  22.466 -14.799
  881   HD11  LEU 115          1HD1      LEU 115  -6.099  21.062 -12.588
  882   HD12  LEU 115          2HD1      LEU 115  -5.967  22.823 -12.812
  883   HD13  LEU 115          3HD1      LEU 115  -6.802  21.836 -14.027
  884   HD21  LEU 115          3HD2      LEU 115  -3.572  20.930 -12.352
  885   HD22  LEU 115          1HD2      LEU 115  -2.544  21.674 -13.598
  886   HD23  LEU 115          2HD2      LEU 115  -3.536  22.700 -12.538
  887    H    GLU 116           H        GLU 116  -6.575  22.431 -15.960
  888    HA   GLU 116           HA       GLU 116  -5.236  23.198 -18.485
  889    HB2  GLU 116           2HB      GLU 116  -7.265  24.107 -19.420
  890    HB3  GLU 116           3HB      GLU 116  -7.448  22.361 -19.147
  891    HG2  GLU 116           2HG      GLU 116  -8.733  22.825 -17.082
  892    HG3  GLU 116           3HG      GLU 116  -8.594  24.573 -17.375
  893    H    GLU 117           H        GLU 117  -5.565  25.624 -18.788
  894    HA   GLU 117           HA       GLU 117  -5.563  27.114 -16.211
  895    HB2  GLU 117           2HB      GLU 117  -3.306  27.057 -18.244
  896    HB3  GLU 117           3HB      GLU 117  -3.434  28.194 -16.883
  897    HG2  GLU 117           2HG      GLU 117  -3.365  26.229 -15.302
  898    HG3  GLU 117           3HG      GLU 117  -3.119  25.177 -16.714
  899    H    TRP 118           H        TRP 118  -5.251  29.519 -16.751
  900    HA   TRP 118           HA       TRP 118  -6.914  30.274 -19.141
  901    HB2  TRP 118           2HB      TRP 118  -8.056  30.021 -16.727
  902    HB3  TRP 118           3HB      TRP 118  -7.183  31.542 -16.456
  903    HD1  TRP 118           HD1      TRP 118  -9.153  30.481 -19.485
  904    HE1  TRP 118           HE1      TRP 118 -11.171  32.148 -19.867
  905    HE3  TRP 118           HE3      TRP 118  -8.462  33.502 -15.412
  906    HZ2  TRP 118           HZ2      TRP 118 -12.322  34.342 -18.453
  907    HZ3  TRP 118           HZ3      TRP 118  -9.946  35.337 -14.944
  908    HH2  TRP 118           HH2      TRP 118 -11.921  35.813 -16.397
  909    H    ILE 119           H        ILE 119  -3.996  30.393 -18.578
  910    HA   ILE 119           HA       ILE 119  -3.131  33.124 -18.205
  911    HB   ILE 119           HB       ILE 119  -1.010  32.333 -19.213
  912   HG12  ILE 119          2HG1      ILE 119  -2.416  29.765 -19.882
  913   HG13  ILE 119          3HG1      ILE 119  -1.978  31.046 -21.035
  914   HG21  ILE 119          1HG2      ILE 119  -2.264  30.267 -17.334
  915   HG22  ILE 119          2HG2      ILE 119  -0.525  30.492 -17.605
  916   HG23  ILE 119          3HG2      ILE 119  -1.470  31.778 -16.836
  917   HD11  ILE 119          3HD1      ILE 119   0.422  30.725 -20.488
  918   HD12  ILE 119          1HD1      ILE 119  -0.011  29.438 -19.340
  919   HD13  ILE 119          2HD1      ILE 119  -0.311  29.213 -21.073
  920    H    GLU 120           H        GLU 120  -4.814  31.927 -20.937
  921    HA   GLU 120           HA       GLU 120  -3.995  33.864 -22.817
  922    HB2  GLU 120           2HB      GLU 120  -6.170  33.607 -23.790
  923    HB3  GLU 120           3HB      GLU 120  -5.571  32.025 -23.247
  924    HG2  GLU 120           2HG      GLU 120  -7.001  32.232 -21.199
  925    HG3  GLU 120           3HG      GLU 120  -7.662  33.749 -21.848
  926    H    MET 121           H        MET 121  -5.914  34.326 -19.896
  927    HA   MET 121           HA       MET 121  -6.391  37.178 -20.477
  928    HB2  MET 121           2HB      MET 121  -6.841  35.576 -17.941
  929    HB3  MET 121           3HB      MET 121  -7.492  37.186 -18.319
  930    HG2  MET 121           2HG      MET 121  -8.173  34.550 -19.639
  931    HG3  MET 121           3HG      MET 121  -9.222  35.541 -18.606
  932    HE1  MET 121           3HE      MET 121 -10.038  34.273 -21.470
  933    HE2  MET 121           1HE      MET 121 -11.156  35.201 -20.442
  934    HE3  MET 121           2HE      MET 121 -10.971  35.623 -22.160
  935    H    SER 122           H        SER 122  -3.652  35.868 -20.054
  936    HA   SER 122           HA       SER 122  -2.439  38.164 -18.592
  937    HB2  SER 122           2HB      SER 122  -1.550  35.277 -18.289
  938    HB3  SER 122           3HB      SER 122  -0.907  36.703 -17.445
  939    HG   SER 122           HG       SER 122  -2.379  35.486 -16.139
  940    H    ASN 123           H        ASN 123  -2.939  37.465 -21.417
  941    HA   ASN 123           HA       ASN 123  -0.192  37.454 -22.570
  942    HB2  ASN 123           2HB      ASN 123  -0.983  35.092 -22.359
  943    HB3  ASN 123           3HB      ASN 123  -2.379  35.494 -23.383
  944   HD21  ASN 123          2HD2      ASN 123  -1.603  33.783 -24.854
  945   HD22  ASN 123          1HD2      ASN 123  -0.293  34.139 -25.960
  946    H    ARG 124           H        ARG 124  -0.580  37.735 -25.115
  947    HA   ARG 124           HA       ARG 124  -1.594  40.332 -25.458
  948    HB2  ARG 124           2HB      ARG 124  -1.175  38.147 -27.525
  949    HB3  ARG 124           3HB      ARG 124  -1.425  39.867 -27.899
  950    HG2  ARG 124           2HG      ARG 124   0.622  40.419 -26.577
  951    HG3  ARG 124           3HG      ARG 124   0.892  38.682 -26.310
  952    HD2  ARG 124           2HD      ARG 124   0.766  40.002 -29.054
  953    HD3  ARG 124           3HD      ARG 124   2.275  39.660 -28.176
  954    HE   ARG 124           HE       ARG 124   0.957  37.238 -28.252
  955   HH11  ARG 124          1HH1      ARG 124   2.071  39.529 -30.713
  956   HH12  ARG 124          2HH1      ARG 124   2.320  38.298 -31.924
  957   HH21  ARG 124          1HH2      ARG 124   1.287  35.645 -29.858
  958   HH22  ARG 124          2HH2      ARG 124   1.874  36.092 -31.436
  959    H    LYS 125           H        LYS 125  -3.567  37.403 -25.724
  960    HA   LYS 125           HA       LYS 125  -5.788  38.568 -27.054
  961    HB2  LYS 125           2HB      LYS 125  -5.514  36.150 -26.516
  962    HB3  LYS 125           3HB      LYS 125  -5.784  36.527 -24.799
  963    HG2  LYS 125           2HG      LYS 125  -8.047  37.355 -25.313
  964    HG3  LYS 125           3HG      LYS 125  -7.778  37.060 -27.047
  965    HD2  LYS 125           2HD      LYS 125  -7.533  34.638 -26.605
  966    HD3  LYS 125           3HD      LYS 125  -7.773  34.926 -24.864
  967    HE2  LYS 125           2HE      LYS 125 -10.023  35.814 -25.301
  968    HE3  LYS 125           3HE      LYS 125  -9.787  35.586 -27.050
  969    HZ1  LYS 125           3HZ      LYS 125  -9.605  33.223 -26.645
  970    HZ2  LYS 125           1HZ      LYS 125  -9.819  33.429 -25.022
  971    HZ3  LYS 125           2HZ      LYS 125 -11.045  33.787 -26.077
  972    H    ASP 126           H        ASP 126  -5.016  38.611 -23.544
  973    HA   ASP 126           HA       ASP 126  -6.268  41.236 -23.294
  974    HB2  ASP 126           2HB      ASP 126  -8.266  39.886 -23.015
  975    HB3  ASP 126           3HB      ASP 126  -7.453  38.833 -21.836
  976    H    LEU 127           H        LEU 127  -4.887  42.286 -22.041
  977    HA   LEU 127           HA       LEU 127  -3.778  41.217 -19.558
  978    HB2  LEU 127           2HB      LEU 127  -1.527  41.383 -20.076
  979    HB3  LEU 127           3HB      LEU 127  -2.242  40.349 -21.326
  980    HG   LEU 127           HG       LEU 127  -1.338  43.256 -21.687
  981   HD11  LEU 127          1HD1      LEU 127  -0.274  40.617 -22.791
  982   HD12  LEU 127          2HD1      LEU 127   0.352  42.234 -23.189
  983   HD13  LEU 127          3HD1      LEU 127   0.503  41.605 -21.532
  984   HD21  LEU 127          3HD2      LEU 127  -2.480  41.414 -23.791
  985   HD22  LEU 127          1HD2      LEU 127  -3.264  42.860 -23.128
  986   HD23  LEU 127          2HD2      LEU 127  -1.766  43.021 -24.059
  987    H    ILE 128           H        ILE 128  -2.710  42.887 -18.304
  988    HA   ILE 128           HA       ILE 128  -3.841  45.552 -18.607
  989    HB   ILE 128           HB       ILE 128  -2.345  46.123 -16.710
  990   HG12  ILE 128          2HG1      ILE 128  -1.140  43.392 -16.977
  991   HG13  ILE 128          3HG1      ILE 128  -0.372  44.932 -17.423
  992   HG21  ILE 128          1HG2      ILE 128  -3.691  43.393 -16.391
  993   HG22  ILE 128          2HG2      ILE 128  -3.256  44.489 -15.064
  994   HG23  ILE 128          3HG2      ILE 128  -4.493  44.972 -16.236
  995   HD11  ILE 128          3HD1      ILE 128  -0.502  45.687 -15.063
  996   HD12  ILE 128          1HD1      ILE 128  -1.262  44.145 -14.611
  997   HD13  ILE 128          2HD1      ILE 128   0.409  44.165 -15.201
  998    H    LYS 129           H        LYS 129  -2.983  47.475 -19.022
  999    HA   LYS 129           HA       LYS 129  -0.426  47.610 -20.536
 1000    HB2  LYS 129           2HB      LYS 129  -3.115  48.616 -21.504
 1001    HB3  LYS 129           3HB      LYS 129  -1.551  49.024 -22.237
 1002    HG2  LYS 129           2HG      LYS 129  -2.735  46.234 -22.069
 1003    HG3  LYS 129           3HG      LYS 129  -2.843  47.295 -23.487
 1004    HD2  LYS 129           2HD      LYS 129  -0.244  46.234 -22.300
 1005    HD3  LYS 129           3HD      LYS 129  -1.085  45.522 -23.694
 1006    HE2  LYS 129           2HE      LYS 129  -0.855  47.694 -24.903
 1007    HE3  LYS 129           3HE      LYS 129   0.064  48.338 -23.523
 1008    HZ1  LYS 129           3HZ      LYS 129   1.716  46.635 -23.914
 1009    HZ2  LYS 129           1HZ      LYS 129   0.865  46.041 -25.194
 1010    HZ3  LYS 129           2HZ      LYS 129   1.514  47.554 -25.269
 1011    H    LYS 130           H        LYS 130   0.365  49.860 -20.623
 1012    HA   LYS 130           HA       LYS 130  -0.131  51.509 -18.375
 1013    HB2  LYS 130           2HB      LYS 130   0.966  52.195 -21.123
 1014    HB3  LYS 130           3HB      LYS 130   0.965  53.306 -19.736
 1015    HG2  LYS 130           2HG      LYS 130   2.351  51.669 -18.452
 1016    HG3  LYS 130           3HG      LYS 130   2.397  50.615 -19.885
 1017    HD2  LYS 130           2HD      LYS 130   3.540  52.351 -21.172
 1018    HD3  LYS 130           3HD      LYS 130   3.412  53.482 -19.807
 1019    HE2  LYS 130           2HE      LYS 130   5.656  52.637 -19.827
 1020    HE3  LYS 130           3HE      LYS 130   4.808  51.911 -18.442
 1021    HZ1  LYS 130           3HZ      LYS 130   4.529  49.912 -19.745
 1022    HZ2  LYS 130           1HZ      LYS 130   5.317  50.586 -21.030
 1023    HZ3  LYS 130           2HZ      LYS 130   6.132  50.292 -19.627
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1   8.303 -24.083  -2.410
    2    H2   MET   1           H2       MET   1   9.859 -23.593  -2.639
    3    H3   MET   1           H3       MET   1   9.237 -23.877  -1.099
    4    HA   MET   1           HA       MET   1  10.547 -25.635  -2.785
    5    HB2  MET   1           2HB      MET   1  10.788 -25.580  -0.341
    6    HB3  MET   1           3HB      MET   1   9.106 -26.098  -0.137
    7    HG2  MET   1           2HG      MET   1  10.705 -27.960   0.134
    8    HG3  MET   1           3HG      MET   1   9.583 -28.235  -1.196
    9    HE1  MET   1           3HE      MET   1  12.153 -30.011  -0.779
   10    HE2  MET   1           1HE      MET   1  11.021 -30.209  -2.138
   11    HE3  MET   1           2HE      MET   1  12.770 -30.116  -2.439
   12    H    ALA   2           H        ALA   2   9.777 -26.686  -4.435
   13    HA   ALA   2           HA       ALA   2   8.424 -27.597  -5.934
   14    HB1  ALA   2           1HB      ALA   2   7.258 -29.058  -3.542
   15    HB2  ALA   2           2HB      ALA   2   7.177 -29.580  -5.234
   16    HB3  ALA   2           3HB      ALA   2   8.749 -29.511  -4.408
   17    H    ALA   3           H        ALA   3   7.482 -25.038  -4.867
   18    HA   ALA   3           HA       ALA   3   4.547 -25.208  -5.085
   19    HB1  ALA   3           1HB      ALA   3   6.463 -22.873  -4.644
   20    HB2  ALA   3           2HB      ALA   3   4.685 -22.771  -4.592
   21    HB3  ALA   3           3HB      ALA   3   5.553 -23.739  -3.392
   22    H    LYS   4           H        LYS   4   3.617 -23.377  -6.536
   23    HA   LYS   4           HA       LYS   4   4.105 -23.871  -9.285
   24    HB2  LYS   4           2HB      LYS   4   2.942 -21.389  -7.959
   25    HB3  LYS   4           3HB      LYS   4   2.883 -21.726  -9.692
   26    HG2  LYS   4           2HG      LYS   4   1.494 -23.729  -9.284
   27    HG3  LYS   4           3HG      LYS   4   1.579 -23.437  -7.531
   28    HD2  LYS   4           2HD      LYS   4   0.569 -21.171  -7.921
   29    HD3  LYS   4           3HD      LYS   4   0.332 -21.598  -9.628
   30    HE2  LYS   4           2HE      LYS   4  -1.150 -23.433  -9.020
   31    HE3  LYS   4           3HE      LYS   4  -0.803 -23.212  -7.299
   32    HZ1  LYS   4           3HZ      LYS   4  -1.941 -21.008  -7.455
   33    HZ2  LYS   4           1HZ      LYS   4  -2.257 -21.260  -9.031
   34    HZ3  LYS   4           2HZ      LYS   4  -2.938 -22.210  -7.942
   35    H    PHE   5           H        PHE   5   5.520 -21.434  -7.092
   36    HA   PHE   5           HA       PHE   5   7.347 -20.501  -9.234
   37    HB2  PHE   5           2HB      PHE   5   5.988 -18.820  -7.083
   38    HB3  PHE   5           3HB      PHE   5   7.147 -18.251  -8.265
   39    HD1  PHE   5           HD1      PHE   5   6.530 -18.095 -10.694
   40    HD2  PHE   5           HD2      PHE   5   3.661 -19.123  -7.655
   41    HE1  PHE   5           HE1      PHE   5   4.689 -17.784 -12.318
   42    HE2  PHE   5           HE2      PHE   5   1.814 -18.829  -9.315
   43    HZ   PHE   5           HZ       PHE   5   2.341 -18.197 -11.653
   44    H    GLU   6           H        GLU   6   9.437 -19.925  -8.417
   45    HA   GLU   6           HA       GLU   6  10.093 -20.475  -5.611
   46    HB2  GLU   6           2HB      GLU   6  11.374 -21.827  -8.026
   47    HB3  GLU   6           3HB      GLU   6  12.073 -21.817  -6.412
   48    HG2  GLU   6           2HG      GLU   6   9.447 -23.127  -7.243
   49    HG3  GLU   6           3HG      GLU   6  10.960 -23.928  -6.901
   50    H    VAL   7           H        VAL   7  12.023 -19.324  -5.024
   51    HA   VAL   7           HA       VAL   7  12.406 -16.849  -6.244
   52    HB   VAL   7           HB       VAL   7  14.390 -16.626  -4.809
   53   HG11  VAL   7          1HG1      VAL   7  11.952 -17.923  -3.484
   54   HG12  VAL   7          2HG1      VAL   7  13.154 -16.903  -2.676
   55   HG13  VAL   7          3HG1      VAL   7  12.140 -16.231  -3.975
   56   HG21  VAL   7          3HG2      VAL   7  13.912 -19.539  -4.006
   57   HG22  VAL   7          1HG2      VAL   7  15.332 -18.912  -4.872
   58   HG23  VAL   7          2HG2      VAL   7  15.014 -18.390  -3.215
   59    H    GLY   8           H        GLY   8  13.516 -16.029  -7.839
   60    HA2  GLY   8           2HA      GLY   8  15.302 -15.829  -9.314
   61    HA3  GLY   8           3HA      GLY   8  15.733 -17.534  -9.085
   62    H    SER   9           H        SER   9  12.610 -18.125  -9.524
   63    HA   SER   9           HA       SER   9  12.723 -18.698 -12.306
   64    HB2  SER   9           2HB      SER   9  10.227 -18.259 -10.617
   65    HB3  SER   9           3HB      SER   9  10.376 -19.206 -12.106
   66    HG   SER   9           HG       SER   9  10.442 -20.455 -10.136
   67    H    VAL  10           H        VAL  10  11.192 -17.799 -13.969
   68    HA   VAL  10           HA       VAL  10  10.569 -14.936 -13.641
   69    HB   VAL  10           HB       VAL  10  12.013 -16.171 -16.029
   70   HG11  VAL  10          1HG1      VAL  10  11.148 -13.283 -15.544
   71   HG12  VAL  10          2HG1      VAL  10  12.097 -13.863 -16.932
   72   HG13  VAL  10          3HG1      VAL  10  10.424 -14.384 -16.717
   73   HG21  VAL  10          3HG2      VAL  10  13.021 -14.114 -14.039
   74   HG22  VAL  10          1HG2      VAL  10  13.593 -15.795 -14.181
   75   HG23  VAL  10          2HG2      VAL  10  13.871 -14.657 -15.505
   76    H    TYR  11           H        TYR  11   8.468 -14.601 -14.298
   77    HA   TYR  11           HA       TYR  11   7.225 -16.481 -16.225
   78    HB2  TYR  11           2HB      TYR  11   6.408 -16.064 -13.340
   79    HB3  TYR  11           3HB      TYR  11   5.186 -16.398 -14.547
   80    HD1  TYR  11           HD1      TYR  11   5.109 -18.521 -15.792
   81    HD2  TYR  11           HD2      TYR  11   7.998 -17.838 -12.671
   82    HE1  TYR  11           HE1      TYR  11   5.563 -20.938 -15.703
   83    HE2  TYR  11           HE2      TYR  11   8.447 -20.286 -12.552
   84    HH   TYR  11           HH       TYR  11   6.783 -22.610 -14.697
   85    H    THR  12           H        THR  12   4.885 -15.588 -16.690
   86    HA   THR  12           HA       THR  12   5.058 -12.626 -16.854
   87    HB   THR  12           HB       THR  12   3.592 -14.409 -18.804
   88    HG1  THR  12           1HG      THR  12   5.436 -14.167 -20.108
   89   HG21  THR  12          1HG2      THR  12   4.780 -11.604 -19.052
   90   HG22  THR  12          2HG2      THR  12   3.886 -12.470 -20.320
   91   HG23  THR  12          3HG2      THR  12   3.060 -11.979 -18.839
   92    H    GLY  13           H        GLY  13   3.191 -11.442 -16.416
   93    HA2  GLY  13           2HA      GLY  13   0.768 -12.804 -15.484
   94    HA3  GLY  13           3HA      GLY  13   1.740 -11.969 -14.256
   95    H    LYS  14           H        LYS  14  -0.555 -10.843 -14.322
   96    HA   LYS  14           HA       LYS  14  -0.299  -8.459 -16.099
   97    HB2  LYS  14           2HB      LYS  14  -2.757 -10.147 -15.574
   98    HB3  LYS  14           3HB      LYS  14  -2.895  -8.425 -15.984
   99    HG2  LYS  14           2HG      LYS  14  -1.577  -8.787 -18.049
  100    HG3  LYS  14           3HG      LYS  14  -1.456 -10.519 -17.677
  101    HD2  LYS  14           2HD      LYS  14  -3.938 -10.685 -17.777
  102    HD3  LYS  14           3HD      LYS  14  -4.022  -8.953 -18.190
  103    HE2  LYS  14           2HE      LYS  14  -2.653  -9.367 -20.220
  104    HE3  LYS  14           3HE      LYS  14  -2.522 -11.074 -19.814
  105    HZ1  LYS  14           3HZ      LYS  14  -4.924 -11.255 -20.061
  106    HZ2  LYS  14           1HZ      LYS  14  -5.038  -9.645 -20.445
  107    HZ3  LYS  14           2HZ      LYS  14  -4.230 -10.686 -21.428
  108    H    VAL  15           H        VAL  15  -0.664  -6.535 -15.222
  109    HA   VAL  15           HA       VAL  15  -0.146  -6.430 -12.405
  110    HB   VAL  15           HB       VAL  15  -0.769  -4.140 -14.293
  111   HG11  VAL  15          1HG1      VAL  15   0.955  -4.325 -11.768
  112   HG12  VAL  15          2HG1      VAL  15   0.729  -2.868 -12.755
  113   HG13  VAL  15          3HG1      VAL  15  -0.640  -3.546 -11.875
  114   HG21  VAL  15          3HG2      VAL  15   1.938  -5.480 -13.835
  115   HG22  VAL  15          1HG2      VAL  15   1.015  -5.481 -15.349
  116   HG23  VAL  15          2HG2      VAL  15   1.642  -3.979 -14.752
  117    H    THR  16           H        THR  16  -1.594  -6.284 -10.800
  118    HA   THR  16           HA       THR  16  -4.440  -5.859 -11.465
  119    HB   THR  16           HB       THR  16  -4.580  -6.992  -9.091
  120    HG1  THR  16           1HG      THR  16  -2.838  -8.391  -8.765
  121   HG21  THR  16          1HG2      THR  16  -3.650  -8.528 -11.558
  122   HG22  THR  16          2HG2      THR  16  -4.539  -9.189 -10.158
  123   HG23  THR  16          3HG2      THR  16  -5.320  -8.022 -11.213
  124    H    GLY  17           H        GLY  17  -1.816  -4.231  -9.778
  125    HA2  GLY  17           2HA      GLY  17  -3.466  -1.932  -9.611
  126    HA3  GLY  17           3HA      GLY  17  -3.365  -2.650  -8.000
  127    H    LEU  18           H        LEU  18  -2.329  -0.117  -8.462
  128    HA   LEU  18           HA       LEU  18   0.573  -0.615  -7.974
  129    HB2  LEU  18           2HB      LEU  18  -0.753   1.957  -8.928
  130    HB3  LEU  18           3HB      LEU  18   0.948   1.758  -8.528
  131    HG   LEU  18           HG       LEU  18  -0.524   0.515 -10.864
  132   HD11  LEU  18          1HD1      LEU  18   1.690   2.589 -10.754
  133   HD12  LEU  18          2HD1      LEU  18   0.986   1.917 -12.231
  134   HD13  LEU  18          3HD1      LEU  18  -0.013   2.899 -11.146
  135   HD21  LEU  18          3HD2      LEU  18   2.400   0.185 -10.159
  136   HD22  LEU  18          1HD2      LEU  18   1.150  -1.086 -10.123
  137   HD23  LEU  18          2HD2      LEU  18   1.605  -0.363 -11.660
  138    H    GLN  19           H        GLN  19   1.430   0.477  -6.217
  139    HA   GLN  19           HA       GLN  19  -0.349   1.788  -4.238
  140    HB2  GLN  19           2HB      GLN  19   1.604  -0.523  -3.766
  141    HB3  GLN  19           3HB      GLN  19   0.846   0.416  -2.495
  142    HG2  GLN  19           2HG      GLN  19  -0.800  -1.190  -4.496
  143    HG3  GLN  19           3HG      GLN  19  -0.130  -1.884  -3.031
  144   HE21  GLN  19          2HE2      GLN  19  -1.065  -1.422  -1.059
  145   HE22  GLN  19          1HE2      GLN  19  -2.544  -0.447  -0.886
  146    H    ALA  20           H        ALA  20   1.055   3.028  -2.699
  147    HA   ALA  20           HA       ALA  20   3.164   4.442  -3.924
  148    HB1  ALA  20           1HB      ALA  20   2.533   4.149  -0.954
  149    HB2  ALA  20           2HB      ALA  20   3.496   5.438  -1.703
  150    HB3  ALA  20           3HB      ALA  20   1.768   5.311  -2.076
  151    H    TYR  21           H        TYR  21   3.369   1.288  -2.756
  152    HA   TYR  21           HA       TYR  21   6.318   1.435  -2.395
  153    HB2  TYR  21           2HB      TYR  21   6.046  -0.358  -0.711
  154    HB3  TYR  21           3HB      TYR  21   5.288   1.150  -0.249
  155    HD1  TYR  21           HD2      TYR  21   4.601  -2.300  -1.510
  156    HD2  TYR  21           HD1      TYR  21   2.917   1.292   0.174
  157    HE1  TYR  21           HE2      TYR  21   2.435  -3.475  -1.155
  158    HE2  TYR  21           HE1      TYR  21   0.770   0.124   0.545
  159    HH   TYR  21           HH       TYR  21  -0.351  -1.893   0.433
  160    H    GLY  22           H        GLY  22   3.973   0.291  -4.572
  161    HA2  GLY  22           2HA      GLY  22   5.754  -1.130  -6.072
  162    HA3  GLY  22           3HA      GLY  22   5.154  -2.343  -4.942
  163    H    ALA  23           H        ALA  23   4.643  -3.201  -7.212
  164    HA   ALA  23           HA       ALA  23   1.922  -2.370  -8.128
  165    HB1  ALA  23           1HB      ALA  23   4.287  -3.405  -9.764
  166    HB2  ALA  23           2HB      ALA  23   2.652  -3.124 -10.380
  167    HB3  ALA  23           3HB      ALA  23   3.635  -1.759  -9.808
  168    H    PHE  24           H        PHE  24   0.472  -3.983  -7.733
  169    HA   PHE  24           HA       PHE  24   1.366  -6.702  -7.077
  170    HB2  PHE  24           2HB      PHE  24  -1.372  -5.418  -7.439
  171    HB3  PHE  24           3HB      PHE  24  -1.134  -7.130  -7.138
  172    HD1  PHE  24           HD2      PHE  24   0.444  -7.731  -5.065
  173    HD2  PHE  24           HD1      PHE  24  -1.776  -4.058  -5.543
  174    HE1  PHE  24           HE2      PHE  24   0.441  -7.405  -2.611
  175    HE2  PHE  24           HE1      PHE  24  -1.782  -3.743  -3.090
  176    HZ   PHE  24           HZ       PHE  24  -0.677  -5.403  -1.610
  177    H    VAL  25           H        VAL  25   1.279  -8.467  -8.431
  178    HA   VAL  25           HA       VAL  25   0.175  -8.148 -11.163
  179    HB   VAL  25           HB       VAL  25   2.913  -9.348 -10.548
  180   HG11  VAL  25          1HG1      VAL  25   1.510  -8.702 -13.177
  181   HG12  VAL  25          2HG1      VAL  25   3.145  -9.360 -13.018
  182   HG13  VAL  25          3HG1      VAL  25   1.759 -10.328 -12.507
  183   HG21  VAL  25          3HG2      VAL  25   2.274  -6.675 -11.871
  184   HG22  VAL  25          1HG2      VAL  25   3.054  -6.890 -10.293
  185   HG23  VAL  25          2HG2      VAL  25   3.883  -7.424 -11.746
  186    H    ALA  26           H        ALA  26  -1.352  -9.651 -11.291
  187    HA   ALA  26           HA       ALA  26  -1.339 -12.130  -9.746
  188    HB1  ALA  26           1HB      ALA  26  -3.065 -11.180 -12.063
  189    HB2  ALA  26           2HB      ALA  26  -3.339 -12.645 -11.084
  190    HB3  ALA  26           3HB      ALA  26  -3.441 -11.056 -10.321
  191    H    LEU  27           H        LEU  27  -0.935 -14.171 -10.560
  192    HA   LEU  27           HA       LEU  27   0.888 -14.263 -12.938
  193    HB2  LEU  27           2HB      LEU  27   1.096 -15.743 -10.283
  194    HB3  LEU  27           3HB      LEU  27   2.221 -15.843 -11.636
  195    HG   LEU  27           HG       LEU  27   1.742 -13.366  -9.940
  196   HD11  LEU  27          1HD1      LEU  27   4.050 -15.351  -9.940
  197   HD12  LEU  27          2HD1      LEU  27   3.962 -13.844  -9.002
  198   HD13  LEU  27          3HD1      LEU  27   2.827 -15.151  -8.666
  199   HD21  LEU  27          3HD2      LEU  27   3.862 -13.891 -12.069
  200   HD22  LEU  27          1HD2      LEU  27   2.485 -12.777 -12.219
  201   HD23  LEU  27          2HD2      LEU  27   3.724 -12.451 -11.015
  202    H    ASP  28           H        ASP  28  -1.637 -15.807 -11.009
  203    HA   ASP  28           HA       ASP  28  -2.289 -17.701 -13.138
  204    HB2  ASP  28           2HB      ASP  28  -0.719 -19.031 -11.821
  205    HB3  ASP  28           3HB      ASP  28  -1.441 -18.468 -10.316
  206    H    GLU  29           H        GLU  29  -4.463 -18.659 -12.528
  207    HA   GLU  29           HA       GLU  29  -6.363 -16.739 -11.758
  208    HB2  GLU  29           2HB      GLU  29  -6.439 -19.778 -11.888
  209    HB3  GLU  29           3HB      GLU  29  -7.872 -18.774 -11.601
  210    HG2  GLU  29           2HG      GLU  29  -7.475 -17.592 -13.754
  211    HG3  GLU  29           3HG      GLU  29  -6.095 -18.638 -14.077
  212    H    GLU  30           H        GLU  30  -4.417 -18.796  -9.680
  213    HA   GLU  30           HA       GLU  30  -5.940 -17.762  -7.325
  214    HB2  GLU  30           2HB      GLU  30  -4.754 -20.539  -7.734
  215    HB3  GLU  30           3HB      GLU  30  -5.493 -19.948  -6.243
  216    HG2  GLU  30           2HG      GLU  30  -7.648 -19.603  -7.468
  217    HG3  GLU  30           3HG      GLU  30  -6.927 -20.356  -8.897
  218    H    THR  31           H        THR  31  -3.151 -17.052  -8.787
  219    HA   THR  31           HA       THR  31  -1.772 -16.714  -6.197
  220    HB   THR  31           HB       THR  31  -0.360 -17.976  -8.572
  221    HG1  THR  31           1HG      THR  31  -0.343 -19.845  -7.294
  222   HG21  THR  31          1HG2      THR  31   0.488 -17.681  -5.661
  223   HG22  THR  31          2HG2      THR  31   1.395 -18.526  -6.935
  224   HG23  THR  31          3HG2      THR  31   1.147 -16.784  -7.049
  225    H    GLN  32           H        GLN  32  -0.325 -15.007  -6.112
  226    HA   GLN  32           HA       GLN  32  -0.088 -13.095  -8.319
  227    HB2  GLN  32           2HB      GLN  32  -2.361 -12.752  -7.407
  228    HB3  GLN  32           3HB      GLN  32  -1.731 -12.704  -5.758
  229    HG2  GLN  32           2HG      GLN  32  -0.581 -10.585  -6.223
  230    HG3  GLN  32           3HG      GLN  32  -1.126 -10.622  -7.898
  231   HE21  GLN  32          2HE2      GLN  32  -1.632  -8.648  -5.632
  232   HE22  GLN  32          1HE2      GLN  32  -3.379  -8.535  -5.577
  233    H    GLY  33           H        GLY  33   1.444 -11.392  -7.706
  234    HA2  GLY  33           2HA      GLY  33   2.700 -11.591  -5.041
  235    HA3  GLY  33           3HA      GLY  33   3.752 -11.776  -6.454
  236    H    LEU  34           H        LEU  34   4.624  -9.798  -5.183
  237    HA   LEU  34           HA       LEU  34   3.344  -7.265  -6.124
  238    HB2  LEU  34           2HB      LEU  34   2.769  -7.596  -3.797
  239    HB3  LEU  34           3HB      LEU  34   4.429  -8.035  -3.392
  240    HG   LEU  34           HG       LEU  34   5.170  -5.700  -3.923
  241   HD11  LEU  34          1HD1      LEU  34   2.183  -5.114  -4.185
  242   HD12  LEU  34          2HD1      LEU  34   3.495  -3.914  -4.149
  243   HD13  LEU  34          3HD1      LEU  34   3.377  -5.037  -5.496
  244   HD21  LEU  34          3HD2      LEU  34   2.914  -5.942  -1.884
  245   HD22  LEU  34          1HD2      LEU  34   4.632  -6.352  -1.628
  246   HD23  LEU  34          2HD2      LEU  34   4.181  -4.684  -1.929
  247    H    VAL  35           H        VAL  35   4.734  -6.390  -7.536
  248    HA   VAL  35           HA       VAL  35   7.632  -6.703  -7.330
  249    HB   VAL  35           HB       VAL  35   5.980  -4.684  -8.920
  250   HG11  VAL  35          1HG1      VAL  35   8.851  -5.656  -9.243
  251   HG12  VAL  35          2HG1      VAL  35   8.014  -4.510 -10.316
  252   HG13  VAL  35          3HG1      VAL  35   8.367  -4.062  -8.651
  253   HG21  VAL  35          3HG2      VAL  35   7.072  -7.365  -9.869
  254   HG22  VAL  35          1HG2      VAL  35   5.349  -6.970  -9.617
  255   HG23  VAL  35          2HG2      VAL  35   6.267  -6.141 -10.865
  256    H    HIS  36           H        HIS  36   8.768  -5.619  -5.718
  257    HA   HIS  36           HA       HIS  36   7.542  -3.423  -4.232
  258    HB2  HIS  36           2HB      HIS  36   9.042  -4.974  -3.125
  259    HB3  HIS  36           3HB      HIS  36  10.323  -4.635  -4.286
  260    HD1  HIS  36           HD1      HIS  36  12.055  -3.038  -3.476
  261    HD2  HIS  36           HD2      HIS  36   8.286  -2.467  -1.673
  262    HE1  HIS  36           HE1      HIS  36  12.330  -1.159  -1.727
  263    H    ILE  37           H        ILE  37   8.108  -1.204  -4.346
  264    HA   ILE  37           HA       ILE  37   8.385  -0.229  -6.923
  265    HB   ILE  37           HB       ILE  37   7.302   0.919  -5.023
  266   HG12  ILE  37          2HG1      ILE  37   9.301   2.634  -6.525
  267   HG13  ILE  37          3HG1      ILE  37   7.802   1.976  -7.199
  268   HG21  ILE  37          1HG2      ILE  37  10.135   1.737  -4.218
  269   HG22  ILE  37          2HG2      ILE  37   8.651   2.374  -3.522
  270   HG23  ILE  37          3HG2      ILE  37   9.047   0.677  -3.283
  271   HD11  ILE  37          3HD1      ILE  37   6.466   3.241  -5.551
  272   HD12  ILE  37          1HD1      ILE  37   7.955   3.942  -4.872
  273   HD13  ILE  37          2HD1      ILE  37   7.495   4.309  -6.533
  274    H    SER  38           H        SER  38  11.130  -0.552  -4.553
  275    HA   SER  38           HA       SER  38  12.969   0.775  -6.247
  276    HB2  SER  38           2HB      SER  38  13.558  -1.402  -4.213
  277    HB3  SER  38           3HB      SER  38  14.643  -0.113  -4.766
  278    HG   SER  38           HG       SER  38  13.655   0.385  -2.767
  279    H    GLU  39           H        GLU  39  11.420  -2.176  -6.752
  280    HA   GLU  39           HA       GLU  39  13.474  -3.131  -8.649
  281    HB2  GLU  39           2HB      GLU  39  11.444  -4.557  -6.900
  282    HB3  GLU  39           3HB      GLU  39  12.177  -5.317  -8.299
  283    HG2  GLU  39           2HG      GLU  39  13.344  -6.021  -6.350
  284    HG3  GLU  39           3HG      GLU  39  14.406  -5.094  -7.388
  285    H    VAL  40           H        VAL  40  10.750  -1.272  -8.737
  286    HA   VAL  40           HA       VAL  40   9.377  -2.487 -10.976
  287    HB   VAL  40           HB       VAL  40   9.347   0.163  -9.560
  288   HG11  VAL  40          1HG1      VAL  40   7.823  -0.311 -12.125
  289   HG12  VAL  40          2HG1      VAL  40   7.592   1.052 -10.995
  290   HG13  VAL  40          3HG1      VAL  40   9.109   0.878 -11.864
  291   HG21  VAL  40          3HG2      VAL  40   7.230  -1.938 -10.152
  292   HG22  VAL  40          1HG2      VAL  40   8.090  -1.709  -8.612
  293   HG23  VAL  40          2HG2      VAL  40   6.992  -0.458  -9.202
  294    H    THR  41           H        THR  41  12.315  -0.493 -10.811
  295    HA   THR  41           HA       THR  41  12.654  -0.907 -13.704
  296    HB   THR  41           HB       THR  41  12.660   1.851 -12.409
  297    HG1  THR  41           1HG      THR  41  10.854   2.055 -13.890
  298   HG21  THR  41          1HG2      THR  41  13.104   1.106 -15.336
  299   HG22  THR  41          2HG2      THR  41  12.955   2.753 -14.679
  300   HG23  THR  41          3HG2      THR  41  14.334   1.771 -14.223
  301    H    HIS  42           H        HIS  42  14.894  -0.688 -14.316
  302    HA   HIS  42           HA       HIS  42  16.801  -1.195 -12.185
  303    HB2  HIS  42           2HB      HIS  42  16.561  -2.251 -14.626
  304    HB3  HIS  42           3HB      HIS  42  17.613  -0.925 -15.079
  305    HD1  HIS  42           HD1      HIS  42  17.679  -4.344 -13.743
  306    HD2  HIS  42           HD2      HIS  42  20.065  -0.887 -13.476
  307    HE1  HIS  42           HE1      HIS  42  19.968  -5.095 -12.824
  308    H    GLY  43           H        GLY  43  15.953   1.189 -11.525
  309    HA2  GLY  43           2HA      GLY  43  18.084   3.019 -11.538
  310    HA3  GLY  43           3HA      GLY  43  16.999   3.444 -12.878
  311    H    PHE  44           H        PHE  44  16.619   5.438 -11.515
  312    HA   PHE  44           HA       PHE  44  15.077   5.405  -9.134
  313    HB2  PHE  44           2HB      PHE  44  14.937   7.329 -11.504
  314    HB3  PHE  44           3HB      PHE  44  14.280   7.632  -9.908
  315    HD1  PHE  44           HD2      PHE  44  15.935   7.613  -7.883
  316    HD2  PHE  44           HD1      PHE  44  17.157   8.002 -12.007
  317    HE1  PHE  44           HE2      PHE  44  18.093   8.596  -7.157
  318    HE2  PHE  44           HE1      PHE  44  19.312   8.983 -11.270
  319    HZ   PHE  44           HZ       PHE  44  19.783   9.284  -8.846
  320    H    VAL  45           H        VAL  45  12.813   5.495  -8.810
  321    HA   VAL  45           HA       VAL  45  11.043   5.018 -11.145
  322    HB   VAL  45           HB       VAL  45  10.819   3.855  -8.342
  323   HG11  VAL  45          1HG1      VAL  45   8.875   3.663 -10.697
  324   HG12  VAL  45          2HG1      VAL  45   8.746   2.789  -9.159
  325   HG13  VAL  45          3HG1      VAL  45   8.580   4.548  -9.183
  326   HG21  VAL  45          3HG2      VAL  45  11.082   2.586 -11.105
  327   HG22  VAL  45          1HG2      VAL  45  12.372   2.632  -9.876
  328   HG23  VAL  45          2HG2      VAL  45  10.908   1.706  -9.586
  329    H    LYS  46           H        LYS  46  10.817   7.130 -11.501
  330    HA   LYS  46           HA       LYS  46  10.908   9.190  -9.586
  331    HB2  LYS  46           2HB      LYS  46  11.335   9.381 -12.039
  332    HB3  LYS  46           3HB      LYS  46   9.634   9.065 -12.366
  333    HG2  LYS  46           2HG      LYS  46  10.177  11.436 -12.595
  334    HG3  LYS  46           3HG      LYS  46   8.961  11.157 -11.355
  335    HD2  LYS  46           2HD      LYS  46  10.528  12.875 -10.647
  336    HD3  LYS  46           3HD      LYS  46  10.651  11.475  -9.580
  337    HE2  LYS  46           2HE      LYS  46  12.676  10.714 -10.797
  338    HE3  LYS  46           3HE      LYS  46  12.531  12.079 -11.916
  339    HZ1  LYS  46           3HZ      LYS  46  12.885  13.569 -10.048
  340    HZ2  LYS  46           1HZ      LYS  46  13.011  12.305  -9.005
  341    HZ3  LYS  46           2HZ      LYS  46  14.141  12.518 -10.183
  342    H    ASP  47           H        ASP  47   8.066   7.599 -11.069
  343    HA   ASP  47           HA       ASP  47   6.607   7.774  -8.585
  344    HB2  ASP  47           2HB      ASP  47   5.852   9.898  -9.544
  345    HB3  ASP  47           3HB      ASP  47   5.587   9.137 -11.115
  346    H    ILE  48           H        ILE  48   5.347   5.819  -8.584
  347    HA   ILE  48           HA       ILE  48   6.260   3.869 -10.395
  348    HB   ILE  48           HB       ILE  48   5.632   3.434  -8.095
  349   HG12  ILE  48          2HG1      ILE  48   4.047   1.756 -10.064
  350   HG13  ILE  48          3HG1      ILE  48   5.785   1.648  -9.773
  351   HG21  ILE  48          1HG2      ILE  48   2.723   3.779  -8.955
  352   HG22  ILE  48          2HG2      ILE  48   3.272   3.177  -7.386
  353   HG23  ILE  48          3HG2      ILE  48   3.622   4.826  -7.832
  354   HD11  ILE  48          3HD1      ILE  48   5.382   1.017  -7.414
  355   HD12  ILE  48          1HD1      ILE  48   3.624   1.075  -7.703
  356   HD13  ILE  48          2HD1      ILE  48   4.611  -0.104  -8.555
  357    H    ASN  49           H        ASN  49   3.258   5.830 -10.631
  358    HA   ASN  49           HA       ASN  49   2.186   4.182 -12.762
  359    HB2  ASN  49           2HB      ASN  49   0.364   5.389 -12.444
  360    HB3  ASN  49           3HB      ASN  49   1.182   6.242 -11.137
  361   HD21  ASN  49          2HD2      ASN  49   2.500   8.230 -11.822
  362   HD22  ASN  49          1HD2      ASN  49   1.917   9.132 -13.225
  363    H    GLU  50           H        GLU  50   4.690   6.594 -12.697
  364    HA   GLU  50           HA       GLU  50   4.537   7.024 -15.607
  365    HB2  GLU  50           2HB      GLU  50   6.618   7.887 -13.555
  366    HB3  GLU  50           3HB      GLU  50   6.567   8.394 -15.233
  367    HG2  GLU  50           2HG      GLU  50   4.531   9.032 -13.066
  368    HG3  GLU  50           3HG      GLU  50   5.700  10.128 -13.781
  369    H    HIS  51           H        HIS  51   5.456   4.419 -13.806
  370    HA   HIS  51           HA       HIS  51   7.693   3.631 -15.657
  371    HB2  HIS  51           2HB      HIS  51   7.477   3.476 -12.634
  372    HB3  HIS  51           3HB      HIS  51   8.513   2.389 -13.540
  373    HD1  HIS  51           HD1      HIS  51  10.891   3.272 -14.087
  374    HD2  HIS  51           HD2      HIS  51   8.178   6.302 -13.154
  375    HE1  HIS  51           HE1      HIS  51  12.252   5.336 -13.962
  376    H    LEU  52           H        LEU  52   4.725   2.691 -14.037
  377    HA   LEU  52           HA       LEU  52   4.674   0.126 -15.458
  378    HB2  LEU  52           2HB      LEU  52   5.492   0.279 -12.740
  379    HB3  LEU  52           3HB      LEU  52   3.789  -0.059 -12.622
  380    HG   LEU  52           HG       LEU  52   5.180  -2.067 -12.484
  381   HD11  LEU  52          1HD1      LEU  52   3.523  -2.066 -15.035
  382   HD12  LEU  52          2HD1      LEU  52   4.041  -3.491 -14.144
  383   HD13  LEU  52          3HD1      LEU  52   2.928  -2.356 -13.376
  384   HD21  LEU  52          3HD2      LEU  52   6.058  -1.507 -15.352
  385   HD22  LEU  52          1HD2      LEU  52   7.074  -1.452 -13.903
  386   HD23  LEU  52          2HD2      LEU  52   6.369  -2.982 -14.434
  387    H    SER  53           H        SER  53   2.303  -0.838 -15.059
  388    HA   SER  53           HA       SER  53   0.296   1.339 -14.959
  389    HB2  SER  53           2HB      SER  53   0.847  -0.440 -17.385
  390    HB3  SER  53           3HB      SER  53  -0.469   0.738 -17.218
  391    HG   SER  53           HG       SER  53   1.349   1.558 -18.374
  392    H    VAL  54           H        VAL  54  -1.642   0.488 -14.168
  393    HA   VAL  54           HA       VAL  54  -1.932  -2.337 -13.587
  394    HB   VAL  54           HB       VAL  54  -4.090  -0.173 -13.647
  395   HG11  VAL  54          1HG1      VAL  54  -3.862  -2.780 -12.058
  396   HG12  VAL  54          2HG1      VAL  54  -5.174  -1.587 -11.914
  397   HG13  VAL  54          3HG1      VAL  54  -4.976  -2.488 -13.405
  398   HG21  VAL  54          3HG2      VAL  54  -2.247  -0.962 -11.359
  399   HG22  VAL  54          1HG2      VAL  54  -2.259   0.606 -12.199
  400   HG23  VAL  54          2HG2      VAL  54  -3.648   0.138 -11.232
  401    H    GLY  55           H        GLY  55  -3.348  -3.825 -14.609
  402    HA2  GLY  55           2HA      GLY  55  -4.578  -4.762 -16.248
  403    HA3  GLY  55           3HA      GLY  55  -5.033  -3.141 -16.814
  404    H    ASP  56           H        ASP  56  -1.659  -4.207 -16.552
  405    HA   ASP  56           HA       ASP  56  -1.482  -4.551 -19.509
  406    HB2  ASP  56           2HB      ASP  56  -0.497  -2.413 -18.717
  407    HB3  ASP  56           3HB      ASP  56   0.573  -3.321 -17.639
  408    H    GLU  57           H        GLU  57   0.376  -5.993 -20.096
  409    HA   GLU  57           HA       GLU  57   0.639  -8.233 -18.154
  410    HB2  GLU  57           2HB      GLU  57  -0.476  -8.712 -20.322
  411    HB3  GLU  57           3HB      GLU  57   0.972  -8.159 -21.175
  412    HG2  GLU  57           2HG      GLU  57   2.282  -9.992 -20.104
  413    HG3  GLU  57           3HG      GLU  57   0.830 -10.515 -19.239
  414    H    VAL  58           H        VAL  58   2.662  -8.831 -17.476
  415    HA   VAL  58           HA       VAL  58   5.057  -7.489 -18.575
  416    HB   VAL  58           HB       VAL  58   5.733  -6.834 -16.259
  417   HG11  VAL  58          1HG1      VAL  58   3.172  -5.481 -17.213
  418   HG12  VAL  58          2HG1      VAL  58   4.346  -4.803 -16.075
  419   HG13  VAL  58          3HG1      VAL  58   4.817  -5.116 -17.751
  420   HG21  VAL  58          3HG2      VAL  58   2.842  -7.410 -15.475
  421   HG22  VAL  58          1HG2      VAL  58   4.288  -8.273 -14.895
  422   HG23  VAL  58          2HG2      VAL  58   4.054  -6.575 -14.483
  423    H    GLN  59           H        GLN  59   6.951  -8.718 -18.219
  424    HA   GLN  59           HA       GLN  59   6.586 -11.324 -16.880
  425    HB2  GLN  59           2HB      GLN  59   8.739 -11.945 -17.800
  426    HB3  GLN  59           3HB      GLN  59   7.535 -11.597 -19.034
  427    HG2  GLN  59           2HG      GLN  59   8.586  -9.624 -19.739
  428    HG3  GLN  59           3HG      GLN  59   9.509  -9.430 -18.261
  429   HE21  GLN  59          2HE2      GLN  59  10.111  -9.956 -21.380
  430   HE22  GLN  59          1HE2      GLN  59  11.471 -11.065 -21.246
  431    H    VAL  60           H        VAL  60   7.617 -11.864 -15.056
  432    HA   VAL  60           HA       VAL  60   9.029  -9.731 -13.547
  433    HB   VAL  60           HB       VAL  60   7.743 -10.736 -11.584
  434   HG11  VAL  60          1HG1      VAL  60   6.118  -9.288 -13.704
  435   HG12  VAL  60          2HG1      VAL  60   5.693  -9.415 -11.988
  436   HG13  VAL  60          3HG1      VAL  60   7.168  -8.571 -12.443
  437   HG21  VAL  60          3HG2      VAL  60   5.920 -11.891 -13.750
  438   HG22  VAL  60          1HG2      VAL  60   6.909 -12.825 -12.596
  439   HG23  VAL  60          2HG2      VAL  60   5.589 -11.810 -12.020
  440    H    LYS  61           H        LYS  61  10.658 -10.458 -12.189
  441    HA   LYS  61           HA       LYS  61  11.321 -13.362 -12.283
  442    HB2  LYS  61           2HB      LYS  61  13.091 -11.689 -12.835
  443    HB3  LYS  61           3HB      LYS  61  12.955 -11.043 -11.191
  444    HG2  LYS  61           2HG      LYS  61  13.677 -13.200 -10.249
  445    HG3  LYS  61           3HG      LYS  61  13.673 -13.940 -11.860
  446    HD2  LYS  61           2HD      LYS  61  15.428 -12.301 -12.588
  447    HD3  LYS  61           3HD      LYS  61  15.450 -11.651 -10.943
  448    HE2  LYS  61           2HE      LYS  61  17.301 -13.108 -11.060
  449    HE3  LYS  61           3HE      LYS  61  16.079 -13.970 -10.121
  450    HZ1  LYS  61           3HZ      LYS  61  15.532 -15.256 -12.103
  451    HZ2  LYS  61           1HZ      LYS  61  16.678 -14.423 -12.990
  452    HZ3  LYS  61           2HZ      LYS  61  17.105 -15.403 -11.756
  453    H    VAL  62           H        VAL  62  10.880 -14.600 -10.512
  454    HA   VAL  62           HA       VAL  62   9.498 -13.591  -8.218
  455    HB   VAL  62           HB       VAL  62  10.938 -16.237  -8.645
  456   HG11  VAL  62          1HG1      VAL  62   8.697 -15.428  -6.727
  457   HG12  VAL  62          2HG1      VAL  62   9.353 -17.068  -6.917
  458   HG13  VAL  62          3HG1      VAL  62  10.367 -15.778  -6.262
  459   HG21  VAL  62          3HG2      VAL  62   8.019 -15.494  -9.172
  460   HG22  VAL  62          1HG2      VAL  62   9.230 -15.882 -10.417
  461   HG23  VAL  62          2HG2      VAL  62   8.731 -17.122  -9.280
  462    H    LEU  63           H        LEU  63  10.341 -12.431  -6.639
  463    HA   LEU  63           HA       LEU  63  13.259 -12.375  -6.190
  464    HB2  LEU  63           2HB      LEU  63  12.014 -10.284  -6.562
  465    HB3  LEU  63           3HB      LEU  63  10.943 -10.656  -5.218
  466    HG   LEU  63           HG       LEU  63  12.842 -10.488  -3.626
  467   HD11  LEU  63          1HD1      LEU  63  14.428  -9.538  -6.063
  468   HD12  LEU  63          2HD1      LEU  63  14.971  -9.481  -4.373
  469   HD13  LEU  63          3HD1      LEU  63  14.720 -11.041  -5.150
  470   HD21  LEU  63          3HD2      LEU  63  12.406  -8.071  -5.428
  471   HD22  LEU  63          1HD2      LEU  63  11.393  -8.550  -4.059
  472   HD23  LEU  63          2HD2      LEU  63  13.064  -8.029  -3.777
  473    H    ALA  64           H        ALA  64  10.190 -13.165  -4.497
  474    HA   ALA  64           HA       ALA  64  11.638 -14.802  -2.552
  475    HB1  ALA  64           1HB      ALA  64   9.981 -12.429  -1.627
  476    HB2  ALA  64           2HB      ALA  64  10.602 -13.718  -0.595
  477    HB3  ALA  64           3HB      ALA  64  11.739 -12.637  -1.424
  478    H    VAL  65           H        VAL  65  10.081 -16.212  -1.386
  479    HA   VAL  65           HA       VAL  65   7.272 -16.109  -2.278
  480    HB   VAL  65           HB       VAL  65   9.047 -18.596  -2.310
  481   HG11  VAL  65          1HG1      VAL  65   6.095 -18.278  -3.040
  482   HG12  VAL  65          2HG1      VAL  65   7.064 -19.757  -3.231
  483   HG13  VAL  65          3HG1      VAL  65   6.732 -19.135  -1.618
  484   HG21  VAL  65          3HG2      VAL  65   7.726 -17.132  -4.638
  485   HG22  VAL  65          1HG2      VAL  65   9.470 -17.219  -4.311
  486   HG23  VAL  65          2HG2      VAL  65   8.595 -18.683  -4.739
  487    H    ASP  66           H        ASP  66   5.902 -16.679  -0.603
  488    HA   ASP  66           HA       ASP  66   6.979 -17.701   1.969
  489    HB2  ASP  66           2HB      ASP  66   6.893 -15.223   2.101
  490    HB3  ASP  66           3HB      ASP  66   5.200 -15.264   1.613
  491    H    GLU  67           H        GLU  67   6.085 -19.568   0.791
  492    HA   GLU  67           HA       GLU  67   3.394 -19.832   0.011
  493    HB2  GLU  67           2HB      GLU  67   3.863 -22.211  -0.109
  494    HB3  GLU  67           3HB      GLU  67   5.190 -21.269  -0.792
  495    HG2  GLU  67           2HG      GLU  67   6.503 -21.589   1.301
  496    HG3  GLU  67           3HG      GLU  67   5.170 -22.515   1.995
  497    H    GLU  68           H        GLU  68   4.718 -19.864   3.250
  498    HA   GLU  68           HA       GLU  68   2.646 -21.359   4.526
  499    HB2  GLU  68           2HB      GLU  68   4.308 -19.060   5.650
  500    HB3  GLU  68           3HB      GLU  68   3.437 -20.298   6.565
  501    HG2  GLU  68           2HG      GLU  68   4.934 -22.031   5.432
  502    HG3  GLU  68           3HG      GLU  68   5.885 -20.691   4.790
  503    H    LYS  69           H        LYS  69   2.770 -18.164   3.167
  504    HA   LYS  69           HA       LYS  69   0.057 -17.521   4.275
  505    HB2  LYS  69           2HB      LYS  69   2.383 -15.689   3.526
  506    HB3  LYS  69           3HB      LYS  69   0.780 -15.115   3.978
  507    HG2  LYS  69           2HG      LYS  69   2.669 -16.691   5.789
  508    HG3  LYS  69           3HG      LYS  69   2.411 -14.950   5.822
  509    HD2  LYS  69           2HD      LYS  69   0.000 -15.331   6.386
  510    HD3  LYS  69           3HD      LYS  69   0.324 -17.082   6.449
  511    HE2  LYS  69           2HE      LYS  69   2.024 -16.714   8.207
  512    HE3  LYS  69           3HE      LYS  69   1.711 -14.975   8.158
  513    HZ1  LYS  69           3HZ      LYS  69  -0.555 -15.429   8.873
  514    HZ2  LYS  69           1HZ      LYS  69  -0.251 -17.049   8.914
  515    HZ3  LYS  69           2HZ      LYS  69   0.526 -16.038   9.958
  516    H    GLY  70           H        GLY  70   1.718 -18.404   1.481
  517    HA2  GLY  70           2HA      GLY  70   1.082 -18.456  -0.718
  518    HA3  GLY  70           3HA      GLY  70  -0.522 -17.852  -0.249
  519    H    LYS  71           H        LYS  71   2.707 -16.311   0.253
  520    HA   LYS  71           HA       LYS  71   1.801 -14.031  -1.479
  521    HB2  LYS  71           2HB      LYS  71   3.451 -14.000   1.080
  522    HB3  LYS  71           3HB      LYS  71   3.207 -12.602   0.024
  523    HG2  LYS  71           2HG      LYS  71   0.770 -12.686   0.428
  524    HG3  LYS  71           3HG      LYS  71   0.961 -14.142   1.406
  525    HD2  LYS  71           2HD      LYS  71   0.691 -12.292   2.903
  526    HD3  LYS  71           3HD      LYS  71   2.329 -12.917   3.043
  527    HE2  LYS  71           2HE      LYS  71   2.479 -10.538   3.107
  528    HE3  LYS  71           3HE      LYS  71   3.148 -11.068   1.565
  529    HZ1  LYS  71           3HZ      LYS  71   1.045 -10.473   0.529
  530    HZ2  LYS  71           1HZ      LYS  71   0.432  -9.970   1.976
  531    HZ3  LYS  71           2HZ      LYS  71   1.708  -9.177   1.305
  532    H    ILE  72           H        ILE  72   3.491 -12.919  -2.655
  533    HA   ILE  72           HA       ILE  72   6.066 -14.303  -2.978
  534    HB   ILE  72           HB       ILE  72   4.006 -13.833  -5.198
  535   HG12  ILE  72          2HG1      ILE  72   5.247 -16.402  -4.131
  536   HG13  ILE  72          3HG1      ILE  72   3.563 -15.897  -3.948
  537   HG21  ILE  72          1HG2      ILE  72   6.874 -14.831  -5.432
  538   HG22  ILE  72          2HG2      ILE  72   5.719 -14.711  -6.777
  539   HG23  ILE  72          3HG2      ILE  72   6.276 -13.259  -6.000
  540   HD11  ILE  72          3HD1      ILE  72   3.202 -16.053  -6.363
  541   HD12  ILE  72          1HD1      ILE  72   4.861 -16.656  -6.586
  542   HD13  ILE  72          2HD1      ILE  72   3.717 -17.600  -5.646
  543    H    SER  73           H        SER  73   7.645 -12.806  -3.472
  544    HA   SER  73           HA       SER  73   6.805  -9.999  -4.081
  545    HB2  SER  73           2HB      SER  73   9.473 -10.946  -2.999
  546    HB3  SER  73           3HB      SER  73   8.940  -9.279  -3.221
  547    HG   SER  73           HG       SER  73   8.701 -10.015  -1.030
  548    H    LEU  74           H        LEU  74   7.986  -8.964  -5.813
  549    HA   LEU  74           HA       LEU  74   9.148 -10.844  -7.819
  550    HB2  LEU  74           2HB      LEU  74   6.898  -8.832  -8.164
  551    HB3  LEU  74           3HB      LEU  74   7.637  -9.738  -9.477
  552    HG   LEU  74           HG       LEU  74   6.061 -10.976  -7.177
  553   HD11  LEU  74          1HD1      LEU  74   5.212 -10.408 -10.040
  554   HD12  LEU  74          2HD1      LEU  74   4.265 -11.284  -8.835
  555   HD13  LEU  74          3HD1      LEU  74   4.630  -9.570  -8.590
  556   HD21  LEU  74          3HD2      LEU  74   7.057 -12.195  -9.801
  557   HD22  LEU  74          1HD2      LEU  74   7.690 -12.533  -8.169
  558   HD23  LEU  74          2HD2      LEU  74   6.049 -12.995  -8.577
  559    H    SER  75           H        SER  75  10.104  -9.653  -9.656
  560    HA   SER  75           HA       SER  75  10.827  -6.816  -9.119
  561    HB2  SER  75           2HB      SER  75  12.721  -9.031 -10.030
  562    HB3  SER  75           3HB      SER  75  13.120  -7.310  -9.885
  563    HG   SER  75           HG       SER  75  13.778  -8.515  -8.032
  564    H    ILE  76           H        ILE  76  10.985  -5.561 -10.938
  565    HA   ILE  76           HA       ILE  76  10.617  -6.784 -13.637
  566    HB   ILE  76           HB       ILE  76   9.742  -4.133 -12.438
  567   HG12  ILE  76          2HG1      ILE  76   8.224  -6.052 -12.048
  568   HG13  ILE  76          3HG1      ILE  76   7.502  -4.747 -12.985
  569   HG21  ILE  76          1HG2      ILE  76   9.647  -4.925 -15.378
  570   HG22  ILE  76          2HG2      ILE  76   8.847  -3.501 -14.647
  571   HG23  ILE  76          3HG2      ILE  76  10.594  -3.618 -14.657
  572   HD11  ILE  76          3HD1      ILE  76   7.806  -6.082 -15.075
  573   HD12  ILE  76          1HD1      ILE  76   8.551  -7.370 -14.089
  574   HD13  ILE  76          2HD1      ILE  76   6.844  -6.917 -13.876
  575    H    ARG  77           H        ARG  77  12.539  -4.558 -11.599
  576    HA   ARG  77           HA       ARG  77  14.246  -3.608 -13.609
  577    HB2  ARG  77           2HB      ARG  77  15.804  -3.091 -11.959
  578    HB3  ARG  77           3HB      ARG  77  14.238  -2.945 -11.165
  579    HG2  ARG  77           2HG      ARG  77  14.619  -5.101 -10.016
  580    HG3  ARG  77           3HG      ARG  77  16.173  -5.291 -10.842
  581    HD2  ARG  77           2HD      ARG  77  15.467  -3.065  -8.892
  582    HD3  ARG  77           3HD      ARG  77  16.468  -4.452  -8.538
  583    HE   ARG  77           HE       ARG  77  18.034  -3.610 -10.335
  584   HH11  ARG  77          1HH1      ARG  77  15.967  -1.289  -8.477
  585   HH12  ARG  77          2HH1      ARG  77  17.037   0.019  -8.719
  586   HH21  ARG  77          1HH2      ARG  77  19.428  -1.833 -10.621
  587   HH22  ARG  77          2HH2      ARG  77  19.062  -0.298  -9.924
  588    H    ALA  78           H        ALA  78  14.087  -6.834 -12.283
  589    HA   ALA  78           HA       ALA  78  16.602  -7.752 -13.361
  590    HB1  ALA  78           1HB      ALA  78  14.063  -9.260 -12.577
  591    HB2  ALA  78           2HB      ALA  78  15.661  -9.977 -12.872
  592    HB3  ALA  78           3HB      ALA  78  15.429  -8.882 -11.495
  593    H    THR  79           H        THR  79  13.284  -7.426 -14.753
  594    HA   THR  79           HA       THR  79  14.018  -9.225 -16.963
  595    HB   THR  79           HB       THR  79  11.585  -9.126 -17.444
  596    HG1  THR  79           1HG      THR  79  10.264  -8.181 -15.846
  597   HG21  THR  79          1HG2      THR  79  12.245  -9.840 -14.538
  598   HG22  THR  79          2HG2      THR  79  10.852 -10.409 -15.465
  599   HG23  THR  79          3HG2      THR  79  12.464 -10.909 -15.949
  600    H    GLN  80           H        GLN  80  12.802  -5.858 -16.459
  601    HA   GLN  80           HA       GLN  80  13.182  -5.003 -19.171
  602    HB2  GLN  80           2HB      GLN  80  13.245  -3.533 -16.488
  603    HB3  GLN  80           3HB      GLN  80  13.414  -2.718 -18.046
  604    HG2  GLN  80           2HG      GLN  80  11.191  -3.553 -18.749
  605    HG3  GLN  80           3HG      GLN  80  10.999  -4.366 -17.197
  606   HE21  GLN  80          2HE2      GLN  80   8.951  -2.758 -17.659
  607   HE22  GLN  80          1HE2      GLN  80   9.103  -1.235 -16.794
  608    H    ALA  81           H        ALA  81  15.301  -5.182 -16.354
  609    HA   ALA  81           HA       ALA  81  17.518  -5.065 -16.030
  610    HB1  ALA  81           1HB      ALA  81  17.639  -6.224 -18.827
  611    HB2  ALA  81           2HB      ALA  81  18.899  -6.328 -17.581
  612    HB3  ALA  81           3HB      ALA  81  17.346  -7.142 -17.335
  613    H    ALA  82           H        ALA  82  19.628  -4.660 -17.908
  614    HA   ALA  82           HA       ALA  82  19.379  -1.957 -18.950
  615    HB1  ALA  82           1HB      ALA  82  21.404  -2.832 -16.822
  616    HB2  ALA  82           2HB      ALA  82  21.503  -1.311 -17.726
  617    HB3  ALA  82           3HB      ALA  82  20.135  -1.594 -16.638
  618    HA   PRO  83           HA       PRO  83  21.691  -3.568 -22.250
  619    HB2  PRO  83           2HB      PRO  83  23.954  -1.622 -21.800
  620    HB3  PRO  83           3HB      PRO  83  23.087  -2.019 -23.318
  621    HG2  PRO  83           2HG      PRO  83  22.444   0.233 -21.937
  622    HG3  PRO  83           3HG      PRO  83  21.165  -0.801 -22.646
  623    HD2  PRO  83           2HD      PRO  83  22.083  -0.658 -19.780
  624    HD3  PRO  83           3HD      PRO  83  20.425  -0.804 -20.440
  625    H    GLU  84           H        GLU  84  23.453  -3.666 -19.245
  626    HA   GLU  84           HA       GLU  84  25.707  -5.212 -19.973
  627    HB2  GLU  84           2HB      GLU  84  23.990  -5.254 -17.447
  628    HB3  GLU  84           3HB      GLU  84  25.591  -5.972 -17.585
  629    HG2  GLU  84           2HG      GLU  84  24.924  -3.005 -17.862
  630    HG3  GLU  84           3HG      GLU  84  25.631  -3.772 -16.455
  631    H    LYS  85           H        LYS  85  22.302  -6.120 -19.983
  632    HA   LYS  85           HA       LYS  85  23.118  -8.760 -20.938
  633    HB2  LYS  85           2HB      LYS  85  21.366  -9.921 -19.523
  634    HB3  LYS  85           3HB      LYS  85  22.761  -9.333 -18.616
  635    HG2  LYS  85           2HG      LYS  85  21.559  -7.503 -17.688
  636    HG3  LYS  85           3HG      LYS  85  20.237  -7.655 -18.840
  637    HD2  LYS  85           2HD      LYS  85  20.830  -9.829 -16.797
  638    HD3  LYS  85           3HD      LYS  85  19.820  -8.417 -16.439
  639    HE2  LYS  85           2HE      LYS  85  18.436  -9.004 -18.516
  640    HE3  LYS  85           3HE      LYS  85  19.320 -10.522 -18.583
  641    HZ1  LYS  85           3HZ      LYS  85  18.460 -11.044 -16.384
  642    HZ2  LYS  85           1HZ      LYS  85  17.600  -9.603 -16.345
  643    HZ3  LYS  85           2HZ      LYS  85  17.229 -10.738 -17.429
  644    H    LYS  86           H        LYS  86  21.579  -9.764 -22.264
  645    HA   LYS  86           HA       LYS  86  19.535  -8.217 -23.503
  646    HB2  LYS  86           2HB      LYS  86  18.757 -10.404 -24.444
  647    HB3  LYS  86           3HB      LYS  86  20.434  -9.994 -24.719
  648    HG2  LYS  86           2HG      LYS  86  20.594 -12.248 -24.273
  649    HG3  LYS  86           3HG      LYS  86  21.026 -11.551 -22.731
  650    HD2  LYS  86           2HD      LYS  86  19.588 -13.354 -22.228
  651    HD3  LYS  86           3HD      LYS  86  18.586 -11.925 -22.018
  652    HE2  LYS  86           2HE      LYS  86  17.737 -12.279 -24.392
  653    HE3  LYS  86           3HE      LYS  86  18.636 -13.814 -24.421
  654    HZ1  LYS  86           3HZ      LYS  86  17.261 -14.543 -22.529
  655    HZ2  LYS  86           1HZ      LYS  86  16.492 -13.059 -22.566
  656    HZ3  LYS  86           2HZ      LYS  86  16.326 -14.089 -23.819
  657    H    GLU  87           H        GLU  87  17.175  -8.525 -23.408
  658    HA   GLU  87           HA       GLU  87  16.171  -8.408 -20.779
  659    HB2  GLU  87           2HB      GLU  87  14.052  -8.195 -21.757
  660    HB3  GLU  87           3HB      GLU  87  15.178  -7.315 -22.768
  661    HG2  GLU  87           2HG      GLU  87  13.979 -10.073 -23.341
  662    HG3  GLU  87           3HG      GLU  87  13.452  -8.560 -24.051
  663    H    SER  88           H        SER  88  14.919  -9.840 -19.560
  664    HA   SER  88           HA       SER  88  15.671 -12.602 -19.710
  665    HB2  SER  88           2HB      SER  88  13.453 -11.258 -18.131
  666    HB3  SER  88           3HB      SER  88  14.121 -12.869 -17.825
  667    HG   SER  88           HG       SER  88  15.055 -11.210 -16.545
  668    H    LYS  89           H        LYS  89  14.097 -14.422 -19.684
  669    HA   LYS  89           HA       LYS  89  11.569 -14.077 -21.073
  670    HB2  LYS  89           2HB      LYS  89  13.210 -14.521 -22.888
  671    HB3  LYS  89           3HB      LYS  89  13.761 -15.978 -22.047
  672    HG2  LYS  89           2HG      LYS  89  11.514 -16.991 -22.324
  673    HG3  LYS  89           3HG      LYS  89  10.948 -15.511 -23.132
  674    HD2  LYS  89           2HD      LYS  89  12.614 -15.857 -24.931
  675    HD3  LYS  89           3HD      LYS  89  13.192 -17.328 -24.113
  676    HE2  LYS  89           2HE      LYS  89  10.924 -18.333 -24.325
  677    HE3  LYS  89           3HE      LYS  89  10.349 -16.869 -25.139
  678    HZ1  LYS  89           3HZ      LYS  89  11.921 -17.302 -26.905
  679    HZ2  LYS  89           1HZ      LYS  89  12.459 -18.674 -26.158
  680    HZ3  LYS  89           2HZ      LYS  89  10.914 -18.589 -26.718
  681    HA   PRO  90           HA       PRO  90  10.435 -16.483 -17.616
  682    HB2  PRO  90           2HB      PRO  90   8.846 -18.194 -19.537
  683    HB3  PRO  90           3HB      PRO  90   8.377 -17.619 -17.907
  684    HG2  PRO  90           2HG      PRO  90   7.562 -16.232 -20.086
  685    HG3  PRO  90           3HG      PRO  90   8.190 -15.367 -18.649
  686    HD2  PRO  90           2HD      PRO  90   9.569 -15.902 -21.261
  687    HD3  PRO  90           3HD      PRO  90   9.672 -14.476 -20.184
  688    H    ARG  91           H        ARG  91  10.829 -18.326 -16.375
  689    HA   ARG  91           HA       ARG  91  12.063 -20.713 -17.382
  690    HB2  ARG  91           2HB      ARG  91  13.800 -18.473 -17.214
  691    HB3  ARG  91           3HB      ARG  91  14.034 -19.263 -15.681
  692    HG2  ARG  91           2HG      ARG  91  15.668 -20.127 -17.181
  693    HG3  ARG  91           3HG      ARG  91  14.515 -21.427 -16.893
  694    HD2  ARG  91           2HD      ARG  91  15.184 -21.278 -19.292
  695    HD3  ARG  91           3HD      ARG  91  13.460 -21.033 -19.074
  696    HE   ARG  91           HE       ARG  91  13.597 -18.862 -19.719
  697   HH11  ARG  91          1HH1      ARG  91  16.927 -20.199 -19.574
  698   HH12  ARG  91          2HH1      ARG  91  17.670 -18.701 -20.069
  699   HH21  ARG  91          1HH2      ARG  91  14.681 -16.885 -20.219
  700   HH22  ARG  91          2HH2      ARG  91  16.419 -16.858 -20.553
  701    H    LYS  92           H        LYS  92  12.823 -22.082 -15.501
  702    HA   LYS  92           HA       LYS  92  12.177 -21.088 -12.809
  703    HB2  LYS  92           2HB      LYS  92  10.220 -22.398 -13.733
  704    HB3  LYS  92           3HB      LYS  92  11.275 -23.808 -13.886
  705    HG2  LYS  92           2HG      LYS  92  11.556 -23.933 -11.475
  706    HG3  LYS  92           3HG      LYS  92  10.746 -22.369 -11.259
  707    HD2  LYS  92           2HD      LYS  92   8.653 -23.323 -12.185
  708    HD3  LYS  92           3HD      LYS  92   9.435 -24.915 -12.257
  709    HE2  LYS  92           2HE      LYS  92   9.703 -24.952  -9.836
  710    HE3  LYS  92           3HE      LYS  92   9.209 -23.262  -9.696
  711    HZ1  LYS  92           3HZ      LYS  92   7.003 -23.863 -10.413
  712    HZ2  LYS  92           1HZ      LYS  92   7.442 -25.451 -10.585
  713    HZ3  LYS  92           2HZ      LYS  92   7.392 -24.727  -9.104
  714    HA   PRO  93           HA       PRO  93  16.276 -22.654 -12.626
  715    HB2  PRO  93           2HB      PRO  93  16.857 -22.704  -9.946
  716    HB3  PRO  93           3HB      PRO  93  16.504 -21.210 -10.846
  717    HG2  PRO  93           2HG      PRO  93  14.570 -22.859  -9.191
  718    HG3  PRO  93           3HG      PRO  93  14.874 -21.094  -9.102
  719    HD2  PRO  93           2HD      PRO  93  12.824 -22.119 -10.551
  720    HD3  PRO  93           3HD      PRO  93  13.740 -20.697 -11.131
  721    H    LYS  94           H        LYS  94  14.265 -24.836 -12.918
  722    HA   LYS  94           HA       LYS  94  14.935 -27.091 -11.309
  723    HB2  LYS  94           2HB      LYS  94  12.932 -26.861 -12.791
  724    HB3  LYS  94           3HB      LYS  94  13.977 -26.888 -14.209
  725    HG2  LYS  94           2HG      LYS  94  12.891 -29.034 -13.906
  726    HG3  LYS  94           3HG      LYS  94  14.633 -29.214 -13.720
  727    HD2  LYS  94           2HD      LYS  94  14.390 -29.292 -11.262
  728    HD3  LYS  94           3HD      LYS  94  12.637 -29.013 -11.416
  729    HE2  LYS  94           2HE      LYS  94  12.431 -31.126 -12.715
  730    HE3  LYS  94           3HE      LYS  94  14.175 -31.389 -12.565
  731    HZ1  LYS  94           3HZ      LYS  94  13.894 -31.535 -10.177
  732    HZ2  LYS  94           1HZ      LYS  94  12.268 -31.290 -10.309
  733    HZ3  LYS  94           2HZ      LYS  94  12.950 -32.645 -10.933
  734    H    ALA  95           H        ALA  95  16.600 -25.618 -14.063
  735    HA   ALA  95           HA       ALA  95  18.926 -27.317 -13.550
  736    HB1  ALA  95           1HB      ALA  95  17.654 -26.975 -16.310
  737    HB2  ALA  95           2HB      ALA  95  19.234 -27.721 -15.994
  738    HB3  ALA  95           3HB      ALA  95  17.759 -28.491 -15.382
  739    H    ALA  96           H        ALA  96  20.854 -26.358 -14.484
  740    HA   ALA  96           HA       ALA  96  21.111 -23.546 -14.270
  741    HB1  ALA  96           1HB      ALA  96  22.916 -25.580 -15.659
  742    HB2  ALA  96           2HB      ALA  96  23.377 -23.934 -15.189
  743    HB3  ALA  96           3HB      ALA  96  22.985 -25.124 -13.936
  744    H    GLN  97           H        GLN  97  21.940 -22.102 -16.031
  745    HA   GLN  97           HA       GLN  97  20.451 -22.487 -18.577
  746    HB2  GLN  97           2HB      GLN  97  20.574 -19.980 -16.847
  747    HB3  GLN  97           3HB      GLN  97  19.753 -20.132 -18.400
  748    HG2  GLN  97           2HG      GLN  97  19.023 -21.622 -15.829
  749    HG3  GLN  97           3HG      GLN  97  18.183 -20.232 -16.482
  750   HE21  GLN  97          2HE2      GLN  97  17.670 -23.382 -16.101
  751   HE22  GLN  97          1HE2      GLN  97  16.848 -23.751 -17.600
  752    H    VAL  98           H        VAL  98  21.365 -21.354 -20.361
  753    HA   VAL  98           HA       VAL  98  24.039 -20.201 -20.142
  754    HB   VAL  98           HB       VAL  98  24.929 -21.851 -21.817
  755   HG11  VAL  98          1HG1      VAL  98  24.122 -23.121 -19.176
  756   HG12  VAL  98          2HG1      VAL  98  25.388 -23.696 -20.262
  757   HG13  VAL  98          3HG1      VAL  98  25.556 -22.120 -19.467
  758   HG21  VAL  98          3HG2      VAL  98  22.450 -23.505 -21.161
  759   HG22  VAL  98          1HG2      VAL  98  22.842 -22.761 -22.729
  760   HG23  VAL  98          2HG2      VAL  98  23.865 -24.051 -22.085
  761    H    SER  99           H        SER  99  24.793 -19.753 -22.548
  762    HA   SER  99           HA       SER  99  24.520 -18.601 -24.436
  763    HB2  SER  99           2HB      SER  99  21.857 -20.024 -24.729
  764    HB3  SER  99           3HB      SER  99  22.870 -19.345 -26.010
  765    HG   SER  99           HG       SER  99  23.135 -21.615 -25.774
  766    H    GLU 100           H        GLU 100  23.547 -17.380 -21.909
  767    HA   GLU 100           HA       GLU 100  22.144 -15.107 -23.152
  768    HB2  GLU 100           2HB      GLU 100  21.404 -16.552 -20.560
  769    HB3  GLU 100           3HB      GLU 100  20.888 -14.907 -20.940
  770    HG2  GLU 100           2HG      GLU 100  19.717 -15.744 -22.971
  771    HG3  GLU 100           3HG      GLU 100  20.196 -17.392 -22.563
  772    H    GLU 101           H        GLU 101  23.068 -13.156 -22.402
  773    HA   GLU 101           HA       GLU 101  25.587 -13.165 -21.141
  774    HB2  GLU 101           2HB      GLU 101  23.491 -10.971 -21.397
  775    HB3  GLU 101           3HB      GLU 101  25.175 -10.701 -20.909
  776    HG2  GLU 101           2HG      GLU 101  25.958 -11.589 -23.087
  777    HG3  GLU 101           3HG      GLU 101  24.281 -11.829 -23.596
  778    H    ALA 102           H        ALA 102  22.386 -13.136 -19.745
  779    HA   ALA 102           HA       ALA 102  23.081 -12.202 -17.118
  780    HB1  ALA 102           1HB      ALA 102  20.760 -13.943 -18.073
  781    HB2  ALA 102           2HB      ALA 102  20.857 -13.094 -16.521
  782    HB3  ALA 102           3HB      ALA 102  20.779 -12.160 -18.035
  783    H    SER 103           H        SER 103  23.847 -15.181 -18.675
  784    HA   SER 103           HA       SER 103  24.174 -16.583 -16.058
  785    HB2  SER 103           2HB      SER 103  22.968 -17.819 -18.562
  786    HB3  SER 103           3HB      SER 103  23.098 -18.540 -16.954
  787    HG   SER 103           HG       SER 103  21.014 -17.717 -17.418
  788    H    THR 104           H        THR 104  25.617 -15.688 -19.028
  789    HA   THR 104           HA       THR 104  27.826 -17.562 -18.747
  790    HB   THR 104           HB       THR 104  27.207 -17.835 -21.462
  791    HG1  THR 104           1HG      THR 104  25.094 -18.573 -21.509
  792   HG21  THR 104          1HG2      THR 104  26.435 -19.743 -19.222
  793   HG22  THR 104          2HG2      THR 104  26.630 -20.168 -20.940
  794   HG23  THR 104          3HG2      THR 104  28.029 -19.645 -19.996
  795    HA   PRO 105           HA       PRO 105  30.118 -14.239 -20.699
  796    HB2  PRO 105           2HB      PRO 105  31.044 -16.278 -22.725
  797    HB3  PRO 105           3HB      PRO 105  32.015 -15.082 -21.813
  798    HG2  PRO 105           2HG      PRO 105  31.979 -17.693 -21.060
  799    HG3  PRO 105           3HG      PRO 105  31.884 -16.401 -19.823
  800    HD2  PRO 105           2HD      PRO 105  29.634 -18.052 -20.990
  801    HD3  PRO 105           3HD      PRO 105  29.931 -17.584 -19.285
  802    H    GLN 106           H        GLN 106  30.089 -12.871 -22.572
  803    HA   GLN 106           HA       GLN 106  27.688 -12.852 -24.047
  804    HB2  GLN 106           2HB      GLN 106  28.585 -10.862 -25.109
  805    HB3  GLN 106           3HB      GLN 106  28.905 -10.838 -23.378
  806    HG2  GLN 106           2HG      GLN 106  31.267 -11.528 -23.805
  807    HG3  GLN 106           3HG      GLN 106  30.941 -11.549 -25.539
  808   HE21  GLN 106          2HE2      GLN 106  30.536  -9.492 -26.639
  809   HE22  GLN 106          1HE2      GLN 106  31.066  -8.000 -25.880
  810    H    GLY 107           H        GLY 107  30.551 -14.639 -24.743
  811    HA2  GLY 107           2HA      GLY 107  29.473 -15.707 -27.147
  812    HA3  GLY 107           3HA      GLY 107  30.792 -14.583 -27.518
  813    H    PHE 108           H        PHE 108  31.333 -17.063 -28.247
  814    HA   PHE 108           HA       PHE 108  33.415 -17.999 -26.420
  815    HB2  PHE 108           2HB      PHE 108  31.309 -19.237 -25.779
  816    HB3  PHE 108           3HB      PHE 108  31.189 -19.823 -27.434
  817    HD1  PHE 108           HD2      PHE 108  33.745 -19.681 -24.636
  818    HD2  PHE 108           HD1      PHE 108  31.971 -21.995 -27.817
  819    HE1  PHE 108           HE2      PHE 108  35.225 -21.595 -24.083
  820    HE2  PHE 108           HE1      PHE 108  33.448 -23.901 -27.254
  821    HZ   PHE 108           HZ       PHE 108  35.087 -23.700 -25.395
  822    H    ASN 109           H        ASN 109  34.546 -19.940 -27.648
  823    HA   ASN 109           HA       ASN 109  35.862 -18.994 -29.879
  824    HB2  ASN 109           2HB      ASN 109  36.737 -20.839 -28.608
  825    HB3  ASN 109           3HB      ASN 109  35.345 -21.855 -29.001
  826   HD21  ASN 109          2HD2      ASN 109  35.586 -23.244 -30.771
  827   HD22  ASN 109          1HD2      ASN 109  36.779 -23.048 -32.017
  828    H    THR 110           H        THR 110  32.861 -20.975 -30.001
  829    HA   THR 110           HA       THR 110  32.782 -21.624 -32.652
  830    HB   THR 110           HB       THR 110  30.325 -20.666 -31.162
  831    HG1  THR 110           1HG      THR 110  30.405 -22.693 -30.062
  832   HG21  THR 110          1HG2      THR 110  30.893 -23.147 -32.852
  833   HG22  THR 110          2HG2      THR 110  29.329 -22.722 -32.113
  834   HG23  THR 110          3HG2      THR 110  30.010 -21.705 -33.390
  835    H    LEU 111           H        LEU 111  32.202 -18.383 -31.299
  836    HA   LEU 111           HA       LEU 111  30.914 -17.214 -33.548
  837    HB2  LEU 111           2HB      LEU 111  31.017 -16.319 -31.225
  838    HB3  LEU 111           3HB      LEU 111  32.745 -16.014 -31.423
  839    HG   LEU 111           HG       LEU 111  32.278 -14.316 -33.149
  840   HD11  LEU 111          1HD1      LEU 111  29.325 -14.875 -32.572
  841   HD12  LEU 111          2HD1      LEU 111  29.970 -13.564 -33.589
  842   HD13  LEU 111          3HD1      LEU 111  30.166 -15.229 -34.107
  843   HD21  LEU 111          3HD2      LEU 111  30.649 -13.947 -30.601
  844   HD22  LEU 111          1HD2      LEU 111  32.391 -13.633 -30.798
  845   HD23  LEU 111          2HD2      LEU 111  31.211 -12.657 -31.680
  846    H    LYS 112           H        LYS 112  34.248 -18.188 -33.158
  847    HA   LYS 112           HA       LYS 112  35.019 -16.803 -35.655
  848    HB2  LYS 112           2HB      LYS 112  37.080 -15.983 -34.598
  849    HB3  LYS 112           3HB      LYS 112  35.651 -15.307 -33.822
  850    HG2  LYS 112           2HG      LYS 112  35.885 -16.899 -31.934
  851    HG3  LYS 112           3HG      LYS 112  37.284 -17.650 -32.724
  852    HD2  LYS 112           2HD      LYS 112  38.512 -15.505 -32.595
  853    HD3  LYS 112           3HD      LYS 112  37.107 -14.747 -31.805
  854    HE2  LYS 112           2HE      LYS 112  37.277 -16.381 -29.943
  855    HE3  LYS 112           3HE      LYS 112  38.664 -17.149 -30.732
  856    HZ1  LYS 112           3HZ      LYS 112  39.877 -15.079 -30.488
  857    HZ2  LYS 112           1HZ      LYS 112  38.593 -14.353 -29.755
  858    HZ3  LYS 112           2HZ      LYS 112  39.359 -15.608 -29.023
  859    H    ASP 113           H        ASP 113  34.566 -19.712 -34.486
  860    HA   ASP 113           HA       ASP 113  37.092 -21.012 -34.457
  861    HB2  ASP 113           2HB      ASP 113  34.998 -21.912 -33.480
  862    HB3  ASP 113           3HB      ASP 113  34.349 -22.169 -35.098
  863    H    LYS 114           H        LYS 114  34.960 -20.120 -37.085
  864    HA   LYS 114           HA       LYS 114  37.065 -20.855 -39.023
  865    HB2  LYS 114           2HB      LYS 114  34.040 -21.224 -39.296
  866    HB3  LYS 114           3HB      LYS 114  35.121 -21.200 -40.681
  867    HG2  LYS 114           2HG      LYS 114  35.130 -23.265 -38.444
  868    HG3  LYS 114           3HG      LYS 114  34.572 -23.470 -40.103
  869    HD2  LYS 114           2HD      LYS 114  37.132 -22.672 -40.620
  870    HD3  LYS 114           3HD      LYS 114  37.364 -23.341 -39.008
  871    HE2  LYS 114           2HE      LYS 114  37.849 -25.081 -40.536
  872    HE3  LYS 114           3HE      LYS 114  36.276 -25.476 -39.819
  873    HZ1  LYS 114           3HZ      LYS 114  35.257 -24.555 -41.829
  874    HZ2  LYS 114           1HZ      LYS 114  36.690 -24.155 -42.462
  875    HZ3  LYS 114           2HZ      LYS 114  36.299 -25.761 -42.240
  876    H    LEU 115           H        LEU 115  36.686 -19.521 -41.073
  877    HA   LEU 115           HA       LEU 115  35.645 -16.792 -40.427
  878    HB2  LEU 115           2HB      LEU 115  38.021 -16.964 -39.898
  879    HB3  LEU 115           3HB      LEU 115  38.401 -17.531 -41.509
  880    HG   LEU 115           HG       LEU 115  38.972 -15.144 -40.870
  881   HD11  LEU 115          1HD1      LEU 115  37.372 -15.492 -43.423
  882   HD12  LEU 115          2HD1      LEU 115  38.456 -14.149 -43.058
  883   HD13  LEU 115          3HD1      LEU 115  39.097 -15.796 -43.188
  884   HD21  LEU 115          3HD2      LEU 115  35.996 -14.643 -41.205
  885   HD22  LEU 115          1HD2      LEU 115  36.964 -14.471 -39.721
  886   HD23  LEU 115          2HD2      LEU 115  37.253 -13.410 -41.109
  887    H    GLU 116           H        GLU 116  36.216 -19.341 -42.746
  888    HA   GLU 116           HA       GLU 116  36.242 -18.003 -45.148
  889    HB2  GLU 116           2HB      GLU 116  34.924 -20.700 -44.621
  890    HB3  GLU 116           3HB      GLU 116  35.552 -20.099 -46.152
  891    HG2  GLU 116           2HG      GLU 116  37.317 -21.417 -45.562
  892    HG3  GLU 116           3HG      GLU 116  37.844 -19.924 -44.799
  893    H    GLU 117           H        GLU 117  33.318 -18.953 -43.294
  894    HA   GLU 117           HA       GLU 117  31.493 -18.203 -45.361
  895    HB2  GLU 117           2HB      GLU 117  29.777 -18.670 -43.760
  896    HB3  GLU 117           3HB      GLU 117  31.033 -19.902 -43.650
  897    HG2  GLU 117           2HG      GLU 117  31.972 -18.721 -41.633
  898    HG3  GLU 117           3HG      GLU 117  30.637 -17.569 -41.741
  899    H    TRP 118           H        TRP 118  33.394 -16.215 -43.485
  900    HA   TRP 118           HA       TRP 118  31.620 -13.872 -43.924
  901    HB2  TRP 118           2HB      TRP 118  33.424 -14.417 -41.530
  902    HB3  TRP 118           3HB      TRP 118  32.459 -12.968 -41.782
  903    HD1  TRP 118           HD1      TRP 118  29.661 -13.769 -42.185
  904    HE1  TRP 118           HE1      TRP 118  28.281 -15.086 -40.483
  905    HE3  TRP 118           HE3      TRP 118  33.468 -16.020 -39.600
  906    HZ2  TRP 118           HZ2      TRP 118  28.757 -16.861 -38.251
  907    HZ3  TRP 118           HZ3      TRP 118  32.975 -17.510 -37.696
  908    HH2  TRP 118           HH2      TRP 118  30.633 -17.939 -37.009
  909    H    ILE 119           H        ILE 119  34.197 -15.235 -45.215
  910    HA   ILE 119           HA       ILE 119  36.356 -13.488 -44.787
  911    HB   ILE 119           HB       ILE 119  36.385 -15.801 -45.739
  912   HG12  ILE 119          2HG1      ILE 119  37.934 -13.802 -47.418
  913   HG13  ILE 119          3HG1      ILE 119  38.333 -14.238 -45.749
  914   HG21  ILE 119          1HG2      ILE 119  35.609 -14.433 -48.348
  915   HG22  ILE 119          2HG2      ILE 119  36.125 -16.122 -48.200
  916   HG23  ILE 119          3HG2      ILE 119  34.626 -15.598 -47.457
  917   HD11  ILE 119          3HD1      ILE 119  38.642 -16.603 -46.412
  918   HD12  ILE 119          1HD1      ILE 119  38.285 -16.182 -48.104
  919   HD13  ILE 119          2HD1      ILE 119  39.711 -15.510 -47.320
  920    H    GLU 120           H        GLU 120  37.300 -11.857 -46.081
  921    HA   GLU 120           HA       GLU 120  35.463  -9.842 -46.765
  922    HB2  GLU 120           2HB      GLU 120  37.486  -8.522 -47.289
  923    HB3  GLU 120           3HB      GLU 120  37.581  -9.354 -45.738
  924    HG2  GLU 120           2HG      GLU 120  39.026 -11.112 -46.763
  925    HG3  GLU 120           3HG      GLU 120  38.932 -10.285 -48.313
  926    H    MET 121           H        MET 121  36.897 -12.258 -48.783
  927    HA   MET 121           HA       MET 121  36.883 -12.701 -51.004
  928    HB2  MET 121           2HB      MET 121  34.267 -11.141 -50.942
  929    HB3  MET 121           3HB      MET 121  34.792 -12.224 -52.235
  930    HG2  MET 121           2HG      MET 121  34.855 -14.109 -50.632
  931    HG3  MET 121           3HG      MET 121  34.252 -13.022 -49.368
  932    HE1  MET 121           3HE      MET 121  32.904 -15.780 -49.922
  933    HE2  MET 121           1HE      MET 121  32.317 -14.607 -48.721
  934    HE3  MET 121           2HE      MET 121  31.186 -15.327 -49.888
  935    H    SER 122           H        SER 122  38.326 -10.206 -50.193
  936    HA   SER 122           HA       SER 122  37.943  -8.180 -52.082
  937    HB2  SER 122           2HB      SER 122  40.455  -8.953 -50.559
  938    HB3  SER 122           3HB      SER 122  40.140  -7.383 -51.337
  939    HG   SER 122           HG       SER 122  39.596  -7.644 -49.005
  940    H    ASN 123           H        ASN 123  39.294 -11.297 -52.689
  941    HA   ASN 123           HA       ASN 123  41.022 -10.871 -54.852
  942    HB2  ASN 123           2HB      ASN 123  40.482 -13.083 -53.898
  943    HB3  ASN 123           3HB      ASN 123  38.842 -12.977 -54.557
  944   HD21  ASN 123          2HD2      ASN 123  38.578 -14.038 -56.514
  945   HD22  ASN 123          1HD2      ASN 123  39.885 -14.296 -57.649
  946    H    ARG 124           H        ARG 124  37.518 -10.310 -54.772
  947    HA   ARG 124           HA       ARG 124  37.105 -10.136 -57.586
  948    HB2  ARG 124           2HB      ARG 124  35.039  -9.069 -57.042
  949    HB3  ARG 124           3HB      ARG 124  35.344 -10.268 -55.787
  950    HG2  ARG 124           2HG      ARG 124  36.247  -8.371 -54.328
  951    HG3  ARG 124           3HG      ARG 124  35.694  -7.241 -55.573
  952    HD2  ARG 124           2HD      ARG 124  33.381  -8.094 -55.327
  953    HD3  ARG 124           3HD      ARG 124  33.914  -9.225 -54.086
  954    HE   ARG 124           HE       ARG 124  33.460  -6.355 -53.837
  955   HH11  ARG 124          1HH1      ARG 124  35.126  -9.121 -52.354
  956   HH12  ARG 124          2HH1      ARG 124  35.084  -8.506 -50.742
  957   HH21  ARG 124          1HH2      ARG 124  33.372  -5.494 -51.691
  958   HH22  ARG 124          2HH2      ARG 124  34.074  -6.395 -50.386
  959    H    LYS 125           H        LYS 125  38.911  -7.937 -55.581
  960    HA   LYS 125           HA       LYS 125  38.372  -5.496 -56.930
  961    HB2  LYS 125           2HB      LYS 125  39.540  -5.820 -54.716
  962    HB3  LYS 125           3HB      LYS 125  40.946  -6.454 -55.586
  963    HG2  LYS 125           2HG      LYS 125  41.247  -4.280 -56.709
  964    HG3  LYS 125           3HG      LYS 125  39.774  -3.654 -55.945
  965    HD2  LYS 125           2HD      LYS 125  40.789  -3.839 -53.728
  966    HD3  LYS 125           3HD      LYS 125  42.230  -4.624 -54.416
  967    HE2  LYS 125           2HE      LYS 125  42.713  -2.603 -55.758
  968    HE3  LYS 125           3HE      LYS 125  41.280  -1.803 -55.087
  969    HZ1  LYS 125           3HZ      LYS 125  42.298  -1.950 -52.906
  970    HZ2  LYS 125           1HZ      LYS 125  43.636  -2.690 -53.539
  971    HZ3  LYS 125           2HZ      LYS 125  43.279  -1.131 -53.932
  972    H    ASP 126           H        ASP 126  39.467  -4.437 -58.632
  973    HA   ASP 126           HA       ASP 126  40.054  -5.970 -60.891
  974    HB2  ASP 126           2HB      ASP 126  39.285  -3.638 -60.961
  975    HB3  ASP 126           3HB      ASP 126  40.793  -3.093 -60.228
  976    H    LEU 127           H        LEU 127  42.272  -4.614 -58.470
  977    HA   LEU 127           HA       LEU 127  44.320  -6.499 -59.364
  978    HB2  LEU 127           2HB      LEU 127  44.919  -4.448 -60.564
  979    HB3  LEU 127           3HB      LEU 127  44.780  -3.502 -59.082
  980    HG   LEU 127           HG       LEU 127  46.715  -4.739 -58.105
  981   HD11  LEU 127          1HD1      LEU 127  46.945  -6.025 -60.857
  982   HD12  LEU 127          2HD1      LEU 127  48.138  -6.157 -59.545
  983   HD13  LEU 127          3HD1      LEU 127  46.536  -6.882 -59.366
  984   HD21  LEU 127          3HD2      LEU 127  47.248  -3.486 -60.824
  985   HD22  LEU 127          1HD2      LEU 127  47.089  -2.623 -59.289
  986   HD23  LEU 127          2HD2      LEU 127  48.460  -3.722 -59.540
  987    H    ILE 128           H        ILE 128  45.131  -7.484 -57.588
  988    HA   ILE 128           HA       ILE 128  45.527  -6.134 -55.049
  989    HB   ILE 128           HB       ILE 128  43.189  -6.784 -54.887
  990   HG12  ILE 128          2HG1      ILE 128  44.836  -8.686 -53.192
  991   HG13  ILE 128          3HG1      ILE 128  44.706  -6.943 -52.910
  992   HG21  ILE 128          1HG2      ILE 128  44.058  -9.640 -55.505
  993   HG22  ILE 128          2HG2      ILE 128  42.434  -9.144 -54.992
  994   HG23  ILE 128          3HG2      ILE 128  43.045  -8.599 -56.528
  995   HD11  ILE 128          3HD1      ILE 128  42.258  -7.155 -52.604
  996   HD12  ILE 128          1HD1      ILE 128  42.377  -8.914 -52.843
  997   HD13  ILE 128          2HD1      ILE 128  43.165  -8.167 -51.458
  998    H    LYS 129           H        LYS 129  46.950  -7.435 -53.662
  999    HA   LYS 129           HA       LYS 129  48.330  -9.684 -54.952
 1000    HB2  LYS 129           2HB      LYS 129  49.677  -7.132 -53.939
 1001    HB3  LYS 129           3HB      LYS 129  50.524  -8.621 -54.372
 1002    HG2  LYS 129           2HG      LYS 129  49.648  -8.416 -56.717
 1003    HG3  LYS 129           3HG      LYS 129  48.906  -6.865 -56.278
 1004    HD2  LYS 129           2HD      LYS 129  51.135  -5.961 -55.678
 1005    HD3  LYS 129           3HD      LYS 129  51.881  -7.507 -56.146
 1006    HE2  LYS 129           2HE      LYS 129  50.984  -7.231 -58.452
 1007    HE3  LYS 129           3HE      LYS 129  50.255  -5.688 -57.985
 1008    HZ1  LYS 129           3HZ      LYS 129  52.482  -4.840 -57.554
 1009    HZ2  LYS 129           1HZ      LYS 129  53.156  -6.282 -57.979
 1010    HZ3  LYS 129           2HZ      LYS 129  52.364  -5.378 -59.100
 1011    H    LYS 130           H        LYS 130  49.753 -10.766 -53.333
 1012    HA   LYS 130           HA       LYS 130  48.555 -11.171 -50.773
 1013    HB2  LYS 130           2HB      LYS 130  51.434 -11.690 -51.669
 1014    HB3  LYS 130           3HB      LYS 130  50.663 -12.360 -50.240
 1015    HG2  LYS 130           2HG      LYS 130  49.901 -12.970 -53.136
 1016    HG3  LYS 130           3HG      LYS 130  50.820 -14.013 -52.054
 1017    HD2  LYS 130           2HD      LYS 130  48.834 -14.143 -50.528
 1018    HD3  LYS 130           3HD      LYS 130  47.906 -13.184 -51.706
 1019    HE2  LYS 130           2HE      LYS 130  48.322 -14.906 -53.443
 1020    HE3  LYS 130           3HE      LYS 130  49.248 -15.866 -52.277
 1021    HZ1  LYS 130           3HZ      LYS 130  47.236 -16.086 -50.960
 1022    HZ2  LYS 130           1HZ      LYS 130  46.382 -15.190 -52.043
 1023    HZ3  LYS 130           2HZ      LYS 130  46.975 -16.662 -52.483
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1  -0.510 -20.547   1.500
    2    H2   MET   1           H2       MET   1  -2.021 -21.105   1.829
    3    H3   MET   1           H3       MET   1  -1.723 -19.445   1.383
    4    HA   MET   1           HA       MET   1  -2.427 -21.597  -0.181
    5    HB2  MET   1           2HB      MET   1  -3.147 -19.175  -0.380
    6    HB3  MET   1           3HB      MET   1  -1.522 -18.818  -1.011
    7    HG2  MET   1           2HG      MET   1  -1.912 -20.519  -2.797
    8    HG3  MET   1           3HG      MET   1  -3.579 -20.696  -2.204
    9    HE1  MET   1           3HE      MET   1  -1.151 -17.604  -2.997
   10    HE2  MET   1           1HE      MET   1  -1.077 -18.701  -4.396
   11    HE3  MET   1           2HE      MET   1  -1.827 -17.095  -4.563
   12    H    ALA   2           H        ALA   2  -1.110 -23.162  -0.897
   13    HA   ALA   2           HA       ALA   2   1.711 -22.943  -1.209
   14    HB1  ALA   2           1HB      ALA   2  -0.268 -24.775  -2.628
   15    HB2  ALA   2           2HB      ALA   2   1.492 -25.017  -2.528
   16    HB3  ALA   2           3HB      ALA   2   0.498 -25.093  -1.053
   17    H    ALA   3           H        ALA   3   2.980 -22.870  -3.072
   18    HA   ALA   3           HA       ALA   3   1.806 -21.573  -5.512
   19    HB1  ALA   3           1HB      ALA   3   4.463 -20.958  -4.144
   20    HB2  ALA   3           2HB      ALA   3   3.885 -20.246  -5.670
   21    HB3  ALA   3           3HB      ALA   3   3.028 -19.905  -4.148
   22    H    LYS   4           H        LYS   4   3.328 -21.746  -7.355
   23    HA   LYS   4           HA       LYS   4   4.707 -24.404  -7.551
   24    HB2  LYS   4           2HB      LYS   4   3.462 -24.850  -9.599
   25    HB3  LYS   4           3HB      LYS   4   2.398 -24.742  -8.178
   26    HG2  LYS   4           2HG      LYS   4   1.879 -22.343  -8.894
   27    HG3  LYS   4           3HG      LYS   4   2.730 -22.699 -10.416
   28    HD2  LYS   4           2HD      LYS   4   1.146 -24.480 -10.944
   29    HD3  LYS   4           3HD      LYS   4   0.360 -24.305  -9.357
   30    HE2  LYS   4           2HE      LYS   4  -0.185 -21.927  -9.973
   31    HE3  LYS   4           3HE      LYS   4   0.446 -22.258 -11.603
   32    HZ1  LYS   4           3HZ      LYS   4  -1.239 -23.948 -11.839
   33    HZ2  LYS   4           1HZ      LYS   4  -1.824 -23.643 -10.327
   34    HZ3  LYS   4           2HZ      LYS   4  -1.940 -22.491 -11.506
   35    H    PHE   5           H        PHE   5   5.448 -21.490  -7.526
   36    HA   PHE   5           HA       PHE   5   7.562 -21.807  -9.613
   37    HB2  PHE   5           2HB      PHE   5   5.866 -19.344  -9.009
   38    HB3  PHE   5           3HB      PHE   5   7.548 -19.199  -9.569
   39    HD1  PHE   5           HD2      PHE   5   4.265 -20.795 -10.446
   40    HD2  PHE   5           HD1      PHE   5   8.008 -19.150 -11.841
   41    HE1  PHE   5           HE2      PHE   5   3.602 -21.283 -12.801
   42    HE2  PHE   5           HE1      PHE   5   7.326 -19.597 -14.198
   43    HZ   PHE   5           HZ       PHE   5   5.143 -20.709 -14.675
   44    H    GLU   6           H        GLU   6   9.518 -20.498  -8.938
   45    HA   GLU   6           HA       GLU   6   9.940 -20.434  -5.982
   46    HB2  GLU   6           2HB      GLU   6  10.351 -22.732  -6.907
   47    HB3  GLU   6           3HB      GLU   6  11.602 -22.025  -7.955
   48    HG2  GLU   6           2HG      GLU   6  12.944 -21.386  -6.023
   49    HG3  GLU   6           3HG      GLU   6  11.627 -21.856  -4.923
   50    H    VAL   7           H        VAL   7  11.798 -19.274  -5.392
   51    HA   VAL   7           HA       VAL   7  12.352 -16.876  -6.756
   52    HB   VAL   7           HB       VAL   7  14.252 -16.655  -5.193
   53   HG11  VAL   7          1HG1      VAL   7  11.808 -17.984  -3.924
   54   HG12  VAL   7          2HG1      VAL   7  12.981 -16.948  -3.077
   55   HG13  VAL   7          3HG1      VAL   7  11.948 -16.263  -4.354
   56   HG21  VAL   7          3HG2      VAL   7  13.784 -19.532  -4.401
   57   HG22  VAL   7          1HG2      VAL   7  15.206 -18.888  -5.254
   58   HG23  VAL   7          2HG2      VAL   7  14.857 -18.367  -3.589
   59    H    GLY   8           H        GLY   8  13.488 -16.122  -8.210
   60    HA2  GLY   8           2HA      GLY   8  15.326 -15.944  -9.662
   61    HA3  GLY   8           3HA      GLY   8  15.718 -17.656  -9.377
   62    H    SER   9           H        SER   9  12.658 -18.235  -9.903
   63    HA   SER   9           HA       SER   9  12.784 -18.769 -12.707
   64    HB2  SER   9           2HB      SER   9  10.274 -18.358 -11.055
   65    HB3  SER   9           3HB      SER   9  10.463 -19.327 -12.536
   66    HG   SER   9           HG       SER   9  10.468 -20.621 -10.620
   67    H    VAL  10           H        VAL  10  11.699 -17.745 -14.463
   68    HA   VAL  10           HA       VAL  10  10.728 -14.953 -13.975
   69    HB   VAL  10           HB       VAL  10  12.067 -16.045 -16.483
   70   HG11  VAL  10          1HG1      VAL  10  11.277 -13.198 -15.694
   71   HG12  VAL  10          2HG1      VAL  10  12.140 -13.659 -17.180
   72   HG13  VAL  10          3HG1      VAL  10  10.463 -14.196 -16.922
   73   HG21  VAL  10          3HG2      VAL  10  13.193 -14.149 -14.382
   74   HG22  VAL  10          1HG2      VAL  10  13.728 -15.820 -14.680
   75   HG23  VAL  10          2HG2      VAL  10  13.972 -14.573 -15.925
   76    H    TYR  11           H        TYR  11   8.839 -14.431 -14.793
   77    HA   TYR  11           HA       TYR  11   7.133 -16.404 -16.234
   78    HB2  TYR  11           2HB      TYR  11   7.211 -16.593 -13.690
   79    HB3  TYR  11           3HB      TYR  11   6.260 -15.089 -13.680
   80    HD1  TYR  11           HD2      TYR  11   5.214 -17.121 -16.486
   81    HD2  TYR  11           HD1      TYR  11   4.886 -16.747 -12.193
   82    HE1  TYR  11           HE2      TYR  11   3.118 -18.467 -16.533
   83    HE2  TYR  11           HE1      TYR  11   2.788 -18.091 -12.233
   84    HH   TYR  11           HH       TYR  11   1.342 -19.312 -13.512
   85    H    THR  12           H        THR  12   4.816 -15.173 -16.257
   86    HA   THR  12           HA       THR  12   5.155 -12.265 -16.819
   87    HB   THR  12           HB       THR  12   3.836 -14.230 -18.722
   88    HG1  THR  12           1HG      THR  12   5.667 -13.827 -20.060
   89   HG21  THR  12          1HG2      THR  12   4.668 -11.313 -19.062
   90   HG22  THR  12          2HG2      THR  12   3.932 -12.335 -20.319
   91   HG23  THR  12          3HG2      THR  12   2.999 -11.900 -18.868
   92    H    GLY  13           H        GLY  13   3.298 -11.126 -16.295
   93    HA2  GLY  13           2HA      GLY  13   0.834 -12.556 -15.543
   94    HA3  GLY  13           3HA      GLY  13   1.719 -11.739 -14.235
   95    H    LYS  14           H        LYS  14  -0.602 -10.791 -14.362
   96    HA   LYS  14           HA       LYS  14  -0.669  -8.373 -16.145
   97    HB2  LYS  14           2HB      LYS  14  -2.258 -10.387 -16.534
   98    HB3  LYS  14           3HB      LYS  14  -3.069  -9.821 -15.056
   99    HG2  LYS  14           2HG      LYS  14  -2.606  -8.151 -17.533
  100    HG3  LYS  14           3HG      LYS  14  -4.098  -9.064 -17.207
  101    HD2  LYS  14           2HD      LYS  14  -3.016  -6.674 -15.695
  102    HD3  LYS  14           3HD      LYS  14  -4.465  -6.730 -16.725
  103    HE2  LYS  14           2HE      LYS  14  -4.131  -8.268 -14.121
  104    HE3  LYS  14           3HE      LYS  14  -4.949  -6.694 -14.256
  105    HZ1  LYS  14           3HZ      LYS  14  -6.546  -7.723 -15.727
  106    HZ2  LYS  14           1HZ      LYS  14  -5.788  -9.183 -15.603
  107    HZ3  LYS  14           2HZ      LYS  14  -6.516  -8.515 -14.281
  108    H    VAL  15           H        VAL  15  -0.543  -6.542 -15.061
  109    HA   VAL  15           HA       VAL  15  -0.273  -6.479 -12.185
  110    HB   VAL  15           HB       VAL  15  -0.779  -4.118 -14.022
  111   HG11  VAL  15          1HG1      VAL  15   0.878  -4.465 -11.477
  112   HG12  VAL  15          2HG1      VAL  15   0.705  -2.955 -12.402
  113   HG13  VAL  15          3HG1      VAL  15  -0.706  -3.661 -11.580
  114   HG21  VAL  15          3HG2      VAL  15   1.882  -5.491 -13.595
  115   HG22  VAL  15          1HG2      VAL  15   0.955  -5.422 -15.111
  116   HG23  VAL  15          2HG2      VAL  15   1.622  -3.931 -14.410
  117    H    THR  16           H        THR  16  -1.728  -6.409 -10.695
  118    HA   THR  16           HA       THR  16  -4.592  -5.946 -11.404
  119    HB   THR  16           HB       THR  16  -4.782  -7.101  -9.042
  120    HG1  THR  16           1HG      THR  16  -3.017  -8.541  -8.707
  121   HG21  THR  16          1HG2      THR  16  -3.814  -8.618 -11.507
  122   HG22  THR  16          2HG2      THR  16  -4.706  -9.322 -10.137
  123   HG23  THR  16          3HG2      THR  16  -5.492  -8.121 -11.187
  124    H    GLY  17           H        GLY  17  -2.037  -4.352  -9.634
  125    HA2  GLY  17           2HA      GLY  17  -3.733  -2.082  -9.306
  126    HA3  GLY  17           3HA      GLY  17  -3.564  -2.921  -7.747
  127    H    LEU  18           H        LEU  18  -2.657  -0.391  -7.975
  128    HA   LEU  18           HA       LEU  18   0.308  -0.704  -7.768
  129    HB2  LEU  18           2HB      LEU  18  -1.251   1.714  -8.647
  130    HB3  LEU  18           3HB      LEU  18   0.502   1.691  -8.344
  131    HG   LEU  18           HG       LEU  18  -0.969   0.243 -10.600
  132   HD11  LEU  18          1HD1      LEU  18   1.044   2.542 -10.610
  133   HD12  LEU  18          2HD1      LEU  18   0.344   1.771 -12.053
  134   HD13  LEU  18          3HD1      LEU  18  -0.698   2.688 -10.941
  135   HD21  LEU  18          3HD2      LEU  18   1.997   0.265 -10.006
  136   HD22  LEU  18          1HD2      LEU  18   0.900  -1.127  -9.850
  137   HD23  LEU  18          2HD2      LEU  18   1.214  -0.418 -11.451
  138    H    GLN  19           H        GLN  19   1.227   0.548  -6.179
  139    HA   GLN  19           HA       GLN  19  -0.410   1.873  -4.082
  140    HB2  GLN  19           2HB      GLN  19   1.752  -0.168  -3.532
  141    HB3  GLN  19           3HB      GLN  19   0.822   0.757  -2.331
  142    HG2  GLN  19           2HG      GLN  19  -1.237  -0.439  -2.992
  143    HG3  GLN  19           3HG      GLN  19  -0.334  -1.397  -4.189
  144   HE21  GLN  19          2HE2      GLN  19   1.592  -2.667  -3.278
  145   HE22  GLN  19          1HE2      GLN  19   1.376  -3.391  -1.697
  146    H    ALA  20           H        ALA  20   1.134   3.239  -2.707
  147    HA   ALA  20           HA       ALA  20   2.982   4.689  -4.258
  148    HB1  ALA  20           1HB      ALA  20   2.766   4.513  -1.224
  149    HB2  ALA  20           2HB      ALA  20   3.560   5.815  -2.142
  150    HB3  ALA  20           3HB      ALA  20   1.801   5.577  -2.275
  151    H    TYR  21           H        TYR  21   3.524   1.639  -2.790
  152    HA   TYR  21           HA       TYR  21   6.490   1.917  -3.132
  153    HB2  TYR  21           2HB      TYR  21   5.470   2.044  -0.718
  154    HB3  TYR  21           3HB      TYR  21   5.249   0.293  -0.935
  155    HD1  TYR  21           HD2      TYR  21   7.833   3.013  -1.031
  156    HD2  TYR  21           HD1      TYR  21   7.061  -1.205  -0.519
  157    HE1  TYR  21           HE2      TYR  21  10.220   2.659  -0.393
  158    HE2  TYR  21           HE1      TYR  21   9.449  -1.575   0.106
  159    HH   TYR  21           HH       TYR  21  11.510  -0.574   0.466
  160    H    GLY  22           H        GLY  22   3.984   0.447  -4.618
  161    HA2  GLY  22           2HA      GLY  22   5.660  -1.319  -5.947
  162    HA3  GLY  22           3HA      GLY  22   4.951  -2.257  -4.612
  163    H    ALA  23           H        ALA  23   4.379  -3.301  -6.871
  164    HA   ALA  23           HA       ALA  23   1.591  -2.483  -7.671
  165    HB1  ALA  23           1HB      ALA  23   3.856  -3.485  -9.441
  166    HB2  ALA  23           2HB      ALA  23   2.177  -3.196  -9.955
  167    HB3  ALA  23           3HB      ALA  23   3.195  -1.833  -9.433
  168    H    PHE  24           H        PHE  24   0.144  -4.086  -7.482
  169    HA   PHE  24           HA       PHE  24   1.038  -6.799  -6.808
  170    HB2  PHE  24           2HB      PHE  24  -1.741  -5.587  -7.229
  171    HB3  PHE  24           3HB      PHE  24  -1.404  -7.269  -6.759
  172    HD1  PHE  24           HD2      PHE  24   0.382  -7.362  -4.657
  173    HD2  PHE  24           HD1      PHE  24  -2.460  -4.224  -5.536
  174    HE1  PHE  24           HE2      PHE  24   0.330  -6.730  -2.245
  175    HE2  PHE  24           HE1      PHE  24  -2.533  -3.616  -3.120
  176    HZ   PHE  24           HZ       PHE  24  -1.154  -4.880  -1.471
  177    H    VAL  25           H        VAL  25   0.786  -8.614  -8.148
  178    HA   VAL  25           HA       VAL  25  -0.142  -8.212 -10.965
  179    HB   VAL  25           HB       VAL  25   2.476  -9.557 -10.181
  180   HG11  VAL  25          1HG1      VAL  25   1.324  -8.770 -12.900
  181   HG12  VAL  25          2HG1      VAL  25   2.915  -9.517 -12.625
  182   HG13  VAL  25          3HG1      VAL  25   1.432 -10.427 -12.259
  183   HG21  VAL  25          3HG2      VAL  25   2.136  -6.834 -11.466
  184   HG22  VAL  25          1HG2      VAL  25   2.763  -7.165  -9.834
  185   HG23  VAL  25          2HG2      VAL  25   3.669  -7.713 -11.262
  186    H    ALA  26           H        ALA  26  -1.549  -9.747 -11.457
  187    HA   ALA  26           HA       ALA  26  -1.680 -12.319  -9.936
  188    HB1  ALA  26           1HB      ALA  26  -3.305 -11.187 -12.248
  189    HB2  ALA  26           2HB      ALA  26  -3.622 -12.719 -11.400
  190    HB3  ALA  26           3HB      ALA  26  -3.783 -11.174 -10.534
  191    H    LEU  27           H        LEU  27  -1.030 -14.237 -10.762
  192    HA   LEU  27           HA       LEU  27   0.478 -14.156 -13.364
  193    HB2  LEU  27           2HB      LEU  27   1.130 -15.420 -10.705
  194    HB3  LEU  27           3HB      LEU  27   1.993 -15.835 -12.203
  195    HG   LEU  27           HG       LEU  27   1.822 -12.967 -11.232
  196   HD11  LEU  27          1HD1      LEU  27   3.979 -15.002 -10.510
  197   HD12  LEU  27          2HD1      LEU  27   4.039 -13.258 -10.164
  198   HD13  LEU  27          3HD1      LEU  27   2.813 -14.279  -9.377
  199   HD21  LEU  27          3HD2      LEU  27   3.818 -14.434 -12.982
  200   HD22  LEU  27          1HD2      LEU  27   2.549 -13.322 -13.532
  201   HD23  LEU  27          2HD2      LEU  27   3.887 -12.715 -12.536
  202    H    ASP  28           H        ASP  28  -1.503 -16.004 -11.153
  203    HA   ASP  28           HA       ASP  28  -2.719 -17.561 -13.310
  204    HB2  ASP  28           2HB      ASP  28  -0.663 -18.847 -12.849
  205    HB3  ASP  28           3HB      ASP  28  -1.125 -18.980 -11.136
  206    H    GLU  29           H        GLU  29  -4.554 -18.867 -12.325
  207    HA   GLU  29           HA       GLU  29  -6.064 -17.699 -10.245
  208    HB2  GLU  29           2HB      GLU  29  -5.889 -20.528 -11.320
  209    HB3  GLU  29           3HB      GLU  29  -7.116 -19.998 -10.145
  210    HG2  GLU  29           2HG      GLU  29  -7.892 -18.265 -11.783
  211    HG3  GLU  29           3HG      GLU  29  -6.680 -18.873 -12.935
  212    H    GLU  30           H        GLU  30  -3.241 -19.701  -9.948
  213    HA   GLU  30           HA       GLU  30  -3.596 -19.850  -6.968
  214    HB2  GLU  30           2HB      GLU  30  -2.090 -21.743  -8.786
  215    HB3  GLU  30           3HB      GLU  30  -2.323 -21.897  -7.029
  216    HG2  GLU  30           2HG      GLU  30  -4.771 -22.212  -7.398
  217    HG3  GLU  30           3HG      GLU  30  -4.495 -22.079  -9.151
  218    H    THR  31           H        THR  31  -2.122 -17.797  -8.913
  219    HA   THR  31           HA       THR  31   0.310 -17.641  -7.227
  220    HB   THR  31           HB       THR  31   0.531 -17.691 -10.251
  221    HG1  THR  31           1HG      THR  31   1.413 -19.814  -9.958
  222   HG21  THR  31          1HG2      THR  31   2.615 -18.065  -8.055
  223   HG22  THR  31          2HG2      THR  31   2.929 -18.125  -9.805
  224   HG23  THR  31          3HG2      THR  31   2.405 -16.603  -9.047
  225    H    GLN  32           H        GLN  32   0.743 -15.611  -6.740
  226    HA   GLN  32           HA       GLN  32  -0.107 -13.260  -8.312
  227    HB2  GLN  32           2HB      GLN  32  -2.097 -14.256  -7.055
  228    HB3  GLN  32           3HB      GLN  32  -1.250 -13.757  -5.573
  229    HG2  GLN  32           2HG      GLN  32  -2.048 -11.800  -7.761
  230    HG3  GLN  32           3HG      GLN  32  -3.109 -12.219  -6.397
  231   HE21  GLN  32          2HE2      GLN  32  -0.895  -9.987  -7.500
  232   HE22  GLN  32          1HE2      GLN  32  -0.383  -9.317  -5.964
  233    H    GLY  33           H        GLY  33   1.209 -11.442  -7.555
  234    HA2  GLY  33           2HA      GLY  33   2.599 -11.689  -5.000
  235    HA3  GLY  33           3HA      GLY  33   3.635 -11.798  -6.442
  236    H    LEU  34           H        LEU  34   4.550  -9.931  -5.231
  237    HA   LEU  34           HA       LEU  34   3.270  -7.299  -5.884
  238    HB2  LEU  34           2HB      LEU  34   2.795  -7.693  -3.613
  239    HB3  LEU  34           3HB      LEU  34   4.428  -8.315  -3.279
  240    HG   LEU  34           HG       LEU  34   5.360  -6.047  -3.634
  241   HD11  LEU  34          1HD1      LEU  34   2.451  -5.134  -3.813
  242   HD12  LEU  34          2HD1      LEU  34   3.871  -4.065  -3.710
  243   HD13  LEU  34          3HD1      LEU  34   3.635  -5.094  -5.141
  244   HD21  LEU  34          3HD2      LEU  34   3.105  -6.166  -1.593
  245   HD22  LEU  34          1HD2      LEU  34   4.767  -6.762  -1.370
  246   HD23  LEU  34          2HD2      LEU  34   4.465  -5.019  -1.559
  247    H    VAL  35           H        VAL  35   4.608  -6.382  -7.312
  248    HA   VAL  35           HA       VAL  35   7.536  -6.663  -7.225
  249    HB   VAL  35           HB       VAL  35   5.719  -4.730  -8.729
  250   HG11  VAL  35          1HG1      VAL  35   8.659  -5.454  -9.135
  251   HG12  VAL  35          2HG1      VAL  35   7.701  -4.379 -10.180
  252   HG13  VAL  35          3HG1      VAL  35   8.050  -3.906  -8.503
  253   HG21  VAL  35          3HG2      VAL  35   6.998  -7.289  -9.722
  254   HG22  VAL  35          1HG2      VAL  35   5.263  -7.015  -9.439
  255   HG23  VAL  35          2HG2      VAL  35   6.112  -6.105 -10.710
  256    H    HIS  36           H        HIS  36   8.704  -5.490  -5.628
  257    HA   HIS  36           HA       HIS  36   7.479  -3.243  -4.224
  258    HB2  HIS  36           2HB      HIS  36  10.352  -4.264  -4.313
  259    HB3  HIS  36           3HB      HIS  36   9.737  -3.048  -3.168
  260    HD1  HIS  36           HD1      HIS  36   7.587  -4.115  -1.585
  261    HD2  HIS  36           HD2      HIS  36  10.335  -6.777  -3.410
  262    HE1  HIS  36           HE1      HIS  36   7.378  -6.254  -0.381
  263    H    ILE  37           H        ILE  37   7.951  -1.034  -4.566
  264    HA   ILE  37           HA       ILE  37   8.584  -0.123  -7.220
  265    HB   ILE  37           HB       ILE  37   7.364   1.183  -5.395
  266   HG12  ILE  37          2HG1      ILE  37   9.617   2.612  -6.759
  267   HG13  ILE  37          3HG1      ILE  37   8.113   2.066  -7.537
  268   HG21  ILE  37          1HG2      ILE  37  10.219   1.717  -4.429
  269   HG22  ILE  37          2HG2      ILE  37   8.760   2.559  -3.859
  270   HG23  ILE  37          3HG2      ILE  37   8.971   0.825  -3.528
  271   HD11  ILE  37          3HD1      ILE  37   6.797   3.533  -6.025
  272   HD12  ILE  37          1HD1      ILE  37   8.301   4.081  -5.248
  273   HD13  ILE  37          2HD1      ILE  37   7.988   4.475  -6.953
  274    H    SER  38           H        SER  38  10.843  -0.755  -4.671
  275    HA   SER  38           HA       SER  38  13.173   0.307  -5.953
  276    HB2  SER  38           2HB      SER  38  13.098  -2.150  -4.191
  277    HB3  SER  38           3HB      SER  38  14.351  -0.892  -4.303
  278    HG   SER  38           HG       SER  38  13.022  -0.657  -2.416
  279    H    GLU  39           H        GLU  39  11.247  -2.209  -7.023
  280    HA   GLU  39           HA       GLU  39  13.449  -3.493  -8.601
  281    HB2  GLU  39           2HB      GLU  39  10.870  -4.673  -7.550
  282    HB3  GLU  39           3HB      GLU  39  12.074  -5.508  -8.557
  283    HG2  GLU  39           2HG      GLU  39  12.556  -4.484  -5.726
  284    HG3  GLU  39           3HG      GLU  39  12.165  -6.159  -6.179
  285    H    VAL  40           H        VAL  40  10.896  -1.365  -8.921
  286    HA   VAL  40           HA       VAL  40   9.571  -2.456 -11.299
  287    HB   VAL  40           HB       VAL  40   9.649   0.191  -9.850
  288   HG11  VAL  40          1HG1      VAL  40   7.987  -0.436 -12.334
  289   HG12  VAL  40          2HG1      VAL  40   7.823   1.013 -11.314
  290   HG13  VAL  40          3HG1      VAL  40   9.315   0.745 -12.246
  291   HG21  VAL  40          3HG2      VAL  40   7.465  -1.876 -10.282
  292   HG22  VAL  40          1HG2      VAL  40   8.380  -1.588  -8.784
  293   HG23  VAL  40          2HG2      VAL  40   7.269  -0.344  -9.400
  294    H    THR  41           H        THR  41  12.250  -0.223 -10.841
  295    HA   THR  41           HA       THR  41  13.271  -0.889 -13.534
  296    HB   THR  41           HB       THR  41  12.780   1.975 -12.679
  297    HG1  THR  41           1HG      THR  41  11.180   1.926 -14.369
  298   HG21  THR  41          1HG2      THR  41  13.577   0.861 -15.409
  299   HG22  THR  41          2HG2      THR  41  13.236   2.570 -15.045
  300   HG23  THR  41          3HG2      THR  41  14.641   1.767 -14.309
  301    H    HIS  42           H        HIS  42  15.530   0.388 -13.616
  302    HA   HIS  42           HA       HIS  42  17.251  -0.953 -11.933
  303    HB2  HIS  42           2HB      HIS  42  17.922   0.263 -13.999
  304    HB3  HIS  42           3HB      HIS  42  17.751   1.814 -13.144
  305    HD1  HIS  42           HD1      HIS  42  19.800   2.567 -11.695
  306    HD2  HIS  42           HD2      HIS  42  20.064  -1.417 -13.122
  307    HE1  HIS  42           HE1      HIS  42  22.082   1.802 -11.176
  308    H    GLY  43           H        GLY  43  16.101   2.345 -11.191
  309    HA2  GLY  43           2HA      GLY  43  15.699   1.728  -8.478
  310    HA3  GLY  43           3HA      GLY  43  17.302   2.490  -8.611
  311    H    PHE  44           H        PHE  44  16.546   4.170 -10.857
  312    HA   PHE  44           HA       PHE  44  15.499   6.470  -9.375
  313    HB2  PHE  44           2HB      PHE  44  16.315   6.233 -12.302
  314    HB3  PHE  44           3HB      PHE  44  16.206   7.723 -11.337
  315    HD1  PHE  44           HD2      PHE  44  17.737   7.688  -9.125
  316    HD2  PHE  44           HD1      PHE  44  18.408   5.364 -12.708
  317    HE1  PHE  44           HE2      PHE  44  20.150   7.466  -8.532
  318    HE2  PHE  44           HE1      PHE  44  20.821   5.153 -12.117
  319    HZ   PHE  44           HZ       PHE  44  21.691   6.195 -10.024
  320    H    VAL  45           H        VAL  45  13.468   4.521  -9.569
  321    HA   VAL  45           HA       VAL  45  11.478   5.213 -11.518
  322    HB   VAL  45           HB       VAL  45  11.230   4.142  -8.680
  323   HG11  VAL  45          1HG1      VAL  45   9.214   4.063 -10.976
  324   HG12  VAL  45          2HG1      VAL  45   9.021   3.260  -9.401
  325   HG13  VAL  45          3HG1      VAL  45   9.059   5.036  -9.495
  326   HG21  VAL  45          3HG2      VAL  45  11.286   2.684 -11.352
  327   HG22  VAL  45          1HG2      VAL  45  12.568   2.669 -10.118
  328   HG23  VAL  45          2HG2      VAL  45  10.989   1.932  -9.767
  329    H    LYS  46           H        LYS  46  10.983   7.301 -11.884
  330    HA   LYS  46           HA       LYS  46  11.030   9.377  -9.924
  331    HB2  LYS  46           2HB      LYS  46   9.255   9.391 -12.357
  332    HB3  LYS  46           3HB      LYS  46   9.996  10.769 -11.511
  333    HG2  LYS  46           2HG      LYS  46  11.393   8.718 -13.261
  334    HG3  LYS  46           3HG      LYS  46  11.091  10.426 -13.655
  335    HD2  LYS  46           2HD      LYS  46  12.599  11.124 -11.840
  336    HD3  LYS  46           3HD      LYS  46  12.881   9.421 -11.408
  337    HE2  LYS  46           2HE      LYS  46  13.612  10.731 -14.055
  338    HE3  LYS  46           3HE      LYS  46  14.747  10.376 -12.731
  339    HZ1  LYS  46           3HZ      LYS  46  14.267   8.041 -13.032
  340    HZ2  LYS  46           1HZ      LYS  46  13.216   8.370 -14.260
  341    HZ3  LYS  46           2HZ      LYS  46  14.824   8.695 -14.443
  342    H    ASP  47           H        ASP  47   8.337   7.551 -11.272
  343    HA   ASP  47           HA       ASP  47   7.033   7.347  -8.664
  344    HB2  ASP  47           2HB      ASP  47   6.045   9.436  -9.489
  345    HB3  ASP  47           3HB      ASP  47   5.562   8.638 -11.004
  346    H    ILE  48           H        ILE  48   5.785   5.408  -8.680
  347    HA   ILE  48           HA       ILE  48   6.459   3.372 -10.632
  348    HB   ILE  48           HB       ILE  48   5.866   2.980  -8.229
  349   HG12  ILE  48          2HG1      ILE  48   4.079   1.467 -10.082
  350   HG13  ILE  48          3HG1      ILE  48   5.844   1.269  -9.983
  351   HG21  ILE  48          1HG2      ILE  48   3.005   3.592  -9.130
  352   HG22  ILE  48          2HG2      ILE  48   3.469   2.900  -7.559
  353   HG23  ILE  48          3HG2      ILE  48   3.957   4.557  -7.976
  354   HD11  ILE  48          3HD1      ILE  48   5.642   0.663  -7.586
  355   HD12  ILE  48          1HD1      ILE  48   3.877   0.859  -7.685
  356   HD13  ILE  48          2HD1      ILE  48   4.680  -0.432  -8.606
  357    H    ASN  49           H        ASN  49   3.569   5.442 -10.670
  358    HA   ASN  49           HA       ASN  49   2.493   3.877 -12.846
  359    HB2  ASN  49           2HB      ASN  49   0.668   5.200 -12.657
  360    HB3  ASN  49           3HB      ASN  49   1.458   5.773 -11.169
  361   HD21  ASN  49          2HD2      ASN  49   2.867   7.760 -11.395
  362   HD22  ASN  49          1HD2      ASN  49   2.366   8.975 -12.557
  363    H    GLU  50           H        GLU  50   5.074   6.128 -12.900
  364    HA   GLU  50           HA       GLU  50   4.801   6.488 -15.825
  365    HB2  GLU  50           2HB      GLU  50   6.909   7.374 -13.818
  366    HB3  GLU  50           3HB      GLU  50   6.954   7.736 -15.559
  367    HG2  GLU  50           2HG      GLU  50   4.705   8.826 -15.305
  368    HG3  GLU  50           3HG      GLU  50   4.857   8.659 -13.540
  369    H    HIS  51           H        HIS  51   5.741   3.914 -13.976
  370    HA   HIS  51           HA       HIS  51   7.796   2.980 -15.955
  371    HB2  HIS  51           2HB      HIS  51   8.074   2.836 -12.882
  372    HB3  HIS  51           3HB      HIS  51   9.117   2.140 -14.144
  373    HD1  HIS  51           HD1      HIS  51   8.010   5.634 -12.914
  374    HD2  HIS  51           HD2      HIS  51  11.138   3.704 -15.024
  375    HE1  HIS  51           HE1      HIS  51   9.570   7.404 -13.603
  376    H    LEU  52           H        LEU  52   5.020   2.263 -14.147
  377    HA   LEU  52           HA       LEU  52   4.807  -0.334 -15.540
  378    HB2  LEU  52           2HB      LEU  52   5.658  -0.471 -13.014
  379    HB3  LEU  52           3HB      LEU  52   3.922  -0.310 -12.663
  380    HG   LEU  52           HG       LEU  52   3.632  -2.198 -14.464
  381   HD11  LEU  52          1HD1      LEU  52   6.540  -2.617 -13.632
  382   HD12  LEU  52          2HD1      LEU  52   5.557  -3.759 -14.579
  383   HD13  LEU  52          3HD1      LEU  52   5.982  -2.172 -15.262
  384   HD21  LEU  52          3HD2      LEU  52   4.832  -2.792 -11.743
  385   HD22  LEU  52          1HD2      LEU  52   3.117  -2.476 -12.097
  386   HD23  LEU  52          2HD2      LEU  52   3.905  -3.933 -12.746
  387    H    SER  53           H        SER  53   2.293  -1.049 -14.893
  388    HA   SER  53           HA       SER  53   0.502   1.240 -14.427
  389    HB2  SER  53           2HB      SER  53   0.659  -0.172 -17.115
  390    HB3  SER  53           3HB      SER  53  -0.671   0.894 -16.603
  391    HG   SER  53           HG       SER  53   0.941   2.002 -17.827
  392    H    VAL  54           H        VAL  54  -1.356   0.413 -13.442
  393    HA   VAL  54           HA       VAL  54  -1.966  -2.441 -13.294
  394    HB   VAL  54           HB       VAL  54  -2.715  -0.877 -11.579
  395   HG11  VAL  54          1HG1      VAL  54  -4.477   0.393 -13.731
  396   HG12  VAL  54          2HG1      VAL  54  -4.553   0.746 -11.989
  397   HG13  VAL  54          3HG1      VAL  54  -3.102   1.179 -12.921
  398   HG21  VAL  54          3HG2      VAL  54  -5.008  -2.110 -13.077
  399   HG22  VAL  54          1HG2      VAL  54  -3.986  -2.863 -11.830
  400   HG23  VAL  54          2HG2      VAL  54  -5.059  -1.509 -11.403
  401    H    GLY  55           H        GLY  55  -3.390  -3.681 -14.290
  402    HA2  GLY  55           2HA      GLY  55  -4.690  -4.445 -16.023
  403    HA3  GLY  55           3HA      GLY  55  -5.014  -2.754 -16.471
  404    H    ASP  56           H        ASP  56  -1.729  -4.059 -16.243
  405    HA   ASP  56           HA       ASP  56  -1.554  -4.246 -19.230
  406    HB2  ASP  56           2HB      ASP  56  -0.471  -2.165 -18.269
  407    HB3  ASP  56           3HB      ASP  56   0.563  -3.262 -17.326
  408    H    GLU  57           H        GLU  57   0.209  -5.716 -19.912
  409    HA   GLU  57           HA       GLU  57   0.566  -8.005 -18.016
  410    HB2  GLU  57           2HB      GLU  57  -0.710  -8.429 -20.101
  411    HB3  GLU  57           3HB      GLU  57   0.700  -7.894 -21.046
  412    HG2  GLU  57           2HG      GLU  57   2.048  -9.735 -20.096
  413    HG3  GLU  57           3HG      GLU  57   0.653 -10.246 -19.115
  414    H    VAL  58           H        VAL  58   2.586  -8.589 -17.433
  415    HA   VAL  58           HA       VAL  58   4.992  -7.233 -18.594
  416    HB   VAL  58           HB       VAL  58   5.642  -6.504 -16.313
  417   HG11  VAL  58          1HG1      VAL  58   2.950  -5.348 -17.196
  418   HG12  VAL  58          2HG1      VAL  58   4.108  -4.556 -16.103
  419   HG13  VAL  58          3HG1      VAL  58   4.544  -4.843 -17.804
  420   HG21  VAL  58          3HG2      VAL  58   2.847  -7.240 -15.438
  421   HG22  VAL  58          1HG2      VAL  58   4.367  -8.007 -14.921
  422   HG23  VAL  58          2HG2      VAL  58   4.036  -6.312 -14.493
  423    H    GLN  59           H        GLN  59   6.836  -8.312 -18.418
  424    HA   GLN  59           HA       GLN  59   6.807 -11.050 -17.398
  425    HB2  GLN  59           2HB      GLN  59   9.036  -9.253 -18.406
  426    HB3  GLN  59           3HB      GLN  59   9.239 -10.958 -17.941
  427    HG2  GLN  59           2HG      GLN  59   7.597 -11.613 -19.709
  428    HG3  GLN  59           3HG      GLN  59   7.462  -9.906 -20.191
  429   HE21  GLN  59          2HE2      GLN  59   9.403  -8.839 -21.089
  430   HE22  GLN  59          1HE2      GLN  59  10.630  -9.817 -21.869
  431    H    VAL  60           H        VAL  60   7.678 -11.679 -15.426
  432    HA   VAL  60           HA       VAL  60   9.069  -9.701 -13.631
  433    HB   VAL  60           HB       VAL  60   7.768 -10.833 -11.749
  434   HG11  VAL  60          1HG1      VAL  60   6.164  -9.066 -13.652
  435   HG12  VAL  60          2HG1      VAL  60   5.798  -9.339 -11.932
  436   HG13  VAL  60          3HG1      VAL  60   7.289  -8.491 -12.399
  437   HG21  VAL  60          3HG2      VAL  60   5.865 -11.648 -13.930
  438   HG22  VAL  60          1HG2      VAL  60   6.824 -12.713 -12.875
  439   HG23  VAL  60          2HG2      VAL  60   5.546 -11.689 -12.180
  440    H    LYS  61           H        LYS  61  10.655 -10.475 -12.393
  441    HA   LYS  61           HA       LYS  61  11.216 -13.404 -12.552
  442    HB2  LYS  61           2HB      LYS  61  13.037 -11.876 -13.215
  443    HB3  LYS  61           3HB      LYS  61  12.951 -11.094 -11.620
  444    HG2  LYS  61           2HG      LYS  61  13.599 -13.189 -10.519
  445    HG3  LYS  61           3HG      LYS  61  13.591 -14.040 -12.082
  446    HD2  LYS  61           2HD      LYS  61  15.411 -12.528 -12.880
  447    HD3  LYS  61           3HD      LYS  61  15.448 -11.760 -11.275
  448    HE2  LYS  61           2HE      LYS  61  16.017 -13.918 -10.242
  449    HE3  LYS  61           3HE      LYS  61  15.949 -14.708 -11.835
  450    HZ1  LYS  61           3HZ      LYS  61  17.785 -13.324 -12.528
  451    HZ2  LYS  61           1HZ      LYS  61  17.848 -12.592 -11.051
  452    HZ3  LYS  61           2HZ      LYS  61  18.204 -14.196 -11.192
  453    H    VAL  62           H        VAL  62  10.801 -14.627 -10.854
  454    HA   VAL  62           HA       VAL  62   9.474 -13.635  -8.493
  455    HB   VAL  62           HB       VAL  62  10.761 -16.349  -9.029
  456   HG11  VAL  62          1HG1      VAL  62   8.554 -15.476  -7.104
  457   HG12  VAL  62          2HG1      VAL  62   9.122 -17.145  -7.340
  458   HG13  VAL  62          3HG1      VAL  62  10.212 -15.925  -6.643
  459   HG21  VAL  62          3HG2      VAL  62   7.898 -15.433  -9.543
  460   HG22  VAL  62          1HG2      VAL  62   9.111 -15.814 -10.788
  461   HG23  VAL  62          2HG2      VAL  62   8.508 -17.096  -9.712
  462    H    LEU  63           H        LEU  63  10.303 -12.867  -6.703
  463    HA   LEU  63           HA       LEU  63  13.288 -12.845  -6.351
  464    HB2  LEU  63           2HB      LEU  63  12.211 -10.740  -6.978
  465    HB3  LEU  63           3HB      LEU  63  11.140 -10.854  -5.562
  466    HG   LEU  63           HG       LEU  63  13.108 -10.691  -4.066
  467   HD11  LEU  63          1HD1      LEU  63  14.695 -10.175  -6.625
  468   HD12  LEU  63          2HD1      LEU  63  15.314  -9.994  -4.966
  469   HD13  LEU  63          3HD1      LEU  63  14.858 -11.602  -5.575
  470   HD21  LEU  63          3HD2      LEU  63  12.896  -8.463  -6.135
  471   HD22  LEU  63          1HD2      LEU  63  11.869  -8.664  -4.696
  472   HD23  LEU  63          2HD2      LEU  63  13.599  -8.291  -4.509
  473    H    ALA  64           H        ALA  64  10.202 -13.366  -4.683
  474    HA   ALA  64           HA       ALA  64  11.568 -15.057  -2.683
  475    HB1  ALA  64           1HB      ALA  64   9.956 -12.618  -1.836
  476    HB2  ALA  64           2HB      ALA  64  10.528 -13.913  -0.762
  477    HB3  ALA  64           3HB      ALA  64  11.700 -12.851  -1.577
  478    H    VAL  65           H        VAL  65  10.027 -16.417  -1.601
  479    HA   VAL  65           HA       VAL  65   7.161 -16.231  -2.475
  480    HB   VAL  65           HB       VAL  65   8.873 -18.752  -2.363
  481   HG11  VAL  65          1HG1      VAL  65   5.954 -18.362  -3.184
  482   HG12  VAL  65          2HG1      VAL  65   6.863 -19.889  -3.282
  483   HG13  VAL  65          3HG1      VAL  65   6.514 -19.161  -1.696
  484   HG21  VAL  65          3HG2      VAL  65   7.659 -17.375  -4.782
  485   HG22  VAL  65          1HG2      VAL  65   9.390 -17.481  -4.384
  486   HG23  VAL  65          2HG2      VAL  65   8.477 -18.955  -4.781
  487    H    ASP  66           H        ASP  66   5.766 -16.513  -0.855
  488    HA   ASP  66           HA       ASP  66   6.612 -17.622   1.768
  489    HB2  ASP  66           2HB      ASP  66   6.956 -15.163   1.849
  490    HB3  ASP  66           3HB      ASP  66   5.235 -14.926   1.466
  491    H    GLU  67           H        GLU  67   5.402 -19.400   1.123
  492    HA   GLU  67           HA       GLU  67   2.716 -19.266   0.097
  493    HB2  GLU  67           2HB      GLU  67   4.201 -21.506   1.501
  494    HB3  GLU  67           3HB      GLU  67   2.683 -21.675   0.590
  495    HG2  GLU  67           2HG      GLU  67   3.811 -20.968  -1.463
  496    HG3  GLU  67           3HG      GLU  67   5.347 -20.758  -0.589
  497    H    GLU  68           H        GLU  68   3.976 -19.220   3.412
  498    HA   GLU  68           HA       GLU  68   1.475 -19.917   4.676
  499    HB2  GLU  68           2HB      GLU  68   3.831 -18.303   5.692
  500    HB3  GLU  68           3HB      GLU  68   2.487 -18.913   6.686
  501    HG2  GLU  68           2HG      GLU  68   4.485 -20.635   5.147
  502    HG3  GLU  68           3HG      GLU  68   4.508 -20.301   6.894
  503    H    LYS  69           H        LYS  69   3.028 -16.737   3.896
  504    HA   LYS  69           HA       LYS  69   0.629 -15.210   4.478
  505    HB2  LYS  69           2HB      LYS  69   3.089 -14.446   4.273
  506    HB3  LYS  69           3HB      LYS  69   2.804 -14.468   2.517
  507    HG2  LYS  69           2HG      LYS  69   0.994 -12.836   2.752
  508    HG3  LYS  69           3HG      LYS  69   1.153 -12.874   4.524
  509    HD2  LYS  69           2HD      LYS  69   3.471 -11.987   4.321
  510    HD3  LYS  69           3HD      LYS  69   3.280 -11.918   2.553
  511    HE2  LYS  69           2HE      LYS  69   1.406 -10.347   2.801
  512    HE3  LYS  69           3HE      LYS  69   1.547 -10.440   4.572
  513    HZ1  LYS  69           3HZ      LYS  69   3.739  -9.479   4.384
  514    HZ2  LYS  69           1HZ      LYS  69   3.609  -9.393   2.742
  515    HZ3  LYS  69           2HZ      LYS  69   2.620  -8.480   3.697
  516    H    GLY  70           H        GLY  70   1.536 -17.251   1.830
  517    HA2  GLY  70           2HA      GLY  70   0.444 -17.807  -0.127
  518    HA3  GLY  70           3HA      GLY  70  -0.940 -16.818   0.398
  519    H    LYS  71           H        LYS  71   2.465 -15.846  -0.084
  520    HA   LYS  71           HA       LYS  71   1.671 -13.950  -2.252
  521    HB2  LYS  71           2HB      LYS  71   2.947 -13.310   0.414
  522    HB3  LYS  71           3HB      LYS  71   3.080 -12.240  -1.001
  523    HG2  LYS  71           2HG      LYS  71   0.447 -13.117   0.235
  524    HG3  LYS  71           3HG      LYS  71   1.283 -11.604   0.655
  525    HD2  LYS  71           2HD      LYS  71   1.053 -10.798  -1.660
  526    HD3  LYS  71           3HD      LYS  71   0.303 -12.337  -2.146
  527    HE2  LYS  71           2HE      LYS  71  -1.578 -11.947  -0.654
  528    HE3  LYS  71           3HE      LYS  71  -0.808 -10.475  -0.015
  529    HZ1  LYS  71           3HZ      LYS  71  -1.008  -9.502  -2.200
  530    HZ2  LYS  71           1HZ      LYS  71  -1.720 -10.866  -2.794
  531    HZ3  LYS  71           2HZ      LYS  71  -2.491  -9.963  -1.648
  532    H    ILE  72           H        ILE  72   3.534 -12.897  -3.152
  533    HA   ILE  72           HA       ILE  72   6.100 -14.417  -3.227
  534    HB   ILE  72           HB       ILE  72   4.229 -13.939  -5.602
  535   HG12  ILE  72          2HG1      ILE  72   5.121 -16.493  -4.291
  536   HG13  ILE  72          3HG1      ILE  72   3.484 -15.797  -4.311
  537   HG21  ILE  72          1HG2      ILE  72   7.011 -15.196  -5.511
  538   HG22  ILE  72          2HG2      ILE  72   5.966 -15.096  -6.947
  539   HG23  ILE  72          3HG2      ILE  72   6.613 -13.612  -6.215
  540   HD11  ILE  72          3HD1      ILE  72   3.361 -16.149  -6.762
  541   HD12  ILE  72          1HD1      ILE  72   4.997 -16.850  -6.743
  542   HD13  ILE  72          2HD1      ILE  72   3.667 -17.681  -5.909
  543    H    SER  73           H        SER  73   7.738 -12.893  -3.356
  544    HA   SER  73           HA       SER  73   7.001 -10.125  -4.115
  545    HB2  SER  73           2HB      SER  73   9.699 -11.201  -3.238
  546    HB3  SER  73           3HB      SER  73   9.200  -9.498  -3.359
  547    HG   SER  73           HG       SER  73   9.079 -10.307  -1.191
  548    H    LEU  74           H        LEU  74   7.945  -9.123  -5.902
  549    HA   LEU  74           HA       LEU  74   8.952 -10.958  -8.048
  550    HB2  LEU  74           2HB      LEU  74   6.752  -8.911  -8.172
  551    HB3  LEU  74           3HB      LEU  74   7.379  -9.798  -9.581
  552    HG   LEU  74           HG       LEU  74   5.946 -11.091  -7.210
  553   HD11  LEU  74          1HD1      LEU  74   4.952 -10.482 -10.033
  554   HD12  LEU  74          2HD1      LEU  74   4.056 -11.388  -8.792
  555   HD13  LEU  74          3HD1      LEU  74   4.418  -9.663  -8.546
  556   HD21  LEU  74          3HD2      LEU  74   6.792 -12.267  -9.866
  557   HD22  LEU  74          1HD2      LEU  74   7.515 -12.609  -8.276
  558   HD23  LEU  74          2HD2      LEU  74   5.835 -13.086  -8.610
  559    H    SER  75           H        SER  75   9.922  -9.716  -9.845
  560    HA   SER  75           HA       SER  75  10.583  -6.865  -9.309
  561    HB2  SER  75           2HB      SER  75  12.963  -7.422  -9.935
  562    HB3  SER  75           3HB      SER  75  12.439  -7.963  -8.324
  563    HG   SER  75           HG       SER  75  13.618  -9.592  -9.467
  564    H    ILE  76           H        ILE  76  11.033  -5.672 -11.075
  565    HA   ILE  76           HA       ILE  76  10.243  -6.813 -13.776
  566    HB   ILE  76           HB       ILE  76   9.878  -4.070 -12.494
  567   HG12  ILE  76          2HG1      ILE  76   8.289  -5.753 -11.779
  568   HG13  ILE  76          3HG1      ILE  76   7.629  -4.279 -12.524
  569   HG21  ILE  76          1HG2      ILE  76   9.182  -4.970 -15.326
  570   HG22  ILE  76          2HG2      ILE  76   8.766  -3.395 -14.607
  571   HG23  ILE  76          3HG2      ILE  76  10.469  -3.822 -14.890
  572   HD11  ILE  76          3HD1      ILE  76   7.193  -5.534 -14.619
  573   HD12  ILE  76          1HD1      ILE  76   7.856  -7.006 -13.873
  574   HD13  ILE  76          2HD1      ILE  76   6.359  -6.284 -13.239
  575    H    ARG  77           H        ARG  77  12.441  -4.510 -12.100
  576    HA   ARG  77           HA       ARG  77  13.998  -3.844 -14.371
  577    HB2  ARG  77           2HB      ARG  77  15.635  -3.084 -12.872
  578    HB3  ARG  77           3HB      ARG  77  14.048  -2.768 -12.133
  579    HG2  ARG  77           2HG      ARG  77  14.366  -4.674 -10.591
  580    HG3  ARG  77           3HG      ARG  77  15.930  -5.047 -11.353
  581    HD2  ARG  77           2HD      ARG  77  16.874  -2.935 -10.603
  582    HD3  ARG  77           3HD      ARG  77  15.288  -2.380 -10.017
  583    HE   ARG  77           HE       ARG  77  15.724  -4.705  -8.647
  584   HH11  ARG  77          1HH1      ARG  77  17.700  -1.766  -8.983
  585   HH12  ARG  77          2HH1      ARG  77  18.348  -1.896  -7.363
  586   HH21  ARG  77          1HH2      ARG  77  16.548  -4.799  -6.554
  587   HH22  ARG  77          2HH2      ARG  77  17.702  -3.602  -5.997
  588    H    ALA  78           H        ALA  78  13.992  -6.812 -12.655
  589    HA   ALA  78           HA       ALA  78  16.473  -7.873 -13.617
  590    HB1  ALA  78           1HB      ALA  78  13.900  -9.252 -12.742
  591    HB2  ALA  78           2HB      ALA  78  15.503 -10.014 -12.873
  592    HB3  ALA  78           3HB      ALA  78  15.222  -8.737 -11.666
  593    H    THR  79           H        THR  79  13.447  -7.371 -15.316
  594    HA   THR  79           HA       THR  79  14.309  -9.024 -17.686
  595    HB   THR  79           HB       THR  79  13.216 -10.533 -16.018
  596    HG1  THR  79           1HG      THR  79  11.666 -11.358 -17.440
  597   HG21  THR  79          1HG2      THR  79  10.761  -8.773 -16.466
  598   HG22  THR  79          2HG2      THR  79  10.775 -10.338 -15.621
  599   HG23  THR  79          3HG2      THR  79  11.646  -8.948 -14.933
  600    H    GLN  80           H        GLN  80  12.783  -6.208 -16.570
  601    HA   GLN  80           HA       GLN  80  12.302  -5.575 -19.449
  602    HB2  GLN  80           2HB      GLN  80  10.723  -4.352 -17.189
  603    HB3  GLN  80           3HB      GLN  80  10.434  -4.227 -18.940
  604    HG2  GLN  80           2HG      GLN  80   9.953  -6.754 -18.880
  605    HG3  GLN  80           3HG      GLN  80   9.920  -6.591 -17.109
  606   HE21  GLN  80          2HE2      GLN  80   8.531  -3.923 -17.116
  607   HE22  GLN  80          1HE2      GLN  80   6.885  -4.260 -17.619
  608    H    ALA  81           H        ALA  81  12.712  -3.395 -19.977
  609    HA   ALA  81           HA       ALA  81  13.947  -1.476 -18.076
  610    HB1  ALA  81           1HB      ALA  81  15.449  -2.631 -20.467
  611    HB2  ALA  81           2HB      ALA  81  15.971  -1.248 -19.476
  612    HB3  ALA  81           3HB      ALA  81  15.877  -2.872 -18.756
  613    H    ALA  82           H        ALA  82  14.410   0.542 -19.250
  614    HA   ALA  82           HA       ALA  82  13.360   2.372 -20.107
  615    HB1  ALA  82           1HB      ALA  82  13.602   0.726 -22.662
  616    HB2  ALA  82           2HB      ALA  82  13.450   2.496 -22.572
  617    HB3  ALA  82           3HB      ALA  82  14.900   1.694 -21.923
  618    HA   PRO  83           HA       PRO  83   9.278   0.175 -20.057
  619    HB2  PRO  83           2HB      PRO  83   8.133   1.334 -17.857
  620    HB3  PRO  83           3HB      PRO  83   9.224  -0.070 -17.762
  621    HG2  PRO  83           2HG      PRO  83   9.887   2.897 -17.363
  622    HG3  PRO  83           3HG      PRO  83  10.390   1.509 -16.367
  623    HD2  PRO  83           2HD      PRO  83  12.046   2.541 -18.321
  624    HD3  PRO  83           3HD      PRO  83  12.015   0.795 -17.971
  625    H    GLU  84           H        GLU  84   7.077   0.978 -20.136
  626    HA   GLU  84           HA       GLU  84   6.544   3.859 -20.681
  627    HB2  GLU  84           2HB      GLU  84   7.124   2.771 -22.805
  628    HB3  GLU  84           3HB      GLU  84   5.874   1.541 -22.505
  629    HG2  GLU  84           2HG      GLU  84   5.170   3.242 -24.160
  630    HG3  GLU  84           3HG      GLU  84   4.111   3.197 -22.732
  631    H    LYS  85           H        LYS  85   4.141   4.186 -20.657
  632    HA   LYS  85           HA       LYS  85   2.738   2.286 -18.806
  633    HB2  LYS  85           2HB      LYS  85   1.856   4.395 -17.728
  634    HB3  LYS  85           3HB      LYS  85   3.519   3.886 -17.355
  635    HG2  LYS  85           2HG      LYS  85   3.368   6.317 -17.544
  636    HG3  LYS  85           3HG      LYS  85   4.414   5.624 -18.804
  637    HD2  LYS  85           2HD      LYS  85   2.588   5.863 -20.448
  638    HD3  LYS  85           3HD      LYS  85   1.545   6.559 -19.186
  639    HE2  LYS  85           2HE      LYS  85   2.453   8.340 -20.585
  640    HE3  LYS  85           3HE      LYS  85   3.122   8.450 -18.939
  641    HZ1  LYS  85           3HZ      LYS  85   5.119   7.392 -19.753
  642    HZ2  LYS  85           1HZ      LYS  85   4.500   7.287 -21.277
  643    HZ3  LYS  85           2HZ      LYS  85   4.815   8.766 -20.612
  644    H    LYS  86           H        LYS  86   0.484   2.659 -18.538
  645    HA   LYS  86           HA       LYS  86  -1.016   3.900 -20.757
  646    HB2  LYS  86           2HB      LYS  86  -2.189   1.874 -21.321
  647    HB3  LYS  86           3HB      LYS  86  -0.447   1.707 -21.637
  648    HG2  LYS  86           2HG      LYS  86  -0.729  -0.312 -20.673
  649    HG3  LYS  86           3HG      LYS  86  -0.538   0.632 -19.178
  650    HD2  LYS  86           2HD      LYS  86  -2.397  -0.871 -18.845
  651    HD3  LYS  86           3HD      LYS  86  -3.063   0.767 -19.037
  652    HE2  LYS  86           2HE      LYS  86  -3.738   0.332 -21.294
  653    HE3  LYS  86           3HE      LYS  86  -2.800  -1.180 -21.353
  654    HZ1  LYS  86           3HZ      LYS  86  -4.308  -2.103 -19.735
  655    HZ2  LYS  86           1HZ      LYS  86  -5.178  -0.701 -19.679
  656    HZ3  LYS  86           2HZ      LYS  86  -5.142  -1.596 -21.066
  657    H    GLU  87           H        GLU  87  -3.379   3.746 -20.337
  658    HA   GLU  87           HA       GLU  87  -4.155   3.428 -17.491
  659    HB2  GLU  87           2HB      GLU  87  -3.223   5.681 -17.619
  660    HB3  GLU  87           3HB      GLU  87  -4.247   6.041 -19.029
  661    HG2  GLU  87           2HG      GLU  87  -6.270   5.733 -17.609
  662    HG3  GLU  87           3HG      GLU  87  -5.223   5.447 -16.199
  663    H    SER  88           H        SER  88  -5.680   1.984 -17.866
  664    HA   SER  88           HA       SER  88  -7.233   1.657 -20.253
  665    HB2  SER  88           2HB      SER  88  -8.010   0.716 -17.485
  666    HB3  SER  88           3HB      SER  88  -8.298  -0.074 -19.054
  667    HG   SER  88           HG       SER  88  -6.553  -1.044 -17.874
  668    H    LYS  89           H        LYS  89  -7.872   3.544 -17.325
  669    HA   LYS  89           HA       LYS  89 -10.667   3.999 -17.693
  670    HB2  LYS  89           2HB      LYS  89  -8.490   5.719 -16.448
  671    HB3  LYS  89           3HB      LYS  89 -10.233   6.056 -16.329
  672    HG2  LYS  89           2HG      LYS  89 -10.558   3.840 -15.250
  673    HG3  LYS  89           3HG      LYS  89  -8.800   3.573 -15.312
  674    HD2  LYS  89           2HD      LYS  89 -10.154   5.855 -13.822
  675    HD3  LYS  89           3HD      LYS  89  -9.640   4.328 -13.067
  676    HE2  LYS  89           2HE      LYS  89  -7.297   4.805 -13.795
  677    HE3  LYS  89           3HE      LYS  89  -7.843   6.374 -14.433
  678    HZ1  LYS  89           3HZ      LYS  89  -8.497   6.979 -12.202
  679    HZ2  LYS  89           1HZ      LYS  89  -7.990   5.526 -11.611
  680    HZ3  LYS  89           2HZ      LYS  89  -6.895   6.588 -12.238
  681    HA   PRO  90           HA       PRO  90 -10.693   6.928 -21.074
  682    HB2  PRO  90           2HB      PRO  90 -12.745   8.613 -20.332
  683    HB3  PRO  90           3HB      PRO  90 -12.972   7.041 -21.136
  684    HG2  PRO  90           2HG      PRO  90 -13.178   7.783 -18.171
  685    HG3  PRO  90           3HG      PRO  90 -14.206   6.667 -19.103
  686    HD2  PRO  90           2HD      PRO  90 -12.133   5.773 -17.482
  687    HD3  PRO  90           3HD      PRO  90 -12.626   4.901 -18.954
  688    H    ARG  91           H        ARG  91 -10.241   9.189 -21.481
  689    HA   ARG  91           HA       ARG  91  -8.161  10.232 -19.822
  690    HB2  ARG  91           2HB      ARG  91  -9.754  11.647 -21.966
  691    HB3  ARG  91           3HB      ARG  91  -8.158  12.117 -21.338
  692    HG2  ARG  91           2HG      ARG  91  -8.690   9.517 -22.793
  693    HG3  ARG  91           3HG      ARG  91  -8.215  11.014 -23.628
  694    HD2  ARG  91           2HD      ARG  91  -6.241   9.655 -23.388
  695    HD3  ARG  91           3HD      ARG  91  -6.103  11.032 -22.270
  696    HE   ARG  91           HE       ARG  91  -6.004   9.595 -20.523
  697   HH11  ARG  91          1HH2      ARG  91  -7.344   7.739 -23.239
  698   HH12  ARG  91          2HH2      ARG  91  -7.321   6.228 -22.352
  699   HH21  ARG  91          1HH1      ARG  91  -6.008   7.637 -19.422
  700   HH22  ARG  91          2HH1      ARG  91  -6.570   6.171 -20.206
  701    H    LYS  92           H        LYS  92  -8.027  12.513 -19.170
  702    HA   LYS  92           HA       LYS  92 -10.411  13.482 -17.652
  703    HB2  LYS  92           2HB      LYS  92  -7.666  12.866 -16.521
  704    HB3  LYS  92           3HB      LYS  92  -8.946  13.758 -15.668
  705    HG2  LYS  92           2HG      LYS  92  -9.211  10.887 -16.634
  706    HG3  LYS  92           3HG      LYS  92  -8.711  11.339 -14.988
  707    HD2  LYS  92           2HD      LYS  92 -10.846  12.380 -14.545
  708    HD3  LYS  92           3HD      LYS  92 -11.342  12.209 -16.245
  709    HE2  LYS  92           2HE      LYS  92 -10.690   9.831 -14.479
  710    HE3  LYS  92           3HE      LYS  92 -12.324  10.529 -14.575
  711    HZ1  LYS  92           3HZ      LYS  92 -12.307  10.077 -16.933
  712    HZ2  LYS  92           1HZ      LYS  92 -10.792   9.430 -16.846
  713    HZ3  LYS  92           2HZ      LYS  92 -12.054   8.684 -16.086
  714    HA   PRO  93           HA       PRO  93  -8.804  17.302 -19.080
  715    HB2  PRO  93           2HB      PRO  93  -9.592  19.135 -17.196
  716    HB3  PRO  93           3HB      PRO  93 -10.714  18.368 -18.345
  717    HG2  PRO  93           2HG      PRO  93 -10.134  17.591 -15.438
  718    HG3  PRO  93           3HG      PRO  93 -11.711  17.713 -16.257
  719    HD2  PRO  93           2HD      PRO  93 -10.420  15.284 -15.980
  720    HD3  PRO  93           3HD      PRO  93 -11.399  15.648 -17.422
  721    H    LYS  94           H        LYS  94  -7.765  16.192 -15.952
  722    HA   LYS  94           HA       LYS  94  -5.085  17.386 -16.354
  723    HB2  LYS  94           2HB      LYS  94  -4.952  18.141 -14.036
  724    HB3  LYS  94           3HB      LYS  94  -6.198  19.026 -14.948
  725    HG2  LYS  94           2HG      LYS  94  -7.962  17.702 -13.896
  726    HG3  LYS  94           3HG      LYS  94  -6.751  16.709 -13.052
  727    HD2  LYS  94           2HD      LYS  94  -7.094  19.704 -12.640
  728    HD3  LYS  94           3HD      LYS  94  -7.857  18.466 -11.614
  729    HE2  LYS  94           2HE      LYS  94  -5.594  17.565 -11.074
  730    HE3  LYS  94           3HE      LYS  94  -4.868  18.876 -12.034
  731    HZ1  LYS  94           3HZ      LYS  94  -5.859  20.449 -10.514
  732    HZ2  LYS  94           1HZ      LYS  94  -6.532  19.234  -9.624
  733    HZ3  LYS  94           2HZ      LYS  94  -4.892  19.397  -9.691
  734    H    ALA  95           H        ALA  95  -3.452  16.295 -15.013
  735    HA   ALA  95           HA       ALA  95  -3.819  13.465 -14.712
  736    HB1  ALA  95           1HB      ALA  95  -1.762  15.338 -13.466
  737    HB2  ALA  95           2HB      ALA  95  -1.642  13.565 -13.553
  738    HB3  ALA  95           3HB      ALA  95  -1.612  14.532 -15.046
  739    H    ALA  96           H        ALA  96  -4.104  12.187 -12.915
  740    HA   ALA  96           HA       ALA  96  -5.505  13.192 -10.593
  741    HB1  ALA  96           1HB      ALA  96  -4.063  10.551 -11.088
  742    HB2  ALA  96           2HB      ALA  96  -5.210  10.882  -9.768
  743    HB3  ALA  96           3HB      ALA  96  -5.772  10.887 -11.457
  744    H    GLN  97           H        GLN  97  -4.715  12.762  -8.378
  745    HA   GLN  97           HA       GLN  97  -1.776  12.881  -7.909
  746    HB2  GLN  97           2HB      GLN  97  -2.770  15.215  -8.020
  747    HB3  GLN  97           3HB      GLN  97  -3.747  14.774  -6.600
  748    HG2  GLN  97           2HG      GLN  97  -1.702  14.403  -5.278
  749    HG3  GLN  97           3HG      GLN  97  -0.694  14.762  -6.700
  750   HE21  GLN  97          2HE2      GLN  97  -3.201  16.205  -4.554
  751   HE22  GLN  97          1HE2      GLN  97  -2.605  17.850  -4.693
  752    H    VAL  98           H        VAL  98  -1.225  12.032  -5.858
  753    HA   VAL  98           HA       VAL  98  -2.861   9.825  -4.884
  754    HB   VAL  98           HB       VAL  98  -0.352   9.979  -4.872
  755   HG11  VAL  98          1HG1      VAL  98  -0.795  11.850  -2.494
  756   HG12  VAL  98          2HG1      VAL  98   0.764  11.141  -2.978
  757   HG13  VAL  98          3HG1      VAL  98  -0.054  12.304  -4.047
  758   HG21  VAL  98          3HG2      VAL  98  -1.645   9.356  -2.237
  759   HG22  VAL  98          1HG2      VAL  98  -1.409   8.266  -3.624
  760   HG23  VAL  98          2HG2      VAL  98  -0.001   8.890  -2.733
  761    H    SER  99           H        SER  99  -2.839  13.111  -3.827
  762    HA   SER  99           HA       SER  99  -5.135  12.485  -2.043
  763    HB2  SER  99           2HB      SER  99  -2.731  14.136  -1.193
  764    HB3  SER  99           3HB      SER  99  -4.187  13.790  -0.231
  765    HG   SER  99           HG       SER  99  -2.410  12.409   0.319
  766    H    GLU 100           H        GLU 100  -6.229  14.560  -1.430
  767    HA   GLU 100           HA       GLU 100  -6.647  16.160  -3.851
  768    HB2  GLU 100           2HB      GLU 100  -7.904  16.224  -1.095
  769    HB3  GLU 100           3HB      GLU 100  -8.468  17.145  -2.508
  770    HG2  GLU 100           2HG      GLU 100  -9.926  15.293  -2.329
  771    HG3  GLU 100           3HG      GLU 100  -8.819  14.962  -3.682
  772    H    GLU 101           H        GLU 101  -4.348  16.519  -1.534
  773    HA   GLU 101           HA       GLU 101  -4.585  19.162  -0.531
  774    HB2  GLU 101           2HB      GLU 101  -3.057  17.351   0.248
  775    HB3  GLU 101           3HB      GLU 101  -2.076  17.606  -1.214
  776    HG2  GLU 101           2HG      GLU 101  -1.014  18.737   0.631
  777    HG3  GLU 101           3HG      GLU 101  -1.668  19.966  -0.477
  778    H    ALA 102           H        ALA 102  -4.325  21.100  -1.284
  779    HA   ALA 102           HA       ALA 102  -2.540  21.806  -3.521
  780    HB1  ALA 102           1HB      ALA 102  -5.558  22.188  -3.742
  781    HB2  ALA 102           2HB      ALA 102  -4.336  22.874  -4.839
  782    HB3  ALA 102           3HB      ALA 102  -4.570  21.112  -4.758
  783    H    SER 103           H        SER 103  -2.208  24.060  -3.624
  784    HA   SER 103           HA       SER 103  -2.428  25.604  -1.234
  785    HB2  SER 103           2HB      SER 103  -2.174  26.641  -4.076
  786    HB3  SER 103           3HB      SER 103  -1.610  27.415  -2.576
  787    HG   SER 103           HG       SER 103   0.097  26.343  -3.721
  788    H    THR 104           H        THR 104  -3.740  27.340  -0.678
  789    HA   THR 104           HA       THR 104  -6.535  27.281  -1.228
  790    HB   THR 104           HB       THR 104  -4.952  29.730  -0.420
  791    HG1  THR 104           1HG      THR 104  -5.017  28.856   1.719
  792   HG21  THR 104          1HG2      THR 104  -7.643  28.622   0.507
  793   HG22  THR 104          2HG2      THR 104  -6.884  30.124   1.085
  794   HG23  THR 104          3HG2      THR 104  -7.413  29.991  -0.608
  795    HA   PRO 105           HA       PRO 105  -6.560  29.178  -5.252
  796    HB2  PRO 105           2HB      PRO 105  -9.230  29.827  -5.449
  797    HB3  PRO 105           3HB      PRO 105  -8.592  28.189  -5.732
  798    HG2  PRO 105           2HG      PRO 105  -9.878  29.401  -3.217
  799    HG3  PRO 105           3HG      PRO 105 -10.151  27.788  -3.920
  800    HD2  PRO 105           2HD      PRO 105  -8.411  28.176  -1.800
  801    HD3  PRO 105           3HD      PRO 105  -8.112  26.926  -3.031
  802    H    GLN 106           H        GLN 106  -6.746  31.253  -6.165
  803    HA   GLN 106           HA       GLN 106  -7.449  33.573  -4.398
  804    HB2  GLN 106           2HB      GLN 106  -5.016  33.297  -6.194
  805    HB3  GLN 106           3HB      GLN 106  -5.501  34.766  -5.315
  806    HG2  GLN 106           2HG      GLN 106  -5.222  33.499  -3.151
  807    HG3  GLN 106           3HG      GLN 106  -4.608  32.117  -4.088
  808   HE21  GLN 106          2HE2      GLN 106  -3.781  35.116  -2.565
  809   HE22  GLN 106          1HE2      GLN 106  -2.128  35.204  -3.141
  810    H    GLY 107           H        GLY 107  -8.470  31.978  -6.895
  811    HA2  GLY 107           2HA      GLY 107 -10.098  33.991  -8.063
  812    HA3  GLY 107           3HA      GLY 107  -8.714  33.702  -9.144
  813    H    PHE 108           H        PHE 108 -11.139  33.046 -10.114
  814    HA   PHE 108           HA       PHE 108 -11.149  30.073 -10.204
  815    HB2  PHE 108           2HB      PHE 108 -13.584  31.792  -9.573
  816    HB3  PHE 108           3HB      PHE 108 -13.632  30.048  -9.919
  817    HD1  PHE 108           HD2      PHE 108 -12.503  28.441  -8.329
  818    HD2  PHE 108           HD1      PHE 108 -13.159  32.610  -7.400
  819    HE1  PHE 108           HE2      PHE 108 -12.175  27.953  -5.905
  820    HE2  PHE 108           HE1      PHE 108 -12.825  32.122  -4.978
  821    HZ   PHE 108           HZ       PHE 108 -12.337  29.792  -4.227
  822    H    ASN 109           H        ASN 109 -12.245  29.276 -12.019
  823    HA   ASN 109           HA       ASN 109 -13.131  31.027 -14.223
  824    HB2  ASN 109           2HB      ASN 109 -10.580  30.905 -14.368
  825    HB3  ASN 109           3HB      ASN 109 -10.775  29.151 -14.597
  826   HD21  ASN 109          2HD2      ASN 109 -11.434  28.364 -16.658
  827   HD22  ASN 109          1HD2      ASN 109 -11.667  29.433 -18.029
  828    H    THR 110           H        THR 110 -14.090  29.620 -15.952
  829    HA   THR 110           HA       THR 110 -15.330  27.171 -15.195
  830    HB   THR 110           HB       THR 110 -15.598  26.991 -17.751
  831    HG1  THR 110           1HG      THR 110 -15.041  28.946 -18.856
  832   HG21  THR 110          1HG2      THR 110 -16.388  29.607 -16.384
  833   HG22  THR 110          2HG2      THR 110 -17.145  28.931 -17.845
  834   HG23  THR 110          3HG2      THR 110 -17.289  28.076 -16.291
  835    H    LEU 111           H        LEU 111 -14.906  25.012 -16.372
  836    HA   LEU 111           HA       LEU 111 -12.414  23.930 -15.621
  837    HB2  LEU 111           2HB      LEU 111 -14.458  22.658 -16.059
  838    HB3  LEU 111           3HB      LEU 111 -14.309  22.988 -17.802
  839    HG   LEU 111           HG       LEU 111 -12.167  21.740 -17.852
  840   HD11  LEU 111          1HD1      LEU 111 -12.802  21.028 -14.949
  841   HD12  LEU 111          2HD1      LEU 111 -11.493  20.324 -15.928
  842   HD13  LEU 111          3HD1      LEU 111 -11.450  22.048 -15.494
  843   HD21  LEU 111          3HD2      LEU 111 -14.491  20.184 -16.645
  844   HD22  LEU 111          1HD2      LEU 111 -14.260  20.569 -18.367
  845   HD23  LEU 111          2HD2      LEU 111 -13.129  19.472 -17.541
  846    H    LYS 112           H        LYS 112 -13.342  25.172 -18.788
  847    HA   LYS 112           HA       LYS 112 -10.574  26.067 -19.242
  848    HB2  LYS 112           2HB      LYS 112 -10.359  25.112 -21.416
  849    HB3  LYS 112           3HB      LYS 112 -10.681  23.798 -20.260
  850    HG2  LYS 112           2HG      LYS 112 -13.002  23.645 -21.007
  851    HG3  LYS 112           3HG      LYS 112 -12.789  25.058 -22.066
  852    HD2  LYS 112           2HD      LYS 112 -10.855  23.611 -23.128
  853    HD3  LYS 112           3HD      LYS 112 -11.726  22.250 -22.383
  854    HE2  LYS 112           2HE      LYS 112 -12.618  22.375 -24.563
  855    HE3  LYS 112           3HE      LYS 112 -13.829  23.186 -23.541
  856    HZ1  LYS 112           3HZ      LYS 112 -12.899  25.297 -24.227
  857    HZ2  LYS 112           1HZ      LYS 112 -11.778  24.543 -25.174
  858    HZ3  LYS 112           2HZ      LYS 112 -13.380  24.431 -25.548
  859    H    ASP 113           H        ASP 113 -10.628  27.544 -21.324
  860    HA   ASP 113           HA       ASP 113 -12.886  29.324 -21.263
  861    HB2  ASP 113           2HB      ASP 113 -10.733  30.117 -22.056
  862    HB3  ASP 113           3HB      ASP 113 -10.708  28.873 -23.328
  863    H    LYS 114           H        LYS 114 -14.837  29.118 -22.235
  864    HA   LYS 114           HA       LYS 114 -15.230  27.472 -24.660
  865    HB2  LYS 114           2HB      LYS 114 -15.397  25.803 -22.954
  866    HB3  LYS 114           3HB      LYS 114 -16.417  26.857 -21.949
  867    HG2  LYS 114           2HG      LYS 114 -17.824  25.153 -22.909
  868    HG3  LYS 114           3HG      LYS 114 -18.207  26.706 -23.686
  869    HD2  LYS 114           2HD      LYS 114 -16.652  26.015 -25.570
  870    HD3  LYS 114           3HD      LYS 114 -16.595  24.401 -24.823
  871    HE2  LYS 114           2HE      LYS 114 -19.044  25.821 -25.927
  872    HE3  LYS 114           3HE      LYS 114 -18.201  24.437 -26.662
  873    HZ1  LYS 114           3HZ      LYS 114 -18.865  23.115 -24.775
  874    HZ2  LYS 114           1HZ      LYS 114 -19.649  24.401 -24.093
  875    HZ3  LYS 114           2HZ      LYS 114 -20.192  23.760 -25.511
  876    H    LEU 115           H        LEU 115 -16.594  28.599 -25.926
  877    HA   LEU 115           HA       LEU 115 -18.211  30.813 -25.036
  878    HB2  LEU 115           2HB      LEU 115 -17.365  30.539 -27.223
  879    HB3  LEU 115           3HB      LEU 115 -18.341  29.091 -27.561
  880    HG   LEU 115           HG       LEU 115 -19.164  31.241 -28.615
  881   HD11  LEU 115          1HD1      LEU 115 -21.136  29.987 -26.647
  882   HD12  LEU 115          2HD1      LEU 115 -21.569  30.981 -28.055
  883   HD13  LEU 115          3HD1      LEU 115 -20.793  29.397 -28.289
  884   HD21  LEU 115          3HD2      LEU 115 -19.765  32.110 -25.815
  885   HD22  LEU 115          1HD2      LEU 115 -18.624  32.833 -26.973
  886   HD23  LEU 115          2HD2      LEU 115 -20.372  32.877 -27.300
  887    H    GLU 116           H        GLU 116 -19.922  30.621 -23.771
  888    HA   GLU 116           HA       GLU 116 -22.053  28.674 -24.358
  889    HB2  GLU 116           2HB      GLU 116 -20.247  27.899 -22.507
  890    HB3  GLU 116           3HB      GLU 116 -21.302  28.904 -21.487
  891    HG2  GLU 116           2HG      GLU 116 -22.074  26.680 -21.304
  892    HG3  GLU 116           3HG      GLU 116 -23.269  27.520 -22.320
  893    H    GLU 117           H        GLU 117 -23.879  29.282 -22.619
  894    HA   GLU 117           HA       GLU 117 -24.775  31.896 -23.264
  895    HB2  GLU 117           2HB      GLU 117 -26.011  29.761 -22.518
  896    HB3  GLU 117           3HB      GLU 117 -25.652  30.301 -20.862
  897    HG2  GLU 117           2HG      GLU 117 -27.882  31.050 -21.358
  898    HG3  GLU 117           3HG      GLU 117 -26.811  32.469 -21.413
  899    H    TRP 118           H        TRP 118 -22.770  30.936 -20.517
  900    HA   TRP 118           HA       TRP 118 -23.097  33.270 -18.948
  901    HB2  TRP 118           2HB      TRP 118 -20.739  32.745 -18.156
  902    HB3  TRP 118           3HB      TRP 118 -21.952  31.453 -18.009
  903    HD1  TRP 118           HD1      TRP 118 -19.574  32.343 -20.811
  904    HE1  TRP 118           HE1      TRP 118 -18.180  30.168 -21.483
  905    HE3  TRP 118           HE3      TRP 118 -21.474  29.081 -17.353
  906    HZ2  TRP 118           HZ2      TRP 118 -17.980  27.503 -20.544
  907    HZ3  TRP 118           HZ3      TRP 118 -20.727  26.809 -17.223
  908    HH2  TRP 118           HH2      TRP 118 -18.984  25.918 -18.783
  909    H    ILE 119           H        ILE 119 -21.555  33.195 -22.074
  910    HA   ILE 119           HA       ILE 119 -20.151  35.693 -21.879
  911    HB   ILE 119           HB       ILE 119 -20.217  34.078 -23.857
  912   HG12  ILE 119          2HG1      ILE 119 -20.784  36.936 -24.563
  913   HG13  ILE 119          3HG1      ILE 119 -19.272  36.365 -23.819
  914   HG21  ILE 119          1HG2      ILE 119 -22.860  35.513 -24.428
  915   HG22  ILE 119          2HG2      ILE 119 -22.008  34.428 -25.551
  916   HG23  ILE 119          3HG2      ILE 119 -22.684  33.787 -24.037
  917   HD11  ILE 119          3HD1      ILE 119 -18.867  34.889 -25.771
  918   HD12  ILE 119          1HD1      ILE 119 -20.378  35.460 -26.517
  919   HD13  ILE 119          2HD1      ILE 119 -19.024  36.588 -26.276
  920    H    GLU 120           H        GLU 120 -23.569  35.249 -21.640
  921    HA   GLU 120           HA       GLU 120 -24.389  37.922 -22.139
  922    HB2  GLU 120           2HB      GLU 120 -25.823  35.902 -21.825
  923    HB3  GLU 120           3HB      GLU 120 -25.438  35.949 -20.088
  924    HG2  GLU 120           2HG      GLU 120 -26.546  38.132 -19.860
  925    HG3  GLU 120           3HG      GLU 120 -26.761  38.202 -21.625
  926    H    MET 121           H        MET 121 -22.648  36.671 -19.309
  927    HA   MET 121           HA       MET 121 -22.596  39.435 -18.190
  928    HB2  MET 121           2HB      MET 121 -23.333  38.750 -16.059
  929    HB3  MET 121           3HB      MET 121 -24.544  38.207 -17.243
  930    HG2  MET 121           2HG      MET 121 -22.390  36.409 -16.125
  931    HG3  MET 121           3HG      MET 121 -23.971  36.619 -15.336
  932    HE1  MET 121           3HE      MET 121 -22.708  33.792 -16.108
  933    HE2  MET 121           1HE      MET 121 -24.286  33.992 -15.309
  934    HE3  MET 121           2HE      MET 121 -24.143  32.954 -16.747
  935    H    SER 122           H        SER 122 -20.732  36.839 -19.037
  936    HA   SER 122           HA       SER 122 -18.538  37.778 -17.239
  937    HB2  SER 122           2HB      SER 122 -19.257  34.876 -17.786
  938    HB3  SER 122           3HB      SER 122 -17.880  35.465 -16.824
  939    HG   SER 122           HG       SER 122 -19.688  34.854 -15.510
  940    H    ASN 123           H        ASN 123 -16.585  37.805 -18.179
  941    HA   ASN 123           HA       ASN 123 -15.925  36.379 -20.661
  942    HB2  ASN 123           2HB      ASN 123 -17.011  38.393 -21.617
  943    HB3  ASN 123           3HB      ASN 123 -16.026  39.409 -20.538
  944   HD21  ASN 123          2HD2      ASN 123 -15.668  36.900 -23.118
  945   HD22  ASN 123          1HD2      ASN 123 -14.232  37.616 -23.820
  946    H    ARG 124           H        ARG 124 -13.632  36.256 -20.871
  947    HA   ARG 124           HA       ARG 124 -11.893  38.032 -19.238
  948    HB2  ARG 124           2HB      ARG 124 -12.277  36.001 -17.878
  949    HB3  ARG 124           3HB      ARG 124 -11.731  34.996 -19.241
  950    HG2  ARG 124           2HG      ARG 124  -9.509  35.927 -19.124
  951    HG3  ARG 124           3HG      ARG 124 -10.024  37.126 -17.914
  952    HD2  ARG 124           2HD      ARG 124  -8.742  35.314 -16.849
  953    HD3  ARG 124           3HD      ARG 124 -10.429  35.314 -16.284
  954    HE   ARG 124           HE       ARG 124 -10.737  33.258 -17.165
  955   HH11  ARG 124          1HH1      ARG 124  -7.749  34.505 -18.635
  956   HH12  ARG 124          2HH1      ARG 124  -7.367  32.973 -19.398
  957   HH21  ARG 124          1HH2      ARG 124 -10.208  31.324 -18.143
  958   HH22  ARG 124          2HH2      ARG 124  -8.760  31.172 -19.118
  959    H    LYS 125           H        LYS 125  -9.973  38.457 -20.266
  960    HA   LYS 125           HA       LYS 125  -9.218  37.038 -22.780
  961    HB2  LYS 125           2HB      LYS 125  -9.071  39.123 -24.002
  962    HB3  LYS 125           3HB      LYS 125 -10.737  38.844 -23.443
  963    HG2  LYS 125           2HG      LYS 125 -10.403  40.471 -21.607
  964    HG3  LYS 125           3HG      LYS 125  -8.726  40.738 -22.139
  965    HD2  LYS 125           2HD      LYS 125  -9.552  41.585 -24.319
  966    HD3  LYS 125           3HD      LYS 125 -11.230  41.317 -23.788
  967    HE2  LYS 125           2HE      LYS 125 -10.894  42.897 -21.922
  968    HE3  LYS 125           3HE      LYS 125  -9.214  43.162 -22.446
  969    HZ1  LYS 125           3HZ      LYS 125 -10.066  44.061 -24.501
  970    HZ2  LYS 125           1HZ      LYS 125 -11.624  43.815 -24.015
  971    HZ3  LYS 125           2HZ      LYS 125 -10.673  44.903 -23.219
  972    H    ASP 126           H        ASP 126  -8.186  37.398 -19.975
  973    HA   ASP 126           HA       ASP 126  -5.337  37.794 -20.709
  974    HB2  ASP 126           2HB      ASP 126  -6.197  40.030 -19.938
  975    HB3  ASP 126           3HB      ASP 126  -6.705  39.226 -18.434
  976    H    LEU 127           H        LEU 127  -3.931  36.877 -18.909
  977    HA   LEU 127           HA       LEU 127  -4.985  34.310 -18.173
  978    HB2  LEU 127           2HB      LEU 127  -2.525  35.708 -17.142
  979    HB3  LEU 127           3HB      LEU 127  -2.857  33.966 -17.008
  980    HG   LEU 127           HG       LEU 127  -2.323  35.502 -19.601
  981   HD11  LEU 127          1HD1      LEU 127  -0.699  33.389 -18.110
  982   HD12  LEU 127          2HD1      LEU 127  -0.266  34.116 -19.676
  983   HD13  LEU 127          3HD1      LEU 127  -0.305  35.122 -18.209
  984   HD21  LEU 127          3HD2      LEU 127  -2.833  32.542 -19.225
  985   HD22  LEU 127          1HD2      LEU 127  -3.920  33.708 -20.015
  986   HD23  LEU 127          2HD2      LEU 127  -2.335  33.344 -20.734
  987    H    ILE 128           H        ILE 128  -6.075  33.663 -16.458
  988    HA   ILE 128           HA       ILE 128  -7.197  35.488 -14.533
  989    HB   ILE 128           HB       ILE 128  -8.257  33.348 -15.246
  990   HG12  ILE 128          2HG1      ILE 128  -9.015  32.473 -13.137
  991   HG13  ILE 128          3HG1      ILE 128  -7.777  33.437 -12.298
  992   HG21  ILE 128          1HG2      ILE 128  -6.058  31.998 -13.599
  993   HG22  ILE 128          2HG2      ILE 128  -7.478  31.182 -14.294
  994   HG23  ILE 128          3HG2      ILE 128  -6.245  31.886 -15.365
  995   HD11  ILE 128          3HD1      ILE 128  -8.817  35.521 -13.159
  996   HD12  ILE 128          1HD1      ILE 128 -10.054  34.557 -13.999
  997   HD13  ILE 128          2HD1      ILE 128  -9.986  34.564 -12.221
  998    H    LYS 129           H        LYS 129  -4.203  33.679 -14.215
  999    HA   LYS 129           HA       LYS 129  -3.994  34.174 -11.381
 1000    HB2  LYS 129           2HB      LYS 129  -1.734  33.426 -11.602
 1001    HB3  LYS 129           3HB      LYS 129  -2.785  32.394 -12.600
 1002    HG2  LYS 129           2HG      LYS 129  -2.061  33.628 -14.632
 1003    HG3  LYS 129           3HG      LYS 129  -1.002  34.649 -13.631
 1004    HD2  LYS 129           2HD      LYS 129   0.268  32.630 -12.931
 1005    HD3  LYS 129           3HD      LYS 129  -0.781  31.623 -13.957
 1006    HE2  LYS 129           2HE      LYS 129  -0.052  32.880 -15.949
 1007    HE3  LYS 129           3HE      LYS 129   0.983  33.906 -14.928
 1008    HZ1  LYS 129           3HZ      LYS 129   2.247  31.947 -14.355
 1009    HZ2  LYS 129           1HZ      LYS 129   1.287  30.996 -15.300
 1010    HZ3  LYS 129           2HZ      LYS 129   2.236  32.156 -15.991
 1011    H    LYS 130           H        LYS 130  -3.395  36.352 -14.041
 1012    HA   LYS 130           HA       LYS 130  -1.470  37.984 -12.630
 1013    HB2  LYS 130           2HB      LYS 130  -3.266  38.493 -15.025
 1014    HB3  LYS 130           3HB      LYS 130  -2.094  39.678 -14.403
 1015    HG2  LYS 130           2HG      LYS 130  -0.244  38.233 -14.865
 1016    HG3  LYS 130           3HG      LYS 130  -1.318  36.850 -15.180
 1017    HD2  LYS 130           2HD      LYS 130  -0.414  37.715 -17.272
 1018    HD3  LYS 130           3HD      LYS 130  -2.175  37.957 -17.193
 1019    HE2  LYS 130           2HE      LYS 130  -1.785  40.329 -16.518
 1020    HE3  LYS 130           3HE      LYS 130  -0.034  40.068 -16.707
 1021    HZ1  LYS 130           3HZ      LYS 130  -0.428  39.562 -19.017
 1022    HZ2  LYS 130           1HZ      LYS 130  -2.052  39.802 -18.841
 1023    HZ3  LYS 130           2HZ      LYS 130  -1.004  41.065 -18.659
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1   1.186 -25.413   1.509
    2    H2   MET   1           H2       MET   1  -0.444 -25.464   1.269
    3    H3   MET   1           H3       MET   1   0.281 -24.234   2.202
    4    HA   MET   1           HA       MET   1  -0.343 -24.247  -0.475
    5    HB2  MET   1           2HB      MET   1  -0.513 -22.355   1.130
    6    HB3  MET   1           3HB      MET   1   1.259 -22.280   1.200
    7    HG2  MET   1           2HG      MET   1  -0.237 -22.037  -1.413
    8    HG3  MET   1           3HG      MET   1  -0.043 -20.640  -0.341
    9    HE1  MET   1           3HE      MET   1   0.886 -20.940  -3.493
   10    HE2  MET   1           1HE      MET   1   0.978 -19.418  -2.576
   11    HE3  MET   1           2HE      MET   1   2.409 -20.023  -3.441
   12    H    ALA   2           H        ALA   2   0.760 -24.617  -2.260
   13    HA   ALA   2           HA       ALA   2   3.674 -24.134  -2.393
   14    HB1  ALA   2           1HB      ALA   2   2.362 -26.767  -3.212
   15    HB2  ALA   2           2HB      ALA   2   4.033 -26.282  -3.577
   16    HB3  ALA   2           3HB      ALA   2   3.539 -26.551  -1.893
   17    H    ALA   3           H        ALA   3   4.333 -23.868  -4.604
   18    HA   ALA   3           HA       ALA   3   2.359 -23.883  -6.793
   19    HB1  ALA   3           1HB      ALA   3   3.771 -21.333  -5.885
   20    HB2  ALA   3           2HB      ALA   3   2.832 -21.525  -7.385
   21    HB3  ALA   3           3HB      ALA   3   2.018 -21.638  -5.812
   22    H    LYS   4           H        LYS   4   3.490 -23.438  -8.881
   23    HA   LYS   4           HA       LYS   4   6.016 -24.812  -9.055
   24    HB2  LYS   4           2HB      LYS   4   4.559 -23.033 -11.056
   25    HB3  LYS   4           3HB      LYS   4   5.985 -24.027 -11.426
   26    HG2  LYS   4           2HG      LYS   4   4.730 -26.069 -10.808
   27    HG3  LYS   4           3HG      LYS   4   3.305 -25.080 -10.435
   28    HD2  LYS   4           2HD      LYS   4   3.010 -26.080 -12.608
   29    HD3  LYS   4           3HD      LYS   4   3.206 -24.327 -12.779
   30    HE2  LYS   4           2HE      LYS   4   4.433 -25.386 -14.558
   31    HE3  LYS   4           3HE      LYS   4   5.598 -24.687 -13.415
   32    HZ1  LYS   4           3HZ      LYS   4   5.916 -26.890 -12.493
   33    HZ2  LYS   4           1HZ      LYS   4   4.833 -27.537 -13.558
   34    HZ3  LYS   4           2HZ      LYS   4   6.245 -26.893 -14.107
   35    H    PHE   5           H        PHE   5   5.210 -21.419  -8.662
   36    HA   PHE   5           HA       PHE   5   7.666 -20.285  -9.522
   37    HB2  PHE   5           2HB      PHE   5   5.794 -19.194  -7.356
   38    HB3  PHE   5           3HB      PHE   5   6.974 -18.317  -8.341
   39    HD1  PHE   5           HD1      PHE   5   6.606 -18.224 -10.888
   40    HD2  PHE   5           HD2      PHE   5   3.570 -19.411  -8.062
   41    HE1  PHE   5           HE1      PHE   5   4.859 -17.940 -12.631
   42    HE2  PHE   5           HE2      PHE   5   1.829 -19.157  -9.826
   43    HZ   PHE   5           HZ       PHE   5   2.483 -18.464 -12.124
   44    H    GLU   6           H        GLU   6   9.546 -20.034  -8.644
   45    HA   GLU   6           HA       GLU   6  10.034 -20.251  -5.764
   46    HB2  GLU   6           2HB      GLU   6  11.723 -21.913  -5.962
   47    HB3  GLU   6           3HB      GLU   6  10.203 -22.559  -6.609
   48    HG2  GLU   6           2HG      GLU   6  11.005 -22.223  -8.905
   49    HG3  GLU   6           3HG      GLU   6  12.519 -21.524  -8.302
   50    H    VAL   7           H        VAL   7  12.099 -19.354  -5.217
   51    HA   VAL   7           HA       VAL   7  12.524 -16.869  -6.471
   52    HB   VAL   7           HB       VAL   7  14.464 -18.379  -4.671
   53   HG11  VAL   7          1HG1      VAL   7  13.982 -15.396  -5.114
   54   HG12  VAL   7          2HG1      VAL   7  15.130 -16.097  -3.952
   55   HG13  VAL   7          3HG1      VAL   7  15.386 -16.314  -5.694
   56   HG21  VAL   7          3HG2      VAL   7  12.102 -16.626  -3.909
   57   HG22  VAL   7          1HG2      VAL   7  12.223 -18.372  -3.646
   58   HG23  VAL   7          2HG2      VAL   7  13.312 -17.279  -2.780
   59    H    GLY   8           H        GLY   8  13.533 -16.165  -8.093
   60    HA2  GLY   8           2HA      GLY   8  15.448 -15.953  -9.488
   61    HA3  GLY   8           3HA      GLY   8  15.784 -17.685  -9.291
   62    H    SER   9           H        SER   9  12.721 -18.171  -9.739
   63    HA   SER   9           HA       SER   9  12.856 -18.754 -12.523
   64    HB2  SER   9           2HB      SER   9  10.349 -18.399 -10.848
   65    HB3  SER   9           3HB      SER   9  10.549 -19.377 -12.320
   66    HG   SER   9           HG       SER   9  10.654 -20.652 -10.381
   67    H    VAL  10           H        VAL  10  11.315 -17.962 -14.196
   68    HA   VAL  10           HA       VAL  10  10.592 -15.095 -13.959
   69    HB   VAL  10           HB       VAL  10  12.166 -16.282 -16.284
   70   HG11  VAL  10          1HG1      VAL  10  11.238 -13.420 -15.732
   71   HG12  VAL  10          2HG1      VAL  10  12.242 -13.937 -17.105
   72   HG13  VAL  10          3HG1      VAL  10  10.568 -14.504 -16.969
   73   HG21  VAL  10          3HG2      VAL  10  13.077 -14.249 -14.219
   74   HG22  VAL  10          1HG2      VAL  10  13.666 -15.922 -14.374
   75   HG23  VAL  10          2HG2      VAL  10  13.982 -14.749 -15.666
   76    H    TYR  11           H        TYR  11   8.620 -14.796 -14.672
   77    HA   TYR  11           HA       TYR  11   7.320 -16.624 -16.619
   78    HB2  TYR  11           2HB      TYR  11   6.451 -16.153 -13.744
   79    HB3  TYR  11           3HB      TYR  11   5.343 -16.659 -15.023
   80    HD1  TYR  11           HD2      TYR  11   5.594 -18.861 -16.144
   81    HD2  TYR  11           HD1      TYR  11   8.027 -17.753 -12.760
   82    HE1  TYR  11           HE2      TYR  11   6.131 -21.255 -15.758
   83    HE2  TYR  11           HE1      TYR  11   8.500 -20.156 -12.311
   84    HH   TYR  11           HH       TYR  11   8.202 -22.308 -13.001
   85    H    THR  12           H        THR  12   4.866 -15.658 -16.727
   86    HA   THR  12           HA       THR  12   5.091 -12.692 -17.029
   87    HB   THR  12           HB       THR  12   3.671 -14.603 -18.908
   88    HG1  THR  12           1HG      THR  12   5.463 -14.258 -20.287
   89   HG21  THR  12          1HG2      THR  12   4.580 -11.709 -19.249
   90   HG22  THR  12          2HG2      THR  12   3.766 -12.693 -20.485
   91   HG23  THR  12          3HG2      THR  12   2.910 -12.245 -18.998
   92    H    GLY  13           H        GLY  13   3.235 -11.519 -16.597
   93    HA2  GLY  13           2HA      GLY  13   0.790 -12.848 -15.681
   94    HA3  GLY  13           3HA      GLY  13   1.753 -12.076 -14.404
   95    H    LYS  14           H        LYS  14  -0.618 -10.982 -14.582
   96    HA   LYS  14           HA       LYS  14  -0.276  -8.528 -16.261
   97    HB2  LYS  14           2HB      LYS  14  -2.738 -10.149 -15.605
   98    HB3  LYS  14           3HB      LYS  14  -2.860  -8.414 -15.967
   99    HG2  LYS  14           2HG      LYS  14  -1.658  -8.819 -18.135
  100    HG3  LYS  14           3HG      LYS  14  -1.684 -10.564 -17.788
  101    HD2  LYS  14           2HD      LYS  14  -4.142 -10.519 -17.701
  102    HD3  LYS  14           3HD      LYS  14  -4.127  -8.767 -17.993
  103    HE2  LYS  14           2HE      LYS  14  -4.684  -9.772 -20.067
  104    HE3  LYS  14           3HE      LYS  14  -3.000  -9.216 -20.205
  105    HZ1  LYS  14           3HZ      LYS  14  -2.275 -11.482 -19.849
  106    HZ2  LYS  14           1HZ      LYS  14  -3.847 -12.005 -19.697
  107    HZ3  LYS  14           2HZ      LYS  14  -3.272 -11.413 -21.126
  108    H    VAL  15           H        VAL  15  -0.454  -6.610 -15.361
  109    HA   VAL  15           HA       VAL  15  -0.002  -6.423 -12.511
  110    HB   VAL  15           HB       VAL  15  -0.699  -4.180 -14.420
  111   HG11  VAL  15          1HG1      VAL  15   1.086  -4.303 -11.939
  112   HG12  VAL  15          2HG1      VAL  15   0.802  -2.858 -12.937
  113   HG13  VAL  15          3HG1      VAL  15  -0.534  -3.575 -12.016
  114   HG21  VAL  15          3HG2      VAL  15   2.049  -5.400 -14.070
  115   HG22  VAL  15          1HG2      VAL  15   1.054  -5.424 -15.538
  116   HG23  VAL  15          2HG2      VAL  15   1.672  -3.890 -14.932
  117    H    THR  16           H        THR  16  -1.427  -6.233 -10.937
  118    HA   THR  16           HA       THR  16  -4.313  -5.815 -11.615
  119    HB   THR  16           HB       THR  16  -4.514  -7.251  -9.415
  120    HG1  THR  16           1HG      THR  16  -2.795  -8.742  -9.246
  121   HG21  THR  16          1HG2      THR  16  -3.600  -8.462 -12.065
  122   HG22  THR  16          2HG2      THR  16  -4.512  -9.300 -10.789
  123   HG23  THR  16          3HG2      THR  16  -5.261  -7.965 -11.666
  124    H    GLY  17           H        GLY  17  -1.728  -4.334  -9.872
  125    HA2  GLY  17           2HA      GLY  17  -3.496  -2.164  -9.368
  126    HA3  GLY  17           3HA      GLY  17  -3.210  -3.038  -7.851
  127    H    LEU  18           H        LEU  18  -2.420  -0.391  -8.231
  128    HA   LEU  18           HA       LEU  18   0.536  -0.688  -7.884
  129    HB2  LEU  18           2HB      LEU  18  -1.081   1.680  -8.822
  130    HB3  LEU  18           3HB      LEU  18   0.632   1.789  -8.382
  131    HG   LEU  18           HG       LEU  18  -0.510   0.155 -10.684
  132   HD11  LEU  18          1HD1      LEU  18   1.168   2.698 -10.680
  133   HD12  LEU  18          2HD1      LEU  18   0.675   1.790 -12.124
  134   HD13  LEU  18          3HD1      LEU  18  -0.548   2.592 -11.115
  135   HD21  LEU  18          3HD2      LEU  18   2.372   0.547  -9.900
  136   HD22  LEU  18          1HD2      LEU  18   1.431  -0.957  -9.793
  137   HD23  LEU  18          2HD2      LEU  18   1.784  -0.249 -11.376
  138    H    GLN  19           H        GLN  19   1.412   0.447  -6.219
  139    HA   GLN  19           HA       GLN  19  -0.280   1.711  -4.132
  140    HB2  GLN  19           2HB      GLN  19   1.832  -0.400  -3.613
  141    HB3  GLN  19           3HB      GLN  19   0.907   0.497  -2.396
  142    HG2  GLN  19           2HG      GLN  19  -1.190  -0.673  -3.170
  143    HG3  GLN  19           3HG      GLN  19  -0.204  -1.565  -4.345
  144   HE21  GLN  19          2HE2      GLN  19  -1.302  -1.453  -1.059
  145   HE22  GLN  19          1HE2      GLN  19  -0.318  -2.792  -0.480
  146    H    ALA  20           H        ALA  20   1.181   3.090  -2.742
  147    HA   ALA  20           HA       ALA  20   3.227   4.418  -4.148
  148    HB1  ALA  20           1HB      ALA  20   2.708   4.345  -1.145
  149    HB2  ALA  20           2HB      ALA  20   3.638   5.584  -2.017
  150    HB3  ALA  20           3HB      ALA  20   1.894   5.413  -2.317
  151    H    TYR  21           H        TYR  21   3.498   1.364  -2.729
  152    HA   TYR  21           HA       TYR  21   6.479   1.527  -2.717
  153    HB2  TYR  21           2HB      TYR  21   6.565   0.120  -0.822
  154    HB3  TYR  21           3HB      TYR  21   5.584   1.531  -0.415
  155    HD1  TYR  21           HD1      TYR  21   3.070   1.292  -0.192
  156    HD2  TYR  21           HD2      TYR  21   5.664  -2.114  -0.712
  157    HE1  TYR  21           HE1      TYR  21   1.268  -0.201   0.639
  158    HE2  TYR  21           HE2      TYR  21   3.884  -3.611   0.170
  159    HH   TYR  21           HH       TYR  21   0.685  -2.339   1.210
  160    H    GLY  22           H        GLY  22   4.063   0.248  -4.568
  161    HA2  GLY  22           2HA      GLY  22   5.824  -1.411  -5.911
  162    HA3  GLY  22           3HA      GLY  22   5.031  -2.454  -4.719
  163    H    ALA  23           H        ALA  23   4.643  -3.318  -7.071
  164    HA   ALA  23           HA       ALA  23   1.928  -2.472  -8.049
  165    HB1  ALA  23           1HB      ALA  23   4.353  -3.354  -9.670
  166    HB2  ALA  23           2HB      ALA  23   2.722  -3.073 -10.313
  167    HB3  ALA  23           3HB      ALA  23   3.660  -1.719  -9.644
  168    H    PHE  24           H        PHE  24   0.514  -4.107  -7.781
  169    HA   PHE  24           HA       PHE  24   1.446  -6.811  -7.211
  170    HB2  PHE  24           2HB      PHE  24  -1.273  -5.539  -7.620
  171    HB3  PHE  24           3HB      PHE  24  -1.088  -7.279  -7.369
  172    HD1  PHE  24           HD1      PHE  24   0.551  -7.841  -5.250
  173    HD2  PHE  24           HD2      PHE  24  -1.897  -4.322  -5.762
  174    HE1  PHE  24           HE1      PHE  24   0.457  -7.542  -2.782
  175    HE2  PHE  24           HE2      PHE  24  -2.000  -4.039  -3.295
  176    HZ   PHE  24           HZ       PHE  24  -0.816  -5.636  -1.803
  177    H    VAL  25           H        VAL  25   1.522  -8.510  -8.631
  178    HA   VAL  25           HA       VAL  25   0.314  -8.211 -11.338
  179    HB   VAL  25           HB       VAL  25   3.081  -9.358 -10.798
  180   HG11  VAL  25          1HG1      VAL  25   1.575  -8.739 -13.377
  181   HG12  VAL  25          2HG1      VAL  25   3.229  -9.369 -13.276
  182   HG13  VAL  25          3HG1      VAL  25   1.869 -10.362 -12.714
  183   HG21  VAL  25          3HG2      VAL  25   2.369  -6.699 -12.082
  184   HG22  VAL  25          1HG2      VAL  25   3.174  -6.922 -10.514
  185   HG23  VAL  25          2HG2      VAL  25   3.992  -7.423 -11.999
  186    H    ALA  26           H        ALA  26  -1.225  -9.625 -11.373
  187    HA   ALA  26           HA       ALA  26  -1.190 -12.102  -9.850
  188    HB1  ALA  26           1HB      ALA  26  -3.043 -11.123 -12.050
  189    HB2  ALA  26           2HB      ALA  26  -3.313 -12.543 -11.009
  190    HB3  ALA  26           3HB      ALA  26  -3.287 -10.923 -10.294
  191    H    LEU  27           H        LEU  27  -1.161 -14.164 -10.686
  192    HA   LEU  27           HA       LEU  27   0.601 -14.494 -13.100
  193    HB2  LEU  27           2HB      LEU  27   0.731 -15.670 -10.318
  194    HB3  LEU  27           3HB      LEU  27   1.628 -16.348 -11.684
  195    HG   LEU  27           HG       LEU  27   1.966 -13.456 -10.790
  196   HD11  LEU  27          1HD1      LEU  27   3.614 -15.894  -9.980
  197   HD12  LEU  27          2HD1      LEU  27   4.008 -14.201  -9.607
  198   HD13  LEU  27          3HD1      LEU  27   2.559 -14.949  -8.907
  199   HD21  LEU  27          3HD2      LEU  27   3.724 -15.295 -12.458
  200   HD22  LEU  27          1HD2      LEU  27   2.727 -13.960 -13.073
  201   HD23  LEU  27          2HD2      LEU  27   4.097 -13.617 -12.002
  202    H    ASP  28           H        ASP  28  -1.965 -15.694 -11.064
  203    HA   ASP  28           HA       ASP  28  -3.076 -17.489 -13.076
  204    HB2  ASP  28           2HB      ASP  28  -1.806 -19.221 -12.373
  205    HB3  ASP  28           3HB      ASP  28  -1.405 -18.461 -10.832
  206    H    GLU  29           H        GLU  29  -5.239 -18.268 -12.202
  207    HA   GLU  29           HA       GLU  29  -6.642 -16.027 -11.169
  208    HB2  GLU  29           2HB      GLU  29  -8.602 -17.429 -11.263
  209    HB3  GLU  29           3HB      GLU  29  -7.602 -17.659 -12.710
  210    HG2  GLU  29           2HG      GLU  29  -6.727 -19.770 -11.790
  211    HG3  GLU  29           3HG      GLU  29  -7.695 -19.554 -10.322
  212    H    GLU  30           H        GLU  30  -4.947 -18.287  -9.271
  213    HA   GLU  30           HA       GLU  30  -6.150 -17.015  -6.847
  214    HB2  GLU  30           2HB      GLU  30  -5.366 -19.922  -7.257
  215    HB3  GLU  30           3HB      GLU  30  -5.748 -19.191  -5.685
  216    HG2  GLU  30           2HG      GLU  30  -8.019 -18.612  -6.542
  217    HG3  GLU  30           3HG      GLU  30  -7.658 -19.491  -8.038
  218    H    THR  31           H        THR  31  -3.533 -16.689  -8.632
  219    HA   THR  31           HA       THR  31  -1.671 -16.597  -6.291
  220    HB   THR  31           HB       THR  31  -0.802 -17.614  -9.008
  221    HG1  THR  31           1HG      THR  31  -0.932 -19.716  -8.138
  222   HG21  THR  31          1HG2      THR  31   0.348 -17.936  -6.197
  223   HG22  THR  31          2HG2      THR  31   1.059 -18.591  -7.688
  224   HG23  THR  31          3HG2      THR  31   0.965 -16.835  -7.451
  225    H    GLN  32           H        GLN  32  -0.456 -14.872  -6.182
  226    HA   GLN  32           HA       GLN  32  -0.055 -12.982  -8.408
  227    HB2  GLN  32           2HB      GLN  32  -2.256 -12.386  -7.609
  228    HB3  GLN  32           3HB      GLN  32  -1.710 -12.443  -5.922
  229    HG2  GLN  32           2HG      GLN  32  -0.436 -10.446  -6.154
  230    HG3  GLN  32           3HG      GLN  32  -0.609 -10.415  -7.914
  231   HE21  GLN  32          2HE2      GLN  32  -1.746  -9.000  -5.098
  232   HE22  GLN  32          1HE2      GLN  32  -3.286  -8.440  -5.696
  233    H    GLY  33           H        GLY  33   1.599 -11.462  -7.883
  234    HA2  GLY  33           2HA      GLY  33   2.854 -11.669  -5.199
  235    HA3  GLY  33           3HA      GLY  33   3.865 -11.836  -6.651
  236    H    LEU  34           H        LEU  34   4.700  -9.901  -5.222
  237    HA   LEU  34           HA       LEU  34   3.463  -7.337  -6.161
  238    HB2  LEU  34           2HB      LEU  34   2.867  -7.726  -3.864
  239    HB3  LEU  34           3HB      LEU  34   4.547  -8.112  -3.434
  240    HG   LEU  34           HG       LEU  34   5.219  -5.783  -3.912
  241   HD11  LEU  34          1HD1      LEU  34   2.243  -5.260  -4.355
  242   HD12  LEU  34          2HD1      LEU  34   3.512  -4.027  -4.265
  243   HD13  LEU  34          3HD1      LEU  34   3.509  -5.183  -5.598
  244   HD21  LEU  34          3HD2      LEU  34   2.853  -5.999  -2.010
  245   HD22  LEU  34          1HD2      LEU  34   4.553  -6.379  -1.632
  246   HD23  LEU  34          2HD2      LEU  34   4.074  -4.709  -2.002
  247    H    VAL  35           H        VAL  35   4.855  -6.470  -7.569
  248    HA   VAL  35           HA       VAL  35   7.758  -6.714  -7.339
  249    HB   VAL  35           HB       VAL  35   6.089  -4.687  -8.892
  250   HG11  VAL  35          1HG1      VAL  35   8.950  -5.692  -9.250
  251   HG12  VAL  35          2HG1      VAL  35   8.122  -4.530 -10.309
  252   HG13  VAL  35          3HG1      VAL  35   8.485  -4.098  -8.630
  253   HG21  VAL  35          3HG2      VAL  35   7.130  -7.357  -9.887
  254   HG22  VAL  35          1HG2      VAL  35   5.421  -6.924  -9.619
  255   HG23  VAL  35          2HG2      VAL  35   6.361  -6.092 -10.867
  256    H    HIS  36           H        HIS  36   8.839  -5.601  -5.664
  257    HA   HIS  36           HA       HIS  36   7.547  -3.429  -4.217
  258    HB2  HIS  36           2HB      HIS  36   9.172  -4.985  -3.225
  259    HB3  HIS  36           3HB      HIS  36  10.473  -4.347  -4.250
  260    HD1  HIS  36           HD1      HIS  36   7.992  -2.043  -2.363
  261    HD2  HIS  36           HD2      HIS  36  11.993  -3.415  -2.225
  262    HE1  HIS  36           HE1      HIS  36   9.142  -0.696  -0.612
  263    H    ILE  37           H        ILE  37   7.963  -1.177  -4.477
  264    HA   ILE  37           HA       ILE  37   8.571  -0.174  -7.062
  265    HB   ILE  37           HB       ILE  37   7.337   1.048  -5.252
  266   HG12  ILE  37          2HG1      ILE  37   9.617   2.605  -6.446
  267   HG13  ILE  37          3HG1      ILE  37   8.184   2.046  -7.335
  268   HG21  ILE  37          1HG2      ILE  37  10.138   1.581  -4.141
  269   HG22  ILE  37          2HG2      ILE  37   8.649   2.370  -3.597
  270   HG23  ILE  37          3HG2      ILE  37   8.864   0.634  -3.339
  271   HD11  ILE  37          3HD1      ILE  37   6.724   3.385  -5.842
  272   HD12  ILE  37          1HD1      ILE  37   8.153   3.956  -4.954
  273   HD13  ILE  37          2HD1      ILE  37   7.932   4.408  -6.651
  274    H    SER  38           H        SER  38  10.942  -0.744  -4.519
  275    HA   SER  38           HA       SER  38  13.144   0.358  -5.993
  276    HB2  SER  38           2HB      SER  38  13.201  -1.834  -3.893
  277    HB3  SER  38           3HB      SER  38  14.481  -0.665  -4.287
  278    HG   SER  38           HG       SER  38  13.272  -0.065  -2.405
  279    H    GLU  39           H        GLU  39  11.324  -2.244  -6.840
  280    HA   GLU  39           HA       GLU  39  13.529  -3.614  -8.326
  281    HB2  GLU  39           2HB      GLU  39  10.951  -4.688  -7.137
  282    HB3  GLU  39           3HB      GLU  39  12.005  -5.595  -8.217
  283    HG2  GLU  39           2HG      GLU  39  12.886  -4.485  -5.521
  284    HG3  GLU  39           3HG      GLU  39  12.278  -6.123  -5.796
  285    H    VAL  40           H        VAL  40  11.021  -1.450  -8.737
  286    HA   VAL  40           HA       VAL  40   9.892  -2.504 -11.224
  287    HB   VAL  40           HB       VAL  40   9.836   0.186  -9.827
  288   HG11  VAL  40          1HG1      VAL  40   8.229  -0.659 -12.273
  289   HG12  VAL  40          2HG1      VAL  40   7.996   0.839 -11.341
  290   HG13  VAL  40          3HG1      VAL  40   9.499   0.580 -12.245
  291   HG21  VAL  40          3HG2      VAL  40   7.736  -1.995 -10.178
  292   HG22  VAL  40          1HG2      VAL  40   8.607  -1.609  -8.686
  293   HG23  VAL  40          2HG2      VAL  40   7.474  -0.433  -9.368
  294    H    THR  41           H        THR  41  12.665  -0.495 -10.390
  295    HA   THR  41           HA       THR  41  13.667  -0.624 -13.165
  296    HB   THR  41           HB       THR  41  12.932   1.942 -11.713
  297    HG1  THR  41           1HG      THR  41  11.730   2.230 -13.641
  298   HG21  THR  41          1HG2      THR  41  14.358   1.660 -14.401
  299   HG22  THR  41          2HG2      THR  41  13.769   3.178 -13.686
  300   HG23  THR  41          3HG2      THR  41  15.082   2.290 -12.901
  301    H    HIS  42           H        HIS  42  15.952  -0.211 -13.172
  302    HA   HIS  42           HA       HIS  42  17.252  -0.967 -10.664
  303    HB2  HIS  42           2HB      HIS  42  17.663  -1.820 -13.109
  304    HB3  HIS  42           3HB      HIS  42  18.726  -0.412 -13.268
  305    HD1  HIS  42           HD1      HIS  42  20.457  -0.349 -10.855
  306    HD2  HIS  42           HD2      HIS  42  19.011  -3.991 -12.439
  307    HE1  HIS  42           HE1      HIS  42  21.942  -2.152  -9.950
  308    H    GLY  43           H        GLY  43  16.122   1.476 -10.279
  309    HA2  GLY  43           2HA      GLY  43  18.148   3.210  -9.356
  310    HA3  GLY  43           3HA      GLY  43  17.648   3.767 -10.967
  311    H    PHE  44           H        PHE  44  16.942   5.655  -9.579
  312    HA   PHE  44           HA       PHE  44  14.687   5.572  -7.875
  313    HB2  PHE  44           2HB      PHE  44  15.535   7.772  -9.811
  314    HB3  PHE  44           3HB      PHE  44  14.456   7.966  -8.422
  315    HD1  PHE  44           HD1      PHE  44  15.429   7.370  -6.077
  316    HD2  PHE  44           HD2      PHE  44  17.829   8.178  -9.572
  317    HE1  PHE  44           HE1      PHE  44  17.376   7.897  -4.620
  318    HE2  PHE  44           HE2      PHE  44  19.773   8.704  -8.112
  319    HZ   PHE  44           HZ       PHE  44  19.551   8.562  -5.636
  320    H    VAL  45           H        VAL  45  12.532   6.234  -8.237
  321    HA   VAL  45           HA       VAL  45  11.377   5.610 -10.930
  322    HB   VAL  45           HB       VAL  45  10.452   4.858  -8.133
  323   HG11  VAL  45          1HG1      VAL  45   8.971   4.448 -10.769
  324   HG12  VAL  45          2HG1      VAL  45   8.483   3.797  -9.192
  325   HG13  VAL  45          3HG1      VAL  45   8.480   5.549  -9.461
  326   HG21  VAL  45          3HG2      VAL  45  11.144   3.150 -10.561
  327   HG22  VAL  45          1HG2      VAL  45  12.114   3.319  -9.081
  328   HG23  VAL  45          2HG2      VAL  45  10.525   2.541  -9.008
  329    H    LYS  46           H        LYS  46  10.276   7.232 -11.773
  330    HA   LYS  46           HA       LYS  46  10.227   9.858 -10.669
  331    HB2  LYS  46           2HB      LYS  46   8.507   8.579 -12.832
  332    HB3  LYS  46           3HB      LYS  46   8.610  10.322 -12.518
  333    HG2  LYS  46           2HG      LYS  46  10.921  10.391 -13.177
  334    HG3  LYS  46           3HG      LYS  46  11.030   8.623 -13.238
  335    HD2  LYS  46           2HD      LYS  46   9.188  10.220 -15.058
  336    HD3  LYS  46           3HD      LYS  46  10.866   9.820 -15.491
  337    HE2  LYS  46           2HE      LYS  46  10.359   7.408 -15.195
  338    HE3  LYS  46           3HE      LYS  46   8.674   7.818 -14.812
  339    HZ1  LYS  46           3HZ      LYS  46   8.455   8.720 -17.031
  340    HZ2  LYS  46           1HZ      LYS  46  10.024   8.331 -17.382
  341    HZ3  LYS  46           2HZ      LYS  46   8.917   7.141 -17.091
  342    H    ASP  47           H        ASP  47   7.616   7.645 -11.251
  343    HA   ASP  47           HA       ASP  47   6.472   7.647  -8.614
  344    HB2  ASP  47           2HB      ASP  47   5.288   9.619  -9.262
  345    HB3  ASP  47           3HB      ASP  47   4.934   8.980 -10.877
  346    H    ILE  48           H        ILE  48   5.276   5.559  -8.588
  347    HA   ILE  48           HA       ILE  48   6.210   3.692 -10.575
  348    HB   ILE  48           HB       ILE  48   5.694   3.248  -8.139
  349   HG12  ILE  48          2HG1      ILE  48   4.435   1.378 -10.116
  350   HG13  ILE  48          3HG1      ILE  48   6.169   1.542  -9.780
  351   HG21  ILE  48          1HG2      ILE  48   2.804   3.220  -9.129
  352   HG22  ILE  48          2HG2      ILE  48   3.348   2.675  -7.537
  353   HG23  ILE  48          3HG2      ILE  48   3.495   4.376  -7.974
  354   HD11  ILE  48          3HD1      ILE  48   5.787   0.883  -7.421
  355   HD12  ILE  48          1HD1      ILE  48   4.051   0.707  -7.755
  356   HD13  ILE  48          2HD1      ILE  48   5.211  -0.369  -8.542
  357    H    ASN  49           H        ASN  49   3.124   5.437 -10.647
  358    HA   ASN  49           HA       ASN  49   2.178   3.795 -12.818
  359    HB2  ASN  49           2HB      ASN  49   0.326   5.028 -12.681
  360    HB3  ASN  49           3HB      ASN  49   1.042   5.785 -11.248
  361   HD21  ASN  49          2HD2      ASN  49   2.445   7.771 -11.692
  362   HD22  ASN  49          1HD2      ASN  49   1.913   8.837 -13.004
  363    H    GLU  50           H        GLU  50   4.636   6.200 -12.804
  364    HA   GLU  50           HA       GLU  50   4.496   6.605 -15.722
  365    HB2  GLU  50           2HB      GLU  50   6.661   7.413 -13.764
  366    HB3  GLU  50           3HB      GLU  50   6.438   8.003 -15.412
  367    HG2  GLU  50           2HG      GLU  50   4.622   8.538 -13.030
  368    HG3  GLU  50           3HG      GLU  50   5.767   9.653 -13.785
  369    H    HIS  51           H        HIS  51   5.391   4.003 -13.932
  370    HA   HIS  51           HA       HIS  51   7.519   3.149 -15.859
  371    HB2  HIS  51           2HB      HIS  51   7.485   2.704 -12.825
  372    HB3  HIS  51           3HB      HIS  51   8.518   1.884 -14.005
  373    HD1  HIS  51           HD1      HIS  51  10.819   2.871 -13.962
  374    HD2  HIS  51           HD2      HIS  51   7.865   5.730 -13.172
  375    HE1  HIS  51           HE1      HIS  51  12.046   5.013 -13.516
  376    H    LEU  52           H        LEU  52   4.651   2.288 -14.012
  377    HA   LEU  52           HA       LEU  52   4.375  -0.196 -15.610
  378    HB2  LEU  52           2HB      LEU  52   4.388   0.060 -12.604
  379    HB3  LEU  52           3HB      LEU  52   3.361  -1.158 -13.377
  380    HG   LEU  52           HG       LEU  52   6.386  -0.979 -13.743
  381   HD11  LEU  52          1HD1      LEU  52   4.690  -2.874 -12.063
  382   HD12  LEU  52          2HD1      LEU  52   6.449  -2.988 -12.299
  383   HD13  LEU  52          3HD1      LEU  52   5.758  -1.600 -11.432
  384   HD21  LEU  52          3HD2      LEU  52   4.409  -3.151 -14.551
  385   HD22  LEU  52          1HD2      LEU  52   5.241  -2.040 -15.663
  386   HD23  LEU  52          2HD2      LEU  52   6.177  -3.216 -14.736
  387    H    SER  53           H        SER  53   2.097  -1.048 -15.364
  388    HA   SER  53           HA       SER  53   0.083   1.138 -15.186
  389    HB2  SER  53           2HB      SER  53   0.668  -0.565 -17.643
  390    HB3  SER  53           3HB      SER  53  -0.670   0.591 -17.466
  391    HG   SER  53           HG       SER  53   1.150   1.494 -18.577
  392    H    VAL  54           H        VAL  54  -1.658   0.234 -14.082
  393    HA   VAL  54           HA       VAL  54  -2.037  -2.583 -13.734
  394    HB   VAL  54           HB       VAL  54  -4.118  -0.371 -13.481
  395   HG11  VAL  54          1HG1      VAL  54  -3.886  -3.103 -12.127
  396   HG12  VAL  54          2HG1      VAL  54  -5.146  -1.891 -11.806
  397   HG13  VAL  54          3HG1      VAL  54  -5.054  -2.672 -13.392
  398   HG21  VAL  54          3HG2      VAL  54  -2.167  -1.417 -11.392
  399   HG22  VAL  54          1HG2      VAL  54  -2.146   0.200 -12.135
  400   HG23  VAL  54          2HG2      VAL  54  -3.497  -0.270 -11.093
  401    H    GLY  55           H        GLY  55  -3.317  -4.035 -14.741
  402    HA2  GLY  55           2HA      GLY  55  -4.631  -4.979 -16.362
  403    HA3  GLY  55           3HA      GLY  55  -5.122  -3.354 -16.891
  404    H    ASP  56           H        ASP  56  -1.708  -4.257 -16.699
  405    HA   ASP  56           HA       ASP  56  -1.607  -4.714 -19.661
  406    HB2  ASP  56           2HB      ASP  56  -0.625  -2.509 -18.928
  407    HB3  ASP  56           3HB      ASP  56   0.477  -3.434 -17.888
  408    H    GLU  57           H        GLU  57   0.237  -6.139 -20.268
  409    HA   GLU  57           HA       GLU  57   0.658  -8.285 -18.229
  410    HB2  GLU  57           2HB      GLU  57  -0.587  -8.850 -20.302
  411    HB3  GLU  57           3HB      GLU  57   0.822  -8.350 -21.260
  412    HG2  GLU  57           2HG      GLU  57   2.172 -10.126 -20.346
  413    HG3  GLU  57           3HG      GLU  57   0.943 -10.515 -19.129
  414    H    VAL  58           H        VAL  58   2.670  -8.885 -17.654
  415    HA   VAL  58           HA       VAL  58   5.067  -7.579 -18.841
  416    HB   VAL  58           HB       VAL  58   5.761  -6.870 -16.545
  417   HG11  VAL  58          1HG1      VAL  58   3.174  -5.554 -17.503
  418   HG12  VAL  58          2HG1      VAL  58   4.353  -4.829 -16.396
  419   HG13  VAL  58          3HG1      VAL  58   4.808  -5.172 -18.077
  420   HG21  VAL  58          3HG2      VAL  58   2.898  -7.417 -15.720
  421   HG22  VAL  58          1HG2      VAL  58   4.354  -8.262 -15.149
  422   HG23  VAL  58          2HG2      VAL  58   4.119  -6.548 -14.765
  423    H    GLN  59           H        GLN  59   6.923  -8.761 -18.600
  424    HA   GLN  59           HA       GLN  59   6.670 -11.422 -17.356
  425    HB2  GLN  59           2HB      GLN  59   9.050 -10.110 -18.720
  426    HB3  GLN  59           3HB      GLN  59   8.925 -11.805 -18.202
  427    HG2  GLN  59           2HG      GLN  59   6.739 -11.743 -19.742
  428    HG3  GLN  59           3HG      GLN  59   7.598 -10.401 -20.513
  429   HE21  GLN  59          2HE2      GLN  59   7.208 -13.786 -20.393
  430   HE22  GLN  59          1HE2      GLN  59   8.614 -14.224 -21.359
  431    H    VAL  60           H        VAL  60   7.629 -11.979 -15.455
  432    HA   VAL  60           HA       VAL  60   8.959  -9.865 -13.788
  433    HB   VAL  60           HB       VAL  60   7.599 -10.941 -11.892
  434   HG11  VAL  60          1HG1      VAL  60   6.103  -9.300 -13.975
  435   HG12  VAL  60          2HG1      VAL  60   5.635  -9.483 -12.273
  436   HG13  VAL  60          3HG1      VAL  60   7.150  -8.666 -12.680
  437   HG21  VAL  60          3HG2      VAL  60   5.800 -11.869 -14.143
  438   HG22  VAL  60          1HG2      VAL  60   6.706 -12.896 -13.007
  439   HG23  VAL  60          2HG2      VAL  60   5.404 -11.849 -12.416
  440    H    LYS  61           H        LYS  61  10.598 -10.551 -12.512
  441    HA   LYS  61           HA       LYS  61  11.287 -13.452 -12.574
  442    HB2  LYS  61           2HB      LYS  61  13.024 -11.740 -13.092
  443    HB3  LYS  61           3HB      LYS  61  12.815 -11.073 -11.458
  444    HG2  LYS  61           2HG      LYS  61  13.584 -13.168 -10.452
  445    HG3  LYS  61           3HG      LYS  61  13.652 -13.950 -12.045
  446    HD2  LYS  61           2HD      LYS  61  15.368 -12.296 -12.757
  447    HD3  LYS  61           3HD      LYS  61  15.327 -11.591 -11.128
  448    HE2  LYS  61           2HE      LYS  61  17.227 -12.984 -11.128
  449    HE3  LYS  61           3HE      LYS  61  15.979 -13.899 -10.252
  450    HZ1  LYS  61           3HZ      LYS  61  15.592 -15.175 -12.263
  451    HZ2  LYS  61           1HZ      LYS  61  16.751 -14.312 -13.077
  452    HZ3  LYS  61           2HZ      LYS  61  17.161 -15.285 -11.815
  453    H    VAL  62           H        VAL  62  10.775 -14.720 -10.865
  454    HA   VAL  62           HA       VAL  62   9.480 -13.744  -8.486
  455    HB   VAL  62           HB       VAL  62  10.872 -16.408  -8.975
  456   HG11  VAL  62          1HG1      VAL  62   8.664 -15.591  -7.023
  457   HG12  VAL  62          2HG1      VAL  62   9.305 -17.236  -7.230
  458   HG13  VAL  62          3HG1      VAL  62  10.345 -15.954  -6.586
  459   HG21  VAL  62          3HG2      VAL  62   7.962 -15.639  -9.456
  460   HG22  VAL  62          1HG2      VAL  62   9.166 -16.015 -10.711
  461   HG23  VAL  62          2HG2      VAL  62   8.646 -17.276  -9.582
  462    H    LEU  63           H        LEU  63  10.334 -12.781  -6.813
  463    HA   LEU  63           HA       LEU  63  13.302 -12.788  -6.437
  464    HB2  LEU  63           2HB      LEU  63  12.225 -10.681  -7.117
  465    HB3  LEU  63           3HB      LEU  63  11.175 -10.759  -5.689
  466    HG   LEU  63           HG       LEU  63  13.175 -10.592  -4.220
  467   HD11  LEU  63          1HD1      LEU  63  14.706 -10.100  -6.820
  468   HD12  LEU  63          2HD1      LEU  63  15.356  -9.907  -5.178
  469   HD13  LEU  63          3HD1      LEU  63  14.899 -11.516  -5.756
  470   HD21  LEU  63          3HD2      LEU  63  12.911  -8.393  -6.308
  471   HD22  LEU  63          1HD2      LEU  63  11.914  -8.580  -4.850
  472   HD23  LEU  63          2HD2      LEU  63  13.644  -8.202  -4.701
  473    H    ALA  64           H        ALA  64  10.204 -13.323  -4.779
  474    HA   ALA  64           HA       ALA  64  11.618 -14.982  -2.815
  475    HB1  ALA  64           1HB      ALA  64   9.945 -12.617  -1.903
  476    HB2  ALA  64           2HB      ALA  64  10.557 -13.908  -0.864
  477    HB3  ALA  64           3HB      ALA  64  11.696 -12.804  -1.666
  478    H    VAL  65           H        VAL  65  10.114 -16.380  -1.712
  479    HA   VAL  65           HA       VAL  65   7.224 -16.177  -2.403
  480    HB   VAL  65           HB       VAL  65   8.891 -18.731  -2.474
  481   HG11  VAL  65          1HG1      VAL  65   5.920 -18.279  -3.040
  482   HG12  VAL  65          2HG1      VAL  65   6.792 -19.818  -3.238
  483   HG13  VAL  65          3HG1      VAL  65   6.590 -19.117  -1.623
  484   HG21  VAL  65          3HG2      VAL  65   7.513 -17.279  -4.764
  485   HG22  VAL  65          1HG2      VAL  65   9.267 -17.426  -4.514
  486   HG23  VAL  65          2HG2      VAL  65   8.301 -18.871  -4.861
  487    H    ASP  66           H        ASP  66   5.934 -16.706  -0.668
  488    HA   ASP  66           HA       ASP  66   7.212 -17.369   1.945
  489    HB2  ASP  66           2HB      ASP  66   7.140 -14.875   1.765
  490    HB3  ASP  66           3HB      ASP  66   5.417 -15.010   1.382
  491    H    GLU  67           H        GLU  67   6.270 -19.368   1.335
  492    HA   GLU  67           HA       GLU  67   3.521 -19.821   0.830
  493    HB2  GLU  67           2HB      GLU  67   4.016 -22.147   1.242
  494    HB3  GLU  67           3HB      GLU  67   5.313 -21.401   0.289
  495    HG2  GLU  67           2HG      GLU  67   6.703 -21.215   2.368
  496    HG3  GLU  67           3HG      GLU  67   5.382 -21.976   3.273
  497    H    GLU  68           H        GLU  68   5.001 -19.071   3.875
  498    HA   GLU  68           HA       GLU  68   3.041 -20.183   5.624
  499    HB2  GLU  68           2HB      GLU  68   4.606 -17.595   5.867
  500    HB3  GLU  68           3HB      GLU  68   3.752 -18.420   7.180
  501    HG2  GLU  68           2HG      GLU  68   6.117 -19.580   5.639
  502    HG3  GLU  68           3HG      GLU  68   6.205 -18.781   7.216
  503    H    LYS  69           H        LYS  69   2.917 -17.453   3.452
  504    HA   LYS  69           HA       LYS  69   0.106 -16.834   4.325
  505    HB2  LYS  69           2HB      LYS  69   2.309 -14.952   3.420
  506    HB3  LYS  69           3HB      LYS  69   0.609 -14.488   3.626
  507    HG2  LYS  69           2HG      LYS  69   2.421 -15.512   5.850
  508    HG3  LYS  69           3HG      LYS  69   2.068 -13.803   5.533
  509    HD2  LYS  69           2HD      LYS  69  -0.369 -14.295   5.896
  510    HD3  LYS  69           3HD      LYS  69   0.070 -15.951   6.360
  511    HE2  LYS  69           2HE      LYS  69   1.085 -13.443   7.753
  512    HE3  LYS  69           3HE      LYS  69  -0.326 -14.380   8.291
  513    HZ1  LYS  69           3HZ      LYS  69   1.133 -16.273   8.598
  514    HZ2  LYS  69           1HZ      LYS  69   2.436 -15.409   8.105
  515    HZ3  LYS  69           2HZ      LYS  69   1.660 -14.991   9.499
  516    H    GLY  70           H        GLY  70   1.950 -18.143   1.895
  517    HA2  GLY  70           2HA      GLY  70   1.583 -18.576  -0.325
  518    HA3  GLY  70           3HA      GLY  70  -0.095 -18.030  -0.099
  519    H    LYS  71           H        LYS  71   2.785 -16.024   0.520
  520    HA   LYS  71           HA       LYS  71   1.880 -14.147  -1.625
  521    HB2  LYS  71           2HB      LYS  71   3.606 -13.775   0.853
  522    HB3  LYS  71           3HB      LYS  71   3.366 -12.525  -0.386
  523    HG2  LYS  71           2HG      LYS  71   0.949 -12.531   0.031
  524    HG3  LYS  71           3HG      LYS  71   1.136 -13.842   1.212
  525    HD2  LYS  71           2HD      LYS  71   0.867 -11.771   2.416
  526    HD3  LYS  71           3HD      LYS  71   2.540 -12.338   2.623
  527    HE2  LYS  71           2HE      LYS  71   3.311 -10.754   0.907
  528    HE3  LYS  71           3HE      LYS  71   1.640 -10.217   0.623
  529    HZ1  LYS  71           3HZ      LYS  71   1.591  -9.400   2.888
  530    HZ2  LYS  71           1HZ      LYS  71   3.142  -9.901   3.146
  531    HZ3  LYS  71           2HZ      LYS  71   2.831  -8.702   2.058
  532    H    ILE  72           H        ILE  72   3.525 -13.056  -2.847
  533    HA   ILE  72           HA       ILE  72   6.125 -14.441  -3.256
  534    HB   ILE  72           HB       ILE  72   4.008 -13.919  -5.405
  535   HG12  ILE  72          2HG1      ILE  72   5.167 -16.507  -4.380
  536   HG13  ILE  72          3HG1      ILE  72   3.508 -15.914  -4.165
  537   HG21  ILE  72          1HG2      ILE  72   6.846 -15.008  -5.694
  538   HG22  ILE  72          2HG2      ILE  72   5.659 -14.872  -7.006
  539   HG23  ILE  72          3HG2      ILE  72   6.287 -13.416  -6.245
  540   HD11  ILE  72          3HD1      ILE  72   3.107 -16.102  -6.599
  541   HD12  ILE  72          1HD1      ILE  72   4.757 -16.723  -6.825
  542   HD13  ILE  72          2HD1      ILE  72   3.588 -17.664  -5.897
  543    H    SER  73           H        SER  73   7.713 -12.984  -3.721
  544    HA   SER  73           HA       SER  73   6.900 -10.164  -4.291
  545    HB2  SER  73           2HB      SER  73   9.575 -11.140  -3.259
  546    HB3  SER  73           3HB      SER  73   9.022  -9.466  -3.408
  547    HG   SER  73           HG       SER  73   8.826 -10.274  -1.245
  548    H    LEU  74           H        LEU  74   8.041  -9.114  -6.003
  549    HA   LEU  74           HA       LEU  74   9.158 -10.970  -8.070
  550    HB2  LEU  74           2HB      LEU  74   6.967  -8.919  -8.348
  551    HB3  LEU  74           3HB      LEU  74   7.680  -9.816  -9.702
  552    HG   LEU  74           HG       LEU  74   6.088 -11.072  -7.413
  553   HD11  LEU  74          1HD1      LEU  74   5.290 -10.500 -10.297
  554   HD12  LEU  74          2HD1      LEU  74   4.311 -11.383  -9.111
  555   HD13  LEU  74          3HD1      LEU  74   4.669  -9.661  -8.860
  556   HD21  LEU  74          3HD2      LEU  74   7.096 -12.295 -10.002
  557   HD22  LEU  74          1HD2      LEU  74   7.710 -12.626  -8.366
  558   HD23  LEU  74          2HD2      LEU  74   6.058 -13.087  -8.796
  559    H    SER  75           H        SER  75  10.163  -9.771  -9.862
  560    HA   SER  75           HA       SER  75  10.870  -6.931  -9.328
  561    HB2  SER  75           2HB      SER  75  12.731  -8.424  -8.580
  562    HB3  SER  75           3HB      SER  75  12.805  -9.097 -10.224
  563    HG   SER  75           HG       SER  75  14.315  -7.373  -9.837
  564    H    ILE  76           H        ILE  76  11.218  -5.726 -11.066
  565    HA   ILE  76           HA       ILE  76  10.583  -6.758 -13.819
  566    HB   ILE  76           HB       ILE  76   9.635  -4.301 -12.321
  567   HG12  ILE  76          2HG1      ILE  76   8.255  -6.274 -12.119
  568   HG13  ILE  76          3HG1      ILE  76   7.445  -4.912 -12.908
  569   HG21  ILE  76          1HG2      ILE  76   9.484  -4.749 -15.333
  570   HG22  ILE  76          2HG2      ILE  76   8.677  -3.435 -14.436
  571   HG23  ILE  76          3HG2      ILE  76  10.444  -3.503 -14.516
  572   HD11  ILE  76          3HD1      ILE  76   7.745  -6.002 -15.119
  573   HD12  ILE  76          1HD1      ILE  76   8.565  -7.362 -14.319
  574   HD13  ILE  76          2HD1      ILE  76   6.848  -7.030 -14.009
  575    H    ARG  77           H        ARG  77  12.616  -4.530 -11.830
  576    HA   ARG  77           HA       ARG  77  14.164  -3.644 -14.034
  577    HB2  ARG  77           2HB      ARG  77  15.925  -3.226 -12.496
  578    HB3  ARG  77           3HB      ARG  77  14.383  -2.803 -11.728
  579    HG2  ARG  77           2HG      ARG  77  14.462  -4.765 -10.317
  580    HG3  ARG  77           3HG      ARG  77  15.870  -5.407 -11.189
  581    HD2  ARG  77           2HD      ARG  77  17.256  -3.545 -10.411
  582    HD3  ARG  77           3HD      ARG  77  15.853  -2.799  -9.607
  583    HE   ARG  77           HE       ARG  77  15.784  -5.104  -8.381
  584   HH11  ARG  77          1HH1      ARG  77  18.858  -3.552  -9.282
  585   HH12  ARG  77          2HH1      ARG  77  19.657  -4.052  -7.826
  586   HH21  ARG  77          1HH2      ARG  77  16.781  -5.596  -6.453
  587   HH22  ARG  77          2HH2      ARG  77  18.481  -5.235  -6.202
  588    H    ALA  78           H        ALA  78  14.082  -6.794 -12.524
  589    HA   ALA  78           HA       ALA  78  16.380  -7.884 -13.826
  590    HB1  ALA  78           1HB      ALA  78  13.825  -9.224 -12.844
  591    HB2  ALA  78           2HB      ALA  78  15.364 -10.038 -13.205
  592    HB3  ALA  78           3HB      ALA  78  15.267  -8.884 -11.856
  593    H    THR  79           H        THR  79  13.183  -7.154 -15.135
  594    HA   THR  79           HA       THR  79  13.659  -9.018 -17.432
  595    HB   THR  79           HB       THR  79  11.184  -9.104 -17.582
  596    HG1  THR  79           1HG      THR  79  10.017  -8.296 -15.770
  597   HG21  THR  79          1HG2      THR  79  12.236  -9.851 -14.811
  598   HG22  THR  79          2HG2      THR  79  10.763 -10.485 -15.571
  599   HG23  THR  79          3HG2      THR  79  12.347 -10.864 -16.269
  600    H    GLN  80           H        GLN  80  13.080  -5.740 -16.522
  601    HA   GLN  80           HA       GLN  80  13.022  -4.888 -19.386
  602    HB2  GLN  80           2HB      GLN  80  11.570  -3.612 -17.040
  603    HB3  GLN  80           3HB      GLN  80  11.594  -3.024 -18.716
  604    HG2  GLN  80           2HG      GLN  80  10.557  -5.302 -19.350
  605    HG3  GLN  80           3HG      GLN  80  10.231  -5.513 -17.619
  606   HE21  GLN  80          2HE2      GLN  80   9.191  -3.277 -16.644
  607   HE22  GLN  80          1HE2      GLN  80   7.837  -2.693 -17.600
  608    H    ALA  81           H        ALA  81  15.353  -5.382 -18.172
  609    HA   ALA  81           HA       ALA  81  16.545  -3.255 -16.718
  610    HB1  ALA  81           1HB      ALA  81  17.831  -5.345 -18.531
  611    HB2  ALA  81           2HB      ALA  81  18.665  -4.383 -17.289
  612    HB3  ALA  81           3HB      ALA  81  17.430  -5.566 -16.811
  613    H    ALA  82           H        ALA  82  15.692  -3.331 -20.045
  614    HA   ALA  82           HA       ALA  82  17.692  -1.815 -21.306
  615    HB1  ALA  82           1HB      ALA  82  14.674  -1.770 -21.736
  616    HB2  ALA  82           2HB      ALA  82  15.891  -1.199 -22.895
  617    HB3  ALA  82           3HB      ALA  82  15.815  -2.923 -22.472
  618    HA   PRO  83           HA       PRO  83  17.437   2.232 -19.564
  619    HB2  PRO  83           2HB      PRO  83  17.988   3.855 -21.736
  620    HB3  PRO  83           3HB      PRO  83  19.216   2.947 -20.816
  621    HG2  PRO  83           2HG      PRO  83  17.850   2.196 -23.435
  622    HG3  PRO  83           3HG      PRO  83  19.573   2.031 -22.998
  623    HD2  PRO  83           2HD      PRO  83  17.830  -0.094 -22.845
  624    HD3  PRO  83           3HD      PRO  83  19.156   0.099 -21.668
  625    H    GLU  84           H        GLU  84  16.238   4.281 -19.676
  626    HA   GLU  84           HA       GLU  84  13.437   3.824 -20.084
  627    HB2  GLU  84           2HB      GLU  84  15.023   6.350 -19.495
  628    HB3  GLU  84           3HB      GLU  84  13.251   6.237 -19.444
  629    HG2  GLU  84           2HG      GLU  84  13.424   4.507 -17.662
  630    HG3  GLU  84           3HG      GLU  84  15.190   4.661 -17.702
  631    H    LYS  85           H        LYS  85  15.826   5.046 -22.241
  632    HA   LYS  85           HA       LYS  85  13.807   5.387 -24.367
  633    HB2  LYS  85           2HB      LYS  85  14.753   7.515 -25.094
  634    HB3  LYS  85           3HB      LYS  85  14.065   7.643 -23.464
  635    HG2  LYS  85           2HG      LYS  85  16.344   7.516 -22.484
  636    HG3  LYS  85           3HG      LYS  85  17.039   7.368 -24.114
  637    HD2  LYS  85           2HD      LYS  85  16.191   9.581 -24.717
  638    HD3  LYS  85           3HD      LYS  85  15.377   9.723 -23.144
  639    HE2  LYS  85           2HE      LYS  85  17.397  11.029 -23.062
  640    HE3  LYS  85           3HE      LYS  85  17.596   9.607 -22.013
  641    HZ1  LYS  85           3HZ      LYS  85  18.898   8.567 -23.759
  642    HZ2  LYS  85           1HZ      LYS  85  18.701   9.885 -24.739
  643    HZ3  LYS  85           2HZ      LYS  85  19.559   9.998 -23.339
  644    H    LYS  86           H        LYS  86  14.871   5.333 -26.535
  645    HA   LYS  86           HA       LYS  86  17.082   3.531 -26.720
  646    HB2  LYS  86           2HB      LYS  86  15.953   5.525 -28.725
  647    HB3  LYS  86           3HB      LYS  86  17.201   4.317 -29.106
  648    HG2  LYS  86           2HG      LYS  86  15.621   2.516 -28.389
  649    HG3  LYS  86           3HG      LYS  86  14.367   3.748 -28.140
  650    HD2  LYS  86           2HD      LYS  86  15.744   3.169 -30.795
  651    HD3  LYS  86           3HD      LYS  86  14.158   2.527 -30.312
  652    HE2  LYS  86           2HE      LYS  86  13.309   4.863 -30.087
  653    HE3  LYS  86           3HE      LYS  86  14.883   5.468 -30.651
  654    HZ1  LYS  86           3HZ      LYS  86  14.510   4.319 -32.729
  655    HZ2  LYS  86           1HZ      LYS  86  13.049   3.759 -32.209
  656    HZ3  LYS  86           2HZ      LYS  86  13.276   5.372 -32.433
  657    H    GLU  87           H        GLU  87  19.157   3.913 -26.229
  658    HA   GLU  87           HA       GLU  87  20.210   6.636 -25.975
  659    HB2  GLU  87           2HB      GLU  87  21.459   3.882 -25.705
  660    HB3  GLU  87           3HB      GLU  87  22.305   5.408 -25.383
  661    HG2  GLU  87           2HG      GLU  87  19.793   4.501 -23.916
  662    HG3  GLU  87           3HG      GLU  87  21.440   4.233 -23.332
  663    H    SER  88           H        SER  88  19.907   4.383 -28.526
  664    HA   SER  88           HA       SER  88  22.140   4.898 -30.166
  665    HB2  SER  88           2HB      SER  88  19.298   4.496 -31.137
  666    HB3  SER  88           3HB      SER  88  20.812   3.979 -31.912
  667    HG   SER  88           HG       SER  88  19.735   2.240 -30.832
  668    H    LYS  89           H        LYS  89  22.491   6.297 -31.928
  669    HA   LYS  89           HA       LYS  89  21.562   8.988 -31.763
  670    HB2  LYS  89           2HB      LYS  89  22.674   7.457 -34.138
  671    HB3  LYS  89           3HB      LYS  89  22.511   9.217 -34.037
  672    HG2  LYS  89           2HG      LYS  89  24.305   7.488 -32.286
  673    HG3  LYS  89           3HG      LYS  89  24.834   8.477 -33.660
  674    HD2  LYS  89           2HD      LYS  89  24.052  10.523 -32.462
  675    HD3  LYS  89           3HD      LYS  89  23.594   9.510 -31.077
  676    HE2  LYS  89           2HE      LYS  89  25.716  10.482 -30.560
  677    HE3  LYS  89           3HE      LYS  89  25.980   8.758 -30.896
  678    HZ1  LYS  89           3HZ      LYS  89  26.738   9.373 -33.096
  679    HZ2  LYS  89           1HZ      LYS  89  26.495  10.972 -32.782
  680    HZ3  LYS  89           2HZ      LYS  89  27.646  10.136 -31.949
  681    HA   PRO  90           HA       PRO  90  17.619   8.701 -33.782
  682    HB2  PRO  90           2HB      PRO  90  17.377  11.192 -34.934
  683    HB3  PRO  90           3HB      PRO  90  17.169  10.895 -33.187
  684    HG2  PRO  90           2HG      PRO  90  19.628  11.894 -34.709
  685    HG3  PRO  90           3HG      PRO  90  18.960  12.519 -33.176
  686    HD2  PRO  90           2HD      PRO  90  21.077  10.743 -33.236
  687    HD3  PRO  90           3HD      PRO  90  19.871  10.713 -31.923
  688    H    ARG  91           H        ARG  91  16.631   8.732 -35.976
  689    HA   ARG  91           HA       ARG  91  18.311   7.905 -38.125
  690    HB2  ARG  91           2HB      ARG  91  16.347   8.098 -39.524
  691    HB3  ARG  91           3HB      ARG  91  15.934   7.324 -37.984
  692    HG2  ARG  91           2HG      ARG  91  14.752   9.246 -37.203
  693    HG3  ARG  91           3HG      ARG  91  15.476  10.301 -38.433
  694    HD2  ARG  91           2HD      ARG  91  14.258   9.120 -40.213
  695    HD3  ARG  91           3HD      ARG  91  13.575   7.996 -39.022
  696    HE   ARG  91           HE       ARG  91  12.086   9.588 -38.314
  697   HH11  ARG  91          1HH1      ARG  91  14.437  11.223 -40.437
  698   HH12  ARG  91          2HH1      ARG  91  13.421  12.614 -40.663
  699   HH21  ARG  91          1HH2      ARG  91  10.765  11.397 -38.699
  700   HH22  ARG  91          2HH2      ARG  91  11.337  12.717 -39.675
  701    H    LYS  92           H        LYS  92  18.510   8.949 -40.264
  702    HA   LYS  92           HA       LYS  92  19.558  11.589 -40.213
  703    HB2  LYS  92           2HB      LYS  92  18.307  10.054 -42.514
  704    HB3  LYS  92           3HB      LYS  92  19.296  11.516 -42.670
  705    HG2  LYS  92           2HG      LYS  92  20.242   8.830 -41.596
  706    HG3  LYS  92           3HG      LYS  92  20.564   9.471 -43.217
  707    HD2  LYS  92           2HD      LYS  92  21.802  11.394 -42.166
  708    HD3  LYS  92           3HD      LYS  92  21.564  10.629 -40.575
  709    HE2  LYS  92           2HE      LYS  92  22.753   8.611 -41.361
  710    HE3  LYS  92           3HE      LYS  92  22.987   9.367 -42.953
  711    HZ1  LYS  92           3HZ      LYS  92  24.310  11.067 -41.880
  712    HZ2  LYS  92           1HZ      LYS  92  24.089  10.366 -40.405
  713    HZ3  LYS  92           2HZ      LYS  92  24.942   9.577 -41.572
  714    HA   PRO  93           HA       PRO  93  15.834  13.993 -40.143
  715    HB2  PRO  93           2HB      PRO  93  16.671  16.352 -41.282
  716    HB3  PRO  93           3HB      PRO  93  17.123  15.856 -39.629
  717    HG2  PRO  93           2HG      PRO  93  18.696  15.575 -42.239
  718    HG3  PRO  93           3HG      PRO  93  19.297  16.126 -40.652
  719    HD2  PRO  93           2HD      PRO  93  19.616  13.518 -41.525
  720    HD3  PRO  93           3HD      PRO  93  19.387  13.909 -39.798
  721    H    LYS  94           H        LYS  94  14.296  15.094 -41.603
  722    HA   LYS  94           HA       LYS  94  14.749  14.974 -44.523
  723    HB2  LYS  94           2HB      LYS  94  13.677  12.847 -44.061
  724    HB3  LYS  94           3HB      LYS  94  12.433  13.641 -43.071
  725    HG2  LYS  94           2HG      LYS  94  11.481  14.726 -44.991
  726    HG3  LYS  94           3HG      LYS  94  12.834  14.226 -46.026
  727    HD2  LYS  94           2HD      LYS  94  11.026  12.186 -44.688
  728    HD3  LYS  94           3HD      LYS  94  10.571  12.957 -46.220
  729    HE2  LYS  94           2HE      LYS  94  12.946  12.222 -47.036
  730    HE3  LYS  94           3HE      LYS  94  12.912  11.120 -45.642
  731    HZ1  LYS  94           3HZ      LYS  94  10.902  10.154 -46.547
  732    HZ2  LYS  94           1HZ      LYS  94  10.946  11.177 -47.849
  733    HZ3  LYS  94           2HZ      LYS  94  12.117  10.044 -47.646
  734    H    ALA  95           H        ALA  95  13.581  16.550 -45.578
  735    HA   ALA  95           HA       ALA  95  11.633  18.325 -44.217
  736    HB1  ALA  95           1HB      ALA  95  14.260  19.284 -45.441
  737    HB2  ALA  95           2HB      ALA  95  12.914  20.327 -44.930
  738    HB3  ALA  95           3HB      ALA  95  13.812  19.384 -43.722
  739    H    ALA  96           H        ALA  96  10.776  19.879 -45.969
  740    HA   ALA  96           HA       ALA  96   9.519  18.295 -47.880
  741    HB1  ALA  96           1HB      ALA  96   9.983  21.305 -47.977
  742    HB2  ALA  96           2HB      ALA  96   8.724  20.412 -48.859
  743    HB3  ALA  96           3HB      ALA  96   8.682  20.480 -47.084
  744    H    GLN  97           H        GLN  97  12.332  20.409 -48.385
  745    HA   GLN  97           HA       GLN  97  12.612  20.006 -51.187
  746    HB2  GLN  97           2HB      GLN  97  14.830  20.937 -50.894
  747    HB3  GLN  97           3HB      GLN  97  13.602  21.877 -50.033
  748    HG2  GLN  97           2HG      GLN  97  15.137  19.811 -48.474
  749    HG3  GLN  97           3HG      GLN  97  15.989  21.281 -48.966
  750   HE21  GLN  97          2HE2      GLN  97  16.253  22.156 -46.868
  751   HE22  GLN  97          1HE2      GLN  97  14.893  22.694 -45.905
  752    H    VAL  98           H        VAL  98  13.290  17.715 -48.750
  753    HA   VAL  98           HA       VAL  98  14.637  15.922 -50.746
  754    HB   VAL  98           HB       VAL  98  16.119  15.143 -48.896
  755   HG11  VAL  98          1HG1      VAL  98  16.416  18.117 -49.521
  756   HG12  VAL  98          2HG1      VAL  98  17.696  17.052 -48.908
  757   HG13  VAL  98          3HG1      VAL  98  17.009  16.777 -50.522
  758   HG21  VAL  98          3HG2      VAL  98  15.105  17.534 -47.336
  759   HG22  VAL  98          1HG2      VAL  98  14.846  15.814 -46.955
  760   HG23  VAL  98          2HG2      VAL  98  16.482  16.498 -46.900
  761    H    SER  99           H        SER  99  11.801  16.269 -49.505
  762    HA   SER  99           HA       SER  99  11.466  13.812 -48.035
  763    HB2  SER  99           2HB      SER  99   9.509  15.681 -49.419
  764    HB3  SER  99           3HB      SER  99   9.021  14.274 -48.444
  765    HG   SER  99           HG       SER  99   9.106  16.225 -47.209
  766    H    GLU 100           H        GLU 100  11.103  14.604 -51.495
  767    HA   GLU 100           HA       GLU 100  10.343  11.934 -52.282
  768    HB2  GLU 100           2HB      GLU 100  10.027  14.013 -53.624
  769    HB3  GLU 100           3HB      GLU 100  11.790  14.122 -53.816
  770    HG2  GLU 100           2HG      GLU 100  11.838  12.016 -55.029
  771    HG3  GLU 100           3HG      GLU 100  10.108  11.750 -54.745
  772    H    GLU 101           H        GLU 101  11.614  10.226 -52.908
  773    HA   GLU 101           HA       GLU 101  14.549  10.389 -52.925
  774    HB2  GLU 101           2HB      GLU 101  14.816   8.618 -51.295
  775    HB3  GLU 101           3HB      GLU 101  14.012  10.021 -50.569
  776    HG2  GLU 101           2HG      GLU 101  11.807   8.831 -50.809
  777    HG3  GLU 101           3HG      GLU 101  12.681   7.426 -51.448
  778    H    ALA 102           H        ALA 102  15.388   8.098 -53.367
  779    HA   ALA 102           HA       ALA 102  13.761   6.594 -55.360
  780    HB1  ALA 102           1HB      ALA 102  16.409   8.002 -55.937
  781    HB2  ALA 102           2HB      ALA 102  15.557   6.899 -57.045
  782    HB3  ALA 102           3HB      ALA 102  14.822   8.450 -56.604
  783    H    SER 103           H        SER 103  16.071   5.213 -56.337
  784    HA   SER 103           HA       SER 103  16.387   3.009 -54.710
  785    HB2  SER 103           2HB      SER 103  18.570   4.164 -56.477
  786    HB3  SER 103           3HB      SER 103  18.272   2.456 -56.089
  787    HG   SER 103           HG       SER 103  17.441   3.051 -58.168
  788    H    THR 104           H        THR 104  17.745   2.283 -53.139
  789    HA   THR 104           HA       THR 104  18.541   4.188 -51.185
  790    HB   THR 104           HB       THR 104  19.487   2.066 -50.098
  791    HG1  THR 104           1HG      THR 104  18.836   0.136 -51.151
  792   HG21  THR 104          1HG2      THR 104  16.604   1.977 -51.109
  793   HG22  THR 104          2HG2      THR 104  17.246   1.078 -49.716
  794   HG23  THR 104          3HG2      THR 104  17.169   2.850 -49.667
  795    HA   PRO 105           HA       PRO 105  22.864   4.759 -52.179
  796    HB2  PRO 105           2HB      PRO 105  23.927   5.218 -49.670
  797    HB3  PRO 105           3HB      PRO 105  23.025   6.447 -50.594
  798    HG2  PRO 105           2HG      PRO 105  22.086   4.611 -48.344
  799    HG3  PRO 105           3HG      PRO 105  21.689   6.331 -48.595
  800    HD2  PRO 105           2HD      PRO 105  19.989   4.262 -49.356
  801    HD3  PRO 105           3HD      PRO 105  20.045   5.821 -50.220
  802    H    GLN 106           H        GLN 106  21.971   2.653 -49.416
  803    HA   GLN 106           HA       GLN 106  24.194   0.806 -49.756
  804    HB2  GLN 106           2HB      GLN 106  21.509   0.561 -48.347
  805    HB3  GLN 106           3HB      GLN 106  22.825  -0.628 -48.250
  806    HG2  GLN 106           2HG      GLN 106  24.307   1.116 -47.241
  807    HG3  GLN 106           3HG      GLN 106  22.961   2.269 -47.296
  808   HE21  GLN 106          2HE2      GLN 106  24.393  -0.399 -45.540
  809   HE22  GLN 106          1HE2      GLN 106  23.182  -0.467 -44.279
  810    H    GLY 107           H        GLY 107  23.794  -1.496 -50.351
  811    HA2  GLY 107           2HA      GLY 107  22.524  -1.644 -52.952
  812    HA3  GLY 107           3HA      GLY 107  23.464  -2.908 -52.135
  813    H    PHE 108           H        PHE 108  20.675  -1.442 -50.487
  814    HA   PHE 108           HA       PHE 108  19.152  -3.873 -50.391
  815    HB2  PHE 108           2HB      PHE 108  18.815  -2.115 -48.746
  816    HB3  PHE 108           3HB      PHE 108  18.354  -0.957 -49.998
  817    HD1  PHE 108           HD1      PHE 108  17.300  -4.023 -48.181
  818    HD2  PHE 108           HD2      PHE 108  16.130  -0.856 -50.871
  819    HE1  PHE 108           HE1      PHE 108  14.914  -4.671 -47.914
  820    HE2  PHE 108           HE2      PHE 108  13.745  -1.508 -50.600
  821    HZ   PHE 108           HZ       PHE 108  13.135  -3.412 -49.120
  822    H    ASN 109           H        ASN 109  18.872  -0.967 -52.513
  823    HA   ASN 109           HA       ASN 109  16.958  -1.993 -54.337
  824    HB2  ASN 109           2HB      ASN 109  17.493   0.282 -54.494
  825    HB3  ASN 109           3HB      ASN 109  19.244   0.020 -54.626
  826   HD21  ASN 109          2HD2      ASN 109  20.078   0.064 -56.695
  827   HD22  ASN 109          1HD2      ASN 109  19.147  -0.200 -58.157
  828    H    THR 110           H        THR 110  17.107  -3.320 -56.076
  829    HA   THR 110           HA       THR 110  19.724  -4.620 -56.730
  830    HB   THR 110           HB       THR 110  18.183  -6.565 -57.378
  831    HG1  THR 110           1HG      THR 110  16.159  -6.531 -56.267
  832   HG21  THR 110          1HG2      THR 110  18.277  -5.744 -54.436
  833   HG22  THR 110          2HG2      THR 110  17.988  -7.389 -55.048
  834   HG23  THR 110          3HG2      THR 110  19.559  -6.605 -55.315
  835    H    LEU 111           H        LEU 111  17.366  -2.507 -57.989
  836    HA   LEU 111           HA       LEU 111  17.439  -3.364 -60.743
  837    HB2  LEU 111           2HB      LEU 111  17.022  -0.618 -59.546
  838    HB3  LEU 111           3HB      LEU 111  16.702  -1.050 -61.233
  839    HG   LEU 111           HG       LEU 111  15.229  -2.175 -58.801
  840   HD11  LEU 111          1HD1      LEU 111  14.342  -0.217 -60.969
  841   HD12  LEU 111          2HD1      LEU 111  13.311  -0.869 -59.675
  842   HD13  LEU 111          3HD1      LEU 111  14.677   0.190 -59.271
  843   HD21  LEU 111          3HD2      LEU 111  14.689  -2.623 -61.756
  844   HD22  LEU 111          1HD2      LEU 111  15.316  -3.829 -60.606
  845   HD23  LEU 111          2HD2      LEU 111  13.680  -3.184 -60.401
  846    H    LYS 112           H        LYS 112  19.174  -3.364 -62.022
  847    HA   LYS 112           HA       LYS 112  21.648  -2.030 -61.419
  848    HB2  LYS 112           2HB      LYS 112  22.392  -2.842 -63.558
  849    HB3  LYS 112           3HB      LYS 112  21.467  -4.113 -62.737
  850    HG2  LYS 112           2HG      LYS 112  19.489  -3.579 -64.156
  851    HG3  LYS 112           3HG      LYS 112  20.436  -2.326 -64.989
  852    HD2  LYS 112           2HD      LYS 112  22.038  -4.049 -65.769
  853    HD3  LYS 112           3HD      LYS 112  21.098  -5.306 -64.929
  854    HE2  LYS 112           2HE      LYS 112  19.123  -4.751 -66.317
  855    HE3  LYS 112           3HE      LYS 112  20.068  -3.503 -67.160
  856    HZ1  LYS 112           3HZ      LYS 112  21.528  -5.244 -67.959
  857    HZ2  LYS 112           1HZ      LYS 112  20.651  -6.396 -67.177
  858    HZ3  LYS 112           2HZ      LYS 112  19.973  -5.552 -68.415
  859    H    ASP 113           H        ASP 113  22.759  -0.592 -62.957
  860    HA   ASP 113           HA       ASP 113  21.111   1.319 -64.490
  861    HB2  ASP 113           2HB      ASP 113  21.250   2.201 -62.136
  862    HB3  ASP 113           3HB      ASP 113  23.016   2.162 -62.298
  863    H    LYS 114           H        LYS 114  22.596   2.736 -65.805
  864    HA   LYS 114           HA       LYS 114  24.634   1.201 -67.126
  865    HB2  LYS 114           2HB      LYS 114  23.799   4.105 -67.180
  866    HB3  LYS 114           3HB      LYS 114  25.232   3.552 -68.064
  867    HG2  LYS 114           2HG      LYS 114  23.376   3.648 -69.588
  868    HG3  LYS 114           3HG      LYS 114  23.840   1.953 -69.331
  869    HD2  LYS 114           2HD      LYS 114  21.916   1.558 -67.927
  870    HD3  LYS 114           3HD      LYS 114  21.532   3.290 -67.871
  871    HE2  LYS 114           2HE      LYS 114  19.985   2.240 -69.380
  872    HE3  LYS 114           3HE      LYS 114  21.103   3.241 -70.329
  873    HZ1  LYS 114           3HZ      LYS 114  22.310   1.236 -70.898
  874    HZ2  LYS 114           1HZ      LYS 114  21.270   0.311 -70.020
  875    HZ3  LYS 114           2HZ      LYS 114  20.733   1.103 -71.359
  876    H    LEU 115           H        LEU 115  26.860   1.526 -67.256
  877    HA   LEU 115           HA       LEU 115  28.196   1.675 -64.752
  878    HB2  LEU 115           2HB      LEU 115  28.925   0.364 -66.695
  879    HB3  LEU 115           3HB      LEU 115  29.265   1.857 -67.594
  880    HG   LEU 115           HG       LEU 115  31.026   2.441 -65.937
  881   HD11  LEU 115          1HD1      LEU 115  30.499  -0.341 -64.787
  882   HD12  LEU 115          2HD1      LEU 115  31.840   0.737 -64.336
  883   HD13  LEU 115          3HD1      LEU 115  30.174   1.200 -63.958
  884   HD21  LEU 115          3HD2      LEU 115  31.326  -0.317 -67.191
  885   HD22  LEU 115          1HD2      LEU 115  31.632   1.245 -67.988
  886   HD23  LEU 115          2HD2      LEU 115  32.662   0.722 -66.644
  887    H    GLU 116           H        GLU 116  29.245   3.277 -63.714
  888    HA   GLU 116           HA       GLU 116  29.074   6.030 -64.571
  889    HB2  GLU 116           2HB      GLU 116  30.515   4.706 -62.250
  890    HB3  GLU 116           3HB      GLU 116  30.422   6.462 -62.515
  891    HG2  GLU 116           2HG      GLU 116  27.879   6.189 -62.544
  892    HG3  GLU 116           3HG      GLU 116  28.133   4.548 -61.917
  893    H    GLU 117           H        GLU 117  30.148   4.839 -66.586
  894    HA   GLU 117           HA       GLU 117  32.620   6.449 -66.920
  895    HB2  GLU 117           2HB      GLU 117  33.277   4.052 -66.622
  896    HB3  GLU 117           3HB      GLU 117  32.244   3.629 -68.005
  897    HG2  GLU 117           2HG      GLU 117  33.623   5.062 -69.482
  898    HG3  GLU 117           3HG      GLU 117  34.600   5.551 -68.085
  899    H    TRP 118           H        TRP 118  29.954   4.546 -68.442
  900    HA   TRP 118           HA       TRP 118  29.731   6.206 -70.792
  901    HB2  TRP 118           2HB      TRP 118  28.822   3.886 -70.573
  902    HB3  TRP 118           3HB      TRP 118  27.655   4.481 -69.380
  903    HD1  TRP 118           HD1      TRP 118  25.469   4.839 -70.280
  904    HE1  TRP 118           HE1      TRP 118  24.346   5.454 -72.578
  905    HE3  TRP 118           HE3      TRP 118  29.692   5.342 -73.120
  906    HZ2  TRP 118           HZ2      TRP 118  25.233   6.066 -75.223
  907    HZ3  TRP 118           HZ3      TRP 118  29.567   5.923 -75.466
  908    HH2  TRP 118           HH2      TRP 118  27.370   6.304 -76.585
  909    H    ILE 119           H        ILE 119  28.374   6.329 -67.544
  910    HA   ILE 119           HA       ILE 119  27.547   9.188 -67.873
  911    HB   ILE 119           HB       ILE 119  25.486   8.692 -66.586
  912   HG12  ILE 119          2HG1      ILE 119  25.910   5.745 -66.986
  913   HG13  ILE 119          3HG1      ILE 119  26.440   6.593 -65.522
  914   HG21  ILE 119          1HG2      ILE 119  25.676   7.027 -69.138
  915   HG22  ILE 119          2HG2      ILE 119  24.173   7.573 -68.376
  916   HG23  ILE 119          3HG2      ILE 119  25.305   8.758 -69.049
  917   HD11  ILE 119          3HD1      ILE 119  24.123   7.369 -65.109
  918   HD12  ILE 119          1HD1      ILE 119  23.576   6.512 -66.567
  919   HD13  ILE 119          2HD1      ILE 119  24.209   5.596 -65.187
  920    H    GLU 120           H        GLU 120  26.698   9.637 -65.369
  921    HA   GLU 120           HA       GLU 120  28.548   8.458 -63.396
  922    HB2  GLU 120           2HB      GLU 120  29.069  10.630 -62.444
  923    HB3  GLU 120           3HB      GLU 120  29.645  10.526 -64.119
  924    HG2  GLU 120           2HG      GLU 120  27.727  11.853 -64.885
  925    HG3  GLU 120           3HG      GLU 120  27.095  11.955 -63.233
  926    H    MET 121           H        MET 121  27.564   8.587 -61.218
  927    HA   MET 121           HA       MET 121  24.894   9.871 -61.018
  928    HB2  MET 121           2HB      MET 121  24.511   7.529 -61.809
  929    HB3  MET 121           3HB      MET 121  25.362   6.940 -60.367
  930    HG2  MET 121           2HG      MET 121  22.936   6.844 -60.073
  931    HG3  MET 121           3HG      MET 121  23.691   7.958 -58.921
  932    HE1  MET 121           3HE      MET 121  20.559   7.873 -59.353
  933    HE2  MET 121           1HE      MET 121  21.372   9.017 -58.254
  934    HE3  MET 121           2HE      MET 121  20.171   9.608 -59.426
  935    H    SER 122           H        SER 122  27.634   8.267 -59.375
  936    HA   SER 122           HA       SER 122  26.950   8.709 -56.695
  937    HB2  SER 122           2HB      SER 122  29.489   8.893 -56.430
  938    HB3  SER 122           3HB      SER 122  28.853   7.417 -57.192
  939    HG   SER 122           HG       SER 122  30.639   8.276 -58.355
  940    H    ASN 123           H        ASN 123  28.716  10.990 -58.796
  941    HA   ASN 123           HA       ASN 123  28.823  13.179 -56.975
  942    HB2  ASN 123           2HB      ASN 123  30.178  13.141 -58.977
  943    HB3  ASN 123           3HB      ASN 123  28.744  13.036 -60.014
  944   HD21  ASN 123          2HD2      ASN 123  28.633  14.919 -61.149
  945   HD22  ASN 123          1HD2      ASN 123  28.756  16.517 -60.413
  946    H    ARG 124           H        ARG 124  26.326  12.415 -59.443
  947    HA   ARG 124           HA       ARG 124  24.710  14.739 -58.966
  948    HB2  ARG 124           2HB      ARG 124  24.048  11.980 -60.064
  949    HB3  ARG 124           3HB      ARG 124  22.919  13.349 -60.074
  950    HG2  ARG 124           2HG      ARG 124  24.195  14.563 -61.645
  951    HG3  ARG 124           3HG      ARG 124  25.663  13.620 -61.331
  952    HD2  ARG 124           2HD      ARG 124  24.716  13.027 -63.513
  953    HD3  ARG 124           3HD      ARG 124  24.665  11.652 -62.395
  954    HE   ARG 124           HE       ARG 124  22.240  13.288 -62.553
  955   HH11  ARG 124          1HH1      ARG 124  23.880  10.319 -63.655
  956   HH12  ARG 124          2HH1      ARG 124  22.412   9.564 -64.191
  957   HH21  ARG 124          1HH2      ARG 124  20.332  12.276 -63.292
  958   HH22  ARG 124          2HH2      ARG 124  20.392  10.682 -63.992
  959    H    LYS 125           H        LYS 125  24.641  11.490 -57.560
  960    HA   LYS 125           HA       LYS 125  22.344  11.953 -55.825
  961    HB2  LYS 125           2HB      LYS 125  23.266   9.783 -56.878
  962    HB3  LYS 125           3HB      LYS 125  24.493   9.831 -55.597
  963    HG2  LYS 125           2HG      LYS 125  22.786   9.608 -53.875
  964    HG3  LYS 125           3HG      LYS 125  21.486   9.809 -55.073
  965    HD2  LYS 125           2HD      LYS 125  22.215   7.726 -56.202
  966    HD3  LYS 125           3HD      LYS 125  23.502   7.533 -54.997
  967    HE2  LYS 125           2HE      LYS 125  21.694   6.059 -54.396
  968    HE3  LYS 125           3HE      LYS 125  21.762   7.379 -53.209
  969    HZ1  LYS 125           3HZ      LYS 125  19.927   8.427 -54.366
  970    HZ2  LYS 125           1HZ      LYS 125  19.868   7.192 -55.462
  971    HZ3  LYS 125           2HZ      LYS 125  19.507   6.890 -53.895
  972    H    ASP 126           H        ASP 126  25.515  13.075 -55.663
  973    HA   ASP 126           HA       ASP 126  26.999  13.661 -54.029
  974    HB2  ASP 126           2HB      ASP 126  25.279  15.463 -53.717
  975    HB3  ASP 126           3HB      ASP 126  24.497  14.419 -52.518
  976    H    LEU 127           H        LEU 127  27.007  11.198 -54.196
  977    HA   LEU 127           HA       LEU 127  27.080  10.105 -51.412
  978    HB2  LEU 127           2HB      LEU 127  25.083   9.279 -52.512
  979    HB3  LEU 127           3HB      LEU 127  26.021   8.777 -53.935
  980    HG   LEU 127           HG       LEU 127  27.261   7.139 -52.486
  981   HD11  LEU 127          1HD1      LEU 127  25.153   7.871 -50.401
  982   HD12  LEU 127          2HD1      LEU 127  26.316   6.531 -50.279
  983   HD13  LEU 127          3HD1      LEU 127  26.890   8.206 -50.270
  984   HD21  LEU 127          3HD2      LEU 127  24.239   6.838 -52.547
  985   HD22  LEU 127          1HD2      LEU 127  25.370   6.416 -53.852
  986   HD23  LEU 127          2HD2      LEU 127  25.405   5.513 -52.323
  987    H    ILE 128           H        ILE 128  28.984   9.123 -50.971
  988    HA   ILE 128           HA       ILE 128  30.515   7.664 -53.037
  989    HB   ILE 128           HB       ILE 128  31.473   9.969 -53.040
  990   HG12  ILE 128          2HG1      ILE 128  33.799   9.462 -52.580
  991   HG13  ILE 128          3HG1      ILE 128  33.314   7.936 -51.815
  992   HG21  ILE 128          1HG2      ILE 128  32.061   9.463 -50.082
  993   HG22  ILE 128          2HG2      ILE 128  32.677  10.826 -51.039
  994   HG23  ILE 128          3HG2      ILE 128  30.938  10.680 -50.727
  995   HD11  ILE 128          3HD1      ILE 128  32.326   7.182 -53.976
  996   HD12  ILE 128          1HD1      ILE 128  32.808   8.718 -54.728
  997   HD13  ILE 128          2HD1      ILE 128  34.043   7.576 -54.159
  998    H    LYS 129           H        LYS 129  31.679   5.963 -52.183
  999    HA   LYS 129           HA       LYS 129  31.071   5.260 -49.337
 1000    HB2  LYS 129           2HB      LYS 129  30.444   3.606 -51.814
 1001    HB3  LYS 129           3HB      LYS 129  30.332   3.021 -50.141
 1002    HG2  LYS 129           2HG      LYS 129  28.653   4.828 -49.675
 1003    HG3  LYS 129           3HG      LYS 129  28.685   5.253 -51.399
 1004    HD2  LYS 129           2HD      LYS 129  27.929   2.506 -50.330
 1005    HD3  LYS 129           3HD      LYS 129  26.754   3.784 -50.707
 1006    HE2  LYS 129           2HE      LYS 129  27.529   3.814 -53.057
 1007    HE3  LYS 129           3HE      LYS 129  28.713   2.541 -52.686
 1008    HZ1  LYS 129           3HZ      LYS 129  26.874   1.085 -52.146
 1009    HZ2  LYS 129           1HZ      LYS 129  25.777   2.268 -52.490
 1010    HZ3  LYS 129           2HZ      LYS 129  26.729   1.647 -53.689
 1011    H    LYS 130           H        LYS 130  33.566   6.027 -50.910
 1012    HA   LYS 130           HA       LYS 130  35.349   3.819 -50.882
 1013    HB2  LYS 130           2HB      LYS 130  35.792   6.766 -50.270
 1014    HB3  LYS 130           3HB      LYS 130  37.100   5.570 -50.407
 1015    HG2  LYS 130           2HG      LYS 130  36.504   5.105 -52.728
 1016    HG3  LYS 130           3HG      LYS 130  35.092   6.171 -52.611
 1017    HD2  LYS 130           2HD      LYS 130  36.854   7.324 -53.812
 1018    HD3  LYS 130           3HD      LYS 130  36.599   8.112 -52.239
 1019    HE2  LYS 130           2HE      LYS 130  38.558   6.939 -51.313
 1020    HE3  LYS 130           3HE      LYS 130  38.796   6.090 -52.856
 1021    HZ1  LYS 130           3HZ      LYS 130  39.211   8.221 -53.891
 1022    HZ2  LYS 130           1HZ      LYS 130  38.988   9.009 -52.459
 1023    HZ3  LYS 130           2HZ      LYS 130  40.260   7.981 -52.645
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1  -1.091 -23.798   3.916
    2    H2   MET   1           H2       MET   1  -2.706 -23.623   3.672
    3    H3   MET   1           H3       MET   1  -1.857 -22.519   4.603
    4    HA   MET   1           HA       MET   1  -2.429 -22.433   1.928
    5    HB2  MET   1           2HB      MET   1  -2.296 -20.568   3.643
    6    HB3  MET   1           3HB      MET   1  -0.534 -20.676   3.517
    7    HG2  MET   1           2HG      MET   1  -1.553 -18.863   2.132
    8    HG3  MET   1           3HG      MET   1  -0.582 -20.013   1.212
    9    HE1  MET   1           3HE      MET   1  -2.559 -17.937  -0.203
   10    HE2  MET   1           1HE      MET   1  -1.593 -19.134  -1.098
   11    HE3  MET   1           2HE      MET   1  -3.337 -18.980  -1.413
   12    H    ALA   2           H        ALA   2  -0.938 -21.944   0.151
   13    HA   ALA   2           HA       ALA   2   1.722 -23.245   0.279
   14    HB1  ALA   2           1HB      ALA   2  -0.540 -24.089  -1.595
   15    HB2  ALA   2           2HB      ALA   2   1.145 -24.652  -1.679
   16    HB3  ALA   2           3HB      ALA   2   0.151 -25.069  -0.276
   17    H    ALA   3           H        ALA   3   2.689 -23.048  -2.020
   18    HA   ALA   3           HA       ALA   3   1.720 -20.760  -3.639
   19    HB1  ALA   3           1HB      ALA   3   4.574 -21.109  -2.618
   20    HB2  ALA   3           2HB      ALA   3   4.042 -19.907  -3.814
   21    HB3  ALA   3           3HB      ALA   3   3.446 -19.818  -2.145
   22    H    LYS   4           H        LYS   4   2.964 -20.771  -5.763
   23    HA   LYS   4           HA       LYS   4   3.309 -23.597  -6.725
   24    HB2  LYS   4           2HB      LYS   4   1.564 -21.367  -7.851
   25    HB3  LYS   4           3HB      LYS   4   1.904 -22.890  -8.694
   26    HG2  LYS   4           2HG      LYS   4   0.774 -24.188  -7.012
   27    HG3  LYS   4           3HG      LYS   4   0.622 -22.788  -5.942
   28    HD2  LYS   4           2HD      LYS   4  -1.523 -23.252  -6.944
   29    HD3  LYS   4           3HD      LYS   4  -0.906 -21.697  -7.523
   30    HE2  LYS   4           2HE      LYS   4  -0.136 -22.826  -9.624
   31    HE3  LYS   4           3HE      LYS   4  -0.869 -24.340  -9.039
   32    HZ1  LYS   4           3HZ      LYS   4  -3.017 -23.204  -9.009
   33    HZ2  LYS   4           1HZ      LYS   4  -2.312 -21.812  -9.561
   34    HZ3  LYS   4           2HZ      LYS   4  -2.340 -23.123 -10.521
   35    H    PHE   5           H        PHE   5   5.232 -21.267  -6.207
   36    HA   PHE   5           HA       PHE   5   6.624 -21.288  -8.825
   37    HB2  PHE   5           2HB      PHE   5   5.920 -18.827  -7.183
   38    HB3  PHE   5           3HB      PHE   5   7.129 -18.829  -8.456
   39    HD1  PHE   5           HD2      PHE   5   3.494 -19.439  -7.838
   40    HD2  PHE   5           HD1      PHE   5   6.514 -18.309 -10.680
   41    HE1  PHE   5           HE2      PHE   5   1.730 -19.004  -9.535
   42    HE2  PHE   5           HE1      PHE   5   4.743 -17.805 -12.340
   43    HZ   PHE   5           HZ       PHE   5   2.356 -18.188 -11.793
   44    H    GLU   6           H        GLU   6   8.909 -20.375  -8.455
   45    HA   GLU   6           HA       GLU   6   9.979 -20.867  -5.728
   46    HB2  GLU   6           2HB      GLU   6  10.895 -22.156  -8.318
   47    HB3  GLU   6           3HB      GLU   6  11.862 -22.113  -6.841
   48    HG2  GLU   6           2HG      GLU   6   9.160 -23.489  -7.167
   49    HG3  GLU   6           3HG      GLU   6  10.750 -24.252  -7.154
   50    H    VAL   7           H        VAL   7  11.826 -19.644  -5.336
   51    HA   VAL   7           HA       VAL   7  12.104 -17.154  -6.630
   52    HB   VAL   7           HB       VAL   7  14.008 -16.794  -5.182
   53   HG11  VAL   7          1HG1      VAL   7  11.901 -18.504  -3.778
   54   HG12  VAL   7          2HG1      VAL   7  13.002 -17.372  -2.984
   55   HG13  VAL   7          3HG1      VAL   7  11.774 -16.781  -4.131
   56   HG21  VAL   7          3HG2      VAL   7  13.999 -19.767  -4.553
   57   HG22  VAL   7          1HG2      VAL   7  15.248 -18.881  -5.456
   58   HG23  VAL   7          2HG2      VAL   7  14.976 -18.516  -3.745
   59    H    GLY   8           H        GLY   8  13.398 -16.226  -8.003
   60    HA2  GLY   8           2HA      GLY   8  15.081 -15.990  -9.552
   61    HA3  GLY   8           3HA      GLY   8  15.575 -17.676  -9.301
   62    H    SER   9           H        SER   9  12.461 -18.306  -9.787
   63    HA   SER   9           HA       SER   9  12.610 -18.827 -12.588
   64    HB2  SER   9           2HB      SER   9  10.084 -18.539 -10.928
   65    HB3  SER   9           3HB      SER   9  10.333 -19.508 -12.398
   66    HG   SER   9           HG       SER   9  10.407 -20.769 -10.456
   67    H    VAL  10           H        VAL  10  10.995 -17.967 -14.196
   68    HA   VAL  10           HA       VAL  10  10.339 -15.096 -13.867
   69    HB   VAL  10           HB       VAL  10  11.906 -16.277 -16.200
   70   HG11  VAL  10          1HG1      VAL  10  10.978 -13.413 -15.689
   71   HG12  VAL  10          2HG1      VAL  10  11.997 -13.944 -17.041
   72   HG13  VAL  10          3HG1      VAL  10  10.325 -14.509 -16.922
   73   HG21  VAL  10          3HG2      VAL  10  12.798 -14.236 -14.132
   74   HG22  VAL  10          1HG2      VAL  10  13.393 -15.906 -14.280
   75   HG23  VAL  10          2HG2      VAL  10  13.717 -14.739 -15.567
   76    H    TYR  11           H        TYR  11   8.310 -14.795 -14.511
   77    HA   TYR  11           HA       TYR  11   7.055 -16.558 -16.557
   78    HB2  TYR  11           2HB      TYR  11   6.146 -16.096 -13.709
   79    HB3  TYR  11           3HB      TYR  11   5.018 -16.589 -14.968
   80    HD1  TYR  11           HD1      TYR  11   5.242 -18.810 -16.098
   81    HD2  TYR  11           HD2      TYR  11   7.699 -17.704 -12.736
   82    HE1  TYR  11           HE1      TYR  11   5.777 -21.196 -15.719
   83    HE2  TYR  11           HE2      TYR  11   8.183 -20.112 -12.302
   84    HH   TYR  11           HH       TYR  11   6.867 -22.716 -14.397
   85    H    THR  12           H        THR  12   4.677 -15.567 -16.871
   86    HA   THR  12           HA       THR  12   4.919 -12.602 -16.968
   87    HB   THR  12           HB       THR  12   3.600 -14.409 -19.015
   88    HG1  THR  12           1HG      THR  12   5.463 -13.920 -20.275
   89   HG21  THR  12          1HG2      THR  12   4.459 -11.485 -19.170
   90   HG22  THR  12          2HG2      THR  12   3.721 -12.420 -20.486
   91   HG23  THR  12          3HG2      THR  12   2.788 -12.064 -19.024
   92    H    GLY  13           H        GLY  13   3.066 -11.437 -16.542
   93    HA2  GLY  13           2HA      GLY  13   0.615 -12.787 -15.650
   94    HA3  GLY  13           3HA      GLY  13   1.599 -12.034 -14.382
   95    H    LYS  14           H        LYS  14  -0.685 -10.864 -14.407
   96    HA   LYS  14           HA       LYS  14  -0.431  -8.442 -16.141
   97    HB2  LYS  14           2HB      LYS  14  -2.867 -10.097 -15.468
   98    HB3  LYS  14           3HB      LYS  14  -3.014  -8.364 -15.821
   99    HG2  LYS  14           2HG      LYS  14  -1.830  -8.741 -18.006
  100    HG3  LYS  14           3HG      LYS  14  -1.837 -10.489 -17.669
  101    HD2  LYS  14           2HD      LYS  14  -4.302 -10.458 -17.545
  102    HD3  LYS  14           3HD      LYS  14  -4.296  -8.707 -17.832
  103    HE2  LYS  14           2HE      LYS  14  -4.881  -9.703 -19.901
  104    HE3  LYS  14           3HE      LYS  14  -3.203  -9.135 -20.065
  105    HZ1  LYS  14           3HZ      LYS  14  -2.454 -11.398 -19.746
  106    HZ2  LYS  14           1HZ      LYS  14  -4.023 -11.940 -19.552
  107    HZ3  LYS  14           2HZ      LYS  14  -3.468 -11.330 -20.986
  108    H    VAL  15           H        VAL  15  -0.641  -6.530 -15.229
  109    HA   VAL  15           HA       VAL  15  -0.125  -6.399 -12.394
  110    HB   VAL  15           HB       VAL  15  -0.742  -4.118 -14.285
  111   HG11  VAL  15          1HG1      VAL  15   1.034  -4.320 -11.804
  112   HG12  VAL  15          2HG1      VAL  15   0.809  -2.861 -12.795
  113   HG13  VAL  15          3HG1      VAL  15  -0.554  -3.527 -11.877
  114   HG21  VAL  15          3HG2      VAL  15   1.950  -5.471 -13.908
  115   HG22  VAL  15          1HG2      VAL  15   0.974  -5.455 -15.387
  116   HG23  VAL  15          2HG2      VAL  15   1.652  -3.955 -14.792
  117    H    THR  16           H        THR  16  -1.537  -6.208 -10.802
  118    HA   THR  16           HA       THR  16  -4.412  -5.737 -11.458
  119    HB   THR  16           HB       THR  16  -4.621  -7.171  -9.264
  120    HG1  THR  16           1HG      THR  16  -2.908  -8.667  -9.095
  121   HG21  THR  16          1HG2      THR  16  -3.697  -8.393 -11.905
  122   HG22  THR  16          2HG2      THR  16  -4.613  -9.225 -10.627
  123   HG23  THR  16          3HG2      THR  16  -5.358  -7.896 -11.512
  124    H    GLY  17           H        GLY  17  -1.803  -4.264  -9.780
  125    HA2  GLY  17           2HA      GLY  17  -3.561  -2.095  -9.185
  126    HA3  GLY  17           3HA      GLY  17  -3.140  -2.951  -7.691
  127    H    LEU  18           H        LEU  18  -2.402  -0.332  -8.065
  128    HA   LEU  18           HA       LEU  18   0.566  -0.541  -8.037
  129    HB2  LEU  18           2HB      LEU  18  -1.128   1.700  -9.175
  130    HB3  LEU  18           3HB      LEU  18   0.599   1.844  -8.837
  131    HG   LEU  18           HG       LEU  18  -0.658  -0.013 -10.900
  132   HD11  LEU  18          1HD1      LEU  18   1.034   2.505 -11.221
  133   HD12  LEU  18          2HD1      LEU  18   0.469   1.466 -12.543
  134   HD13  LEU  18          3HD1      LEU  18  -0.700   2.373 -11.561
  135   HD21  LEU  18          3HD2      LEU  18   2.278   0.476 -10.307
  136   HD22  LEU  18          1HD2      LEU  18   1.366  -1.019  -9.986
  137   HD23  LEU  18          2HD2      LEU  18   1.623  -0.490 -11.650
  138    H    GLN  19           H        GLN  19   1.497   0.731  -6.461
  139    HA   GLN  19           HA       GLN  19  -0.167   2.151  -4.466
  140    HB2  GLN  19           2HB      GLN  19   1.807  -0.053  -3.783
  141    HB3  GLN  19           3HB      GLN  19   0.870   0.926  -2.646
  142    HG2  GLN  19           2HG      GLN  19  -1.232  -0.177  -3.446
  143    HG3  GLN  19           3HG      GLN  19  -0.269  -1.134  -4.584
  144   HE21  GLN  19          2HE2      GLN  19  -1.437  -0.941  -1.335
  145   HE22  GLN  19          1HE2      GLN  19  -0.516  -2.321  -0.730
  146    H    ALA  20           H        ALA  20   1.295   3.540  -3.145
  147    HA   ALA  20           HA       ALA  20   3.504   4.625  -4.520
  148    HB1  ALA  20           1HB      ALA  20   2.788   4.845  -1.565
  149    HB2  ALA  20           2HB      ALA  20   3.846   5.947  -2.473
  150    HB3  ALA  20           3HB      ALA  20   2.120   5.852  -2.878
  151    H    TYR  21           H        TYR  21   3.516   1.656  -2.946
  152    HA   TYR  21           HA       TYR  21   6.483   1.677  -2.783
  153    HB2  TYR  21           2HB      TYR  21   6.434   0.352  -0.836
  154    HB3  TYR  21           3HB      TYR  21   5.470   1.793  -0.530
  155    HD1  TYR  21           HD1      TYR  21   2.948   1.615  -0.394
  156    HD2  TYR  21           HD2      TYR  21   5.474  -1.856  -0.744
  157    HE1  TYR  21           HE1      TYR  21   1.082   0.185   0.394
  158    HE2  TYR  21           HE2      TYR  21   3.619  -3.296   0.081
  159    HH   TYR  21           HH       TYR  21   0.420  -1.926   0.982
  160    H    GLY  22           H        GLY  22   4.057   0.433  -4.690
  161    HA2  GLY  22           2HA      GLY  22   5.775  -1.321  -5.944
  162    HA3  GLY  22           3HA      GLY  22   4.964  -2.304  -4.720
  163    H    ALA  23           H        ALA  23   4.568  -3.248  -7.032
  164    HA   ALA  23           HA       ALA  23   1.873  -2.390  -8.043
  165    HB1  ALA  23           1HB      ALA  23   4.289  -3.348  -9.634
  166    HB2  ALA  23           2HB      ALA  23   2.665  -3.072 -10.290
  167    HB3  ALA  23           3HB      ALA  23   3.613  -1.707  -9.657
  168    H    PHE  24           H        PHE  24   0.438  -4.011  -7.714
  169    HA   PHE  24           HA       PHE  24   1.353  -6.712  -7.098
  170    HB2  PHE  24           2HB      PHE  24  -1.400  -5.468  -7.480
  171    HB3  PHE  24           3HB      PHE  24  -1.143  -7.192  -7.223
  172    HD1  PHE  24           HD2      PHE  24   0.452  -7.761  -5.132
  173    HD2  PHE  24           HD1      PHE  24  -1.926  -4.195  -5.597
  174    HE1  PHE  24           HE2      PHE  24   0.405  -7.466  -2.665
  175    HE2  PHE  24           HE1      PHE  24  -1.976  -3.912  -3.133
  176    HZ   PHE  24           HZ       PHE  24  -0.807  -5.538  -1.663
  177    H    VAL  25           H        VAL  25   1.344  -8.467  -8.484
  178    HA   VAL  25           HA       VAL  25   0.182  -8.149 -11.202
  179    HB   VAL  25           HB       VAL  25   2.922  -9.356 -10.666
  180   HG11  VAL  25          1HG1      VAL  25   1.464  -8.600 -13.233
  181   HG12  VAL  25          2HG1      VAL  25   3.094  -9.279 -13.141
  182   HG13  VAL  25          3HG1      VAL  25   1.706 -10.250 -12.628
  183   HG21  VAL  25          3HG2      VAL  25   2.322  -6.630 -11.865
  184   HG22  VAL  25          1HG2      VAL  25   3.110  -6.937 -10.303
  185   HG23  VAL  25          2HG2      VAL  25   3.914  -7.423 -11.794
  186    H    ALA  26           H        ALA  26  -1.391  -9.582 -11.210
  187    HA   ALA  26           HA       ALA  26  -1.331 -12.105  -9.766
  188    HB1  ALA  26           1HB      ALA  26  -3.100 -11.101 -12.025
  189    HB2  ALA  26           2HB      ALA  26  -3.375 -12.570 -11.057
  190    HB3  ALA  26           3HB      ALA  26  -3.438 -10.984 -10.276
  191    H    LEU  27           H        LEU  27  -0.959 -14.157 -10.604
  192    HA   LEU  27           HA       LEU  27   0.858 -14.147 -13.007
  193    HB2  LEU  27           2HB      LEU  27   1.084 -15.721 -10.430
  194    HB3  LEU  27           3HB      LEU  27   2.216 -15.775 -11.787
  195    HG   LEU  27           HG       LEU  27   1.724 -13.353  -9.999
  196   HD11  LEU  27          1HD1      LEU  27   4.069 -15.292 -10.135
  197   HD12  LEU  27          2HD1      LEU  27   3.983 -13.834  -9.127
  198   HD13  LEU  27          3HD1      LEU  27   2.880 -15.183  -8.820
  199   HD21  LEU  27          3HD2      LEU  27   3.799 -13.762 -12.179
  200   HD22  LEU  27          1HD2      LEU  27   2.400 -12.669 -12.251
  201   HD23  LEU  27          2HD2      LEU  27   3.671 -12.370 -11.069
  202    H    ASP  28           H        ASP  28  -1.585 -15.831 -11.108
  203    HA   ASP  28           HA       ASP  28  -2.099 -17.866 -13.152
  204    HB2  ASP  28           2HB      ASP  28  -0.347 -19.073 -12.239
  205    HB3  ASP  28           3HB      ASP  28  -0.513 -18.323 -10.655
  206    H    GLU  29           H        GLU  29  -3.965 -19.179 -12.424
  207    HA   GLU  29           HA       GLU  29  -6.123 -17.555 -11.603
  208    HB2  GLU  29           2HB      GLU  29  -5.780 -20.567 -11.734
  209    HB3  GLU  29           3HB      GLU  29  -7.335 -19.754 -11.503
  210    HG2  GLU  29           2HG      GLU  29  -5.526 -19.435 -13.939
  211    HG3  GLU  29           3HG      GLU  29  -6.955 -20.462 -13.841
  212    H    GLU  30           H        GLU  30  -3.822 -19.131  -9.576
  213    HA   GLU  30           HA       GLU  30  -5.532 -18.663  -7.173
  214    HB2  GLU  30           2HB      GLU  30  -3.528 -20.893  -7.641
  215    HB3  GLU  30           3HB      GLU  30  -4.472 -20.624  -6.167
  216    HG2  GLU  30           2HG      GLU  30  -6.561 -21.115  -7.386
  217    HG3  GLU  30           3HG      GLU  30  -5.645 -21.332  -8.887
  218    H    THR  31           H        THR  31  -2.972 -17.316  -8.781
  219    HA   THR  31           HA       THR  31  -1.465 -16.771  -6.273
  220    HB   THR  31           HB       THR  31   0.030 -17.534  -8.781
  221    HG1  THR  31           1HG      THR  31   0.208 -19.640  -7.976
  222   HG21  THR  31          1HG2      THR  31   0.650 -17.728  -5.802
  223   HG22  THR  31          2HG2      THR  31   1.760 -18.151  -7.121
  224   HG23  THR  31          3HG2      THR  31   1.241 -16.474  -6.911
  225    H    GLN  32           H        GLN  32  -0.460 -14.928  -6.121
  226    HA   GLN  32           HA       GLN  32  -0.129 -13.027  -8.353
  227    HB2  GLN  32           2HB      GLN  32  -2.357 -12.563  -7.520
  228    HB3  GLN  32           3HB      GLN  32  -1.789 -12.600  -5.842
  229    HG2  GLN  32           2HG      GLN  32  -0.591 -10.543  -6.100
  230    HG3  GLN  32           3HG      GLN  32  -0.856 -10.504  -7.842
  231   HE21  GLN  32          2HE2      GLN  32  -1.727  -8.823  -5.257
  232   HE22  GLN  32          1HE2      GLN  32  -3.391  -8.465  -5.641
  233    H    GLY  33           H        GLY  33   1.462 -11.411  -7.798
  234    HA2  GLY  33           2HA      GLY  33   2.749 -11.628  -5.133
  235    HA3  GLY  33           3HA      GLY  33   3.757 -11.768  -6.587
  236    H    LEU  34           H        LEU  34   4.638  -9.840  -5.264
  237    HA   LEU  34           HA       LEU  34   3.360  -7.274  -6.125
  238    HB2  LEU  34           2HB      LEU  34   2.752  -7.656  -3.836
  239    HB3  LEU  34           3HB      LEU  34   4.414  -8.094  -3.401
  240    HG   LEU  34           HG       LEU  34   5.157  -5.772  -3.834
  241   HD11  LEU  34          1HD1      LEU  34   2.197  -5.160  -4.273
  242   HD12  LEU  34          2HD1      LEU  34   3.500  -3.969  -4.154
  243   HD13  LEU  34          3HD1      LEU  34   3.469  -5.089  -5.509
  244   HD21  LEU  34          3HD2      LEU  34   2.779  -5.978  -1.941
  245   HD22  LEU  34          1HD2      LEU  34   4.469  -6.406  -1.570
  246   HD23  LEU  34          2HD2      LEU  34   4.031  -4.723  -1.902
  247    H    VAL  35           H        VAL  35   4.772  -6.396  -7.523
  248    HA   VAL  35           HA       VAL  35   7.669  -6.657  -7.258
  249    HB   VAL  35           HB       VAL  35   6.017  -4.632  -8.831
  250   HG11  VAL  35          1HG1      VAL  35   8.909  -5.562  -9.131
  251   HG12  VAL  35          2HG1      VAL  35   8.077  -4.413 -10.200
  252   HG13  VAL  35          3HG1      VAL  35   8.391  -3.988  -8.513
  253   HG21  VAL  35          3HG2      VAL  35   7.146  -7.269  -9.823
  254   HG22  VAL  35          1HG2      VAL  35   5.420  -6.880  -9.594
  255   HG23  VAL  35          2HG2      VAL  35   6.366  -6.019 -10.808
  256    H    HIS  36           H        HIS  36   8.738  -5.567  -5.552
  257    HA   HIS  36           HA       HIS  36   7.374  -3.372  -4.183
  258    HB2  HIS  36           2HB      HIS  36   9.139  -5.067  -3.202
  259    HB3  HIS  36           3HB      HIS  36  10.335  -3.981  -3.927
  260    HD1  HIS  36           HD1      HIS  36  11.002  -1.993  -2.373
  261    HD2  HIS  36           HD2      HIS  36   7.274  -3.715  -1.423
  262    HE1  HIS  36           HE1      HIS  36  10.214  -0.867  -0.274
  263    H    ILE  37           H        ILE  37   7.956  -1.135  -4.329
  264    HA   ILE  37           HA       ILE  37   8.659  -0.157  -6.888
  265    HB   ILE  37           HB       ILE  37   7.420   1.079  -5.123
  266   HG12  ILE  37          2HG1      ILE  37   9.746   2.673  -6.174
  267   HG13  ILE  37          3HG1      ILE  37   8.452   2.034  -7.208
  268   HG21  ILE  37          1HG2      ILE  37  10.196   1.559  -3.929
  269   HG22  ILE  37          2HG2      ILE  37   8.712   2.381  -3.436
  270   HG23  ILE  37          3HG2      ILE  37   8.876   0.644  -3.165
  271   HD11  ILE  37          3HD1      ILE  37   6.760   3.280  -5.900
  272   HD12  ILE  37          1HD1      ILE  37   8.043   3.938  -4.862
  273   HD13  ILE  37          2HD1      ILE  37   7.987   4.371  -6.576
  274    H    SER  38           H        SER  38  10.858  -0.940  -4.315
  275    HA   SER  38           HA       SER  38  13.261   0.086  -5.412
  276    HB2  SER  38           2HB      SER  38  13.092  -2.485  -3.852
  277    HB3  SER  38           3HB      SER  38  14.289  -1.179  -3.737
  278    HG   SER  38           HG       SER  38  12.837  -1.180  -1.955
  279    H    GLU  39           H        GLU  39  11.314  -2.351  -6.705
  280    HA   GLU  39           HA       GLU  39  13.572  -3.816  -8.008
  281    HB2  GLU  39           2HB      GLU  39  10.869  -4.760  -6.999
  282    HB3  GLU  39           3HB      GLU  39  11.966  -5.732  -7.960
  283    HG2  GLU  39           2HG      GLU  39  12.710  -4.573  -5.243
  284    HG3  GLU  39           3HG      GLU  39  12.011  -6.169  -5.488
  285    H    VAL  40           H        VAL  40  11.181  -1.577  -8.617
  286    HA   VAL  40           HA       VAL  40  10.063  -2.626 -11.065
  287    HB   VAL  40           HB       VAL  40  10.255   0.186  -9.930
  288   HG11  VAL  40          1HG1      VAL  40   8.483  -0.840 -12.194
  289   HG12  VAL  40          2HG1      VAL  40   8.395   0.774 -11.451
  290   HG13  VAL  40          3HG1      VAL  40   9.831   0.297 -12.370
  291   HG21  VAL  40          3HG2      VAL  40   7.958  -1.830  -9.939
  292   HG22  VAL  40          1HG2      VAL  40   8.921  -1.357  -8.540
  293   HG23  VAL  40          2HG2      VAL  40   7.876  -0.167  -9.321
  294    H    THR  41           H        THR  41  12.946  -0.582 -10.401
  295    HA   THR  41           HA       THR  41  14.115  -1.424 -12.960
  296    HB   THR  41           HB       THR  41  12.758   0.471 -13.658
  297    HG1  THR  41           1HG      THR  41  14.451   1.742 -14.475
  298   HG21  THR  41          1HG2      THR  41  14.289   2.126 -11.603
  299   HG22  THR  41          2HG2      THR  41  13.191   2.765 -12.836
  300   HG23  THR  41          3HG2      THR  41  12.559   1.741 -11.540
  301    H    HIS  42           H        HIS  42  16.372  -0.813 -13.088
  302    HA   HIS  42           HA       HIS  42  17.776  -0.729 -10.524
  303    HB2  HIS  42           2HB      HIS  42  18.631  -0.796 -13.437
  304    HB3  HIS  42           3HB      HIS  42  19.814  -0.653 -12.130
  305    HD1  HIS  42           HD1      HIS  42  18.097  -3.254 -14.093
  306    HD2  HIS  42           HD2      HIS  42  19.737  -2.835 -10.230
  307    HE1  HIS  42           HE1      HIS  42  18.438  -5.566 -13.227
  308    H    GLY  43           H        GLY  43  16.319   1.397 -10.242
  309    HA2  GLY  43           2HA      GLY  43  18.090   3.605 -10.080
  310    HA3  GLY  43           3HA      GLY  43  17.057   3.811 -11.505
  311    H    PHE  44           H        PHE  44  16.700   5.722  -9.800
  312    HA   PHE  44           HA       PHE  44  14.671   5.383  -7.817
  313    HB2  PHE  44           2HB      PHE  44  16.153   7.389  -8.123
  314    HB3  PHE  44           3HB      PHE  44  15.274   7.777  -9.604
  315    HD1  PHE  44           HD1      PHE  44  14.709   7.169  -5.933
  316    HD2  PHE  44           HD2      PHE  44  13.461   9.245  -9.499
  317    HE1  PHE  44           HE1      PHE  44  13.077   8.484  -4.598
  318    HE2  PHE  44           HE2      PHE  44  11.843  10.574  -8.152
  319    HZ   PHE  44           HZ       PHE  44  11.646  10.190  -5.707
  320    H    VAL  45           H        VAL  45  12.425   6.127  -8.001
  321    HA   VAL  45           HA       VAL  45  11.173   5.590 -10.654
  322    HB   VAL  45           HB       VAL  45  10.317   4.729  -7.869
  323   HG11  VAL  45          1HG1      VAL  45   8.800   4.418 -10.495
  324   HG12  VAL  45          2HG1      VAL  45   8.336   3.708  -8.942
  325   HG13  VAL  45          3HG1      VAL  45   8.324   5.467  -9.141
  326   HG21  VAL  45          3HG2      VAL  45  10.974   3.127 -10.381
  327   HG22  VAL  45          1HG2      VAL  45  11.979   3.241  -8.920
  328   HG23  VAL  45          2HG2      VAL  45  10.403   2.448  -8.838
  329    H    LYS  46           H        LYS  46  10.406   7.420 -11.435
  330    HA   LYS  46           HA       LYS  46  10.168   9.863  -9.993
  331    HB2  LYS  46           2HB      LYS  46   9.051   8.836 -12.623
  332    HB3  LYS  46           3HB      LYS  46   8.645  10.453 -12.034
  333    HG2  LYS  46           2HG      LYS  46  11.538   9.564 -12.292
  334    HG3  LYS  46           3HG      LYS  46  10.640  10.193 -13.687
  335    HD2  LYS  46           2HD      LYS  46  10.142  12.267 -12.426
  336    HD3  LYS  46           3HD      LYS  46  11.076  11.660 -11.047
  337    HE2  LYS  46           2HE      LYS  46  12.321  11.922 -13.801
  338    HE3  LYS  46           3HE      LYS  46  12.188  13.328 -12.720
  339    HZ1  LYS  46           3HZ      LYS  46  13.479  12.100 -11.084
  340    HZ2  LYS  46           1HZ      LYS  46  13.612  10.809 -12.080
  341    HZ3  LYS  46           2HZ      LYS  46  14.316  12.211 -12.494
  342    H    ASP  47           H        ASP  47   7.651   7.682 -11.140
  343    HA   ASP  47           HA       ASP  47   6.162   7.727  -8.655
  344    HB2  ASP  47           2HB      ASP  47   5.088   9.683  -9.645
  345    HB3  ASP  47           3HB      ASP  47   4.953   8.860 -11.210
  346    H    ILE  48           H        ILE  48   5.088   5.562  -8.690
  347    HA   ILE  48           HA       ILE  48   6.286   3.746 -10.541
  348    HB   ILE  48           HB       ILE  48   5.501   3.254  -8.191
  349   HG12  ILE  48          2HG1      ILE  48   4.538   1.316 -10.292
  350   HG13  ILE  48          3HG1      ILE  48   6.235   1.587  -9.854
  351   HG21  ILE  48          1HG2      ILE  48   2.764   3.073  -9.537
  352   HG22  ILE  48          2HG2      ILE  48   3.132   2.546  -7.893
  353   HG23  ILE  48          3HG2      ILE  48   3.242   4.253  -8.305
  354   HD11  ILE  48          3HD1      ILE  48   5.764   0.891  -7.524
  355   HD12  ILE  48          1HD1      ILE  48   4.067   0.606  -7.959
  356   HD13  ILE  48          2HD1      ILE  48   5.337  -0.385  -8.683
  357    H    ASN  49           H        ASN  49   3.174   5.397 -10.928
  358    HA   ASN  49           HA       ASN  49   2.489   3.730 -13.174
  359    HB2  ASN  49           2HB      ASN  49   0.528   4.766 -13.025
  360    HB3  ASN  49           3HB      ASN  49   1.178   5.647 -11.641
  361   HD21  ASN  49          2HD2      ASN  49   2.265   7.770 -12.096
  362   HD22  ASN  49          1HD2      ASN  49   1.620   8.721 -13.463
  363    H    GLU  50           H        GLU  50   4.886   6.199 -12.988
  364    HA   GLU  50           HA       GLU  50   4.927   6.650 -15.857
  365    HB2  GLU  50           2HB      GLU  50   7.029   7.040 -13.709
  366    HB3  GLU  50           3HB      GLU  50   7.301   7.426 -15.399
  367    HG2  GLU  50           2HG      GLU  50   5.012   8.578 -13.804
  368    HG3  GLU  50           3HG      GLU  50   6.600   9.351 -13.805
  369    H    HIS  51           H        HIS  51   5.860   3.979 -13.859
  370    HA   HIS  51           HA       HIS  51   7.839   3.009 -15.898
  371    HB2  HIS  51           2HB      HIS  51   7.713   2.432 -12.901
  372    HB3  HIS  51           3HB      HIS  51   8.829   1.754 -14.088
  373    HD1  HIS  51           HD1      HIS  51  11.087   2.910 -14.092
  374    HD2  HIS  51           HD2      HIS  51   7.970   5.412 -12.822
  375    HE1  HIS  51           HE1      HIS  51  12.165   5.007 -13.292
  376    H    LEU  52           H        LEU  52   4.904   2.238 -14.173
  377    HA   LEU  52           HA       LEU  52   4.616  -0.301 -15.659
  378    HB2  LEU  52           2HB      LEU  52   4.547   0.118 -12.666
  379    HB3  LEU  52           3HB      LEU  52   3.508  -1.112 -13.394
  380    HG   LEU  52           HG       LEU  52   6.539  -1.042 -13.708
  381   HD11  LEU  52          1HD1      LEU  52   4.769  -2.770 -11.933
  382   HD12  LEU  52          2HD1      LEU  52   6.525  -2.944 -12.129
  383   HD13  LEU  52          3HD1      LEU  52   5.863  -1.489 -11.373
  384   HD21  LEU  52          3HD2      LEU  52   4.496  -3.194 -14.412
  385   HD22  LEU  52          1HD2      LEU  52   5.385  -2.195 -15.577
  386   HD23  LEU  52          2HD2      LEU  52   6.260  -3.333 -14.571
  387    H    SER  53           H        SER  53   2.276  -1.042 -15.495
  388    HA   SER  53           HA       SER  53   0.355   1.204 -15.182
  389    HB2  SER  53           2HB      SER  53   0.642  -0.541 -17.662
  390    HB3  SER  53           3HB      SER  53  -0.588   0.709 -17.383
  391    HG   SER  53           HG       SER  53   1.179   1.462 -18.659
  392    H    VAL  54           H        VAL  54  -1.334   0.395 -13.953
  393    HA   VAL  54           HA       VAL  54  -1.897  -2.410 -13.612
  394    HB   VAL  54           HB       VAL  54  -2.538  -0.664 -12.000
  395   HG11  VAL  54          1HG1      VAL  54  -4.618   0.189 -14.059
  396   HG12  VAL  54          2HG1      VAL  54  -4.543   0.742 -12.376
  397   HG13  VAL  54          3HG1      VAL  54  -3.245   1.164 -13.504
  398   HG21  VAL  54          3HG2      VAL  54  -4.858  -2.268 -13.069
  399   HG22  VAL  54          1HG2      VAL  54  -3.641  -2.778 -11.880
  400   HG23  VAL  54          2HG2      VAL  54  -4.783  -1.482 -11.484
  401    H    GLY  55           H        GLY  55  -3.343  -3.761 -14.468
  402    HA2  GLY  55           2HA      GLY  55  -4.702  -4.671 -16.050
  403    HA3  GLY  55           3HA      GLY  55  -5.139  -3.033 -16.583
  404    H    ASP  56           H        ASP  56  -1.776  -4.188 -16.499
  405    HA   ASP  56           HA       ASP  56  -1.794  -4.592 -19.465
  406    HB2  ASP  56           2HB      ASP  56  -0.797  -2.432 -18.818
  407    HB3  ASP  56           3HB      ASP  56   0.376  -3.275 -17.792
  408    H    GLU  57           H        GLU  57   0.045  -6.019 -20.137
  409    HA   GLU  57           HA       GLU  57   0.460  -8.207 -18.143
  410    HB2  GLU  57           2HB      GLU  57  -0.805  -8.734 -20.202
  411    HB3  GLU  57           3HB      GLU  57   0.580  -8.206 -21.177
  412    HG2  GLU  57           2HG      GLU  57   1.955 -10.005 -20.330
  413    HG3  GLU  57           3HG      GLU  57   0.742 -10.432 -19.114
  414    H    VAL  58           H        VAL  58   2.484  -8.818 -17.577
  415    HA   VAL  58           HA       VAL  58   4.869  -7.555 -18.813
  416    HB   VAL  58           HB       VAL  58   5.642  -6.857 -16.534
  417   HG11  VAL  58          1HG1      VAL  58   3.084  -5.470 -17.463
  418   HG12  VAL  58          2HG1      VAL  58   4.300  -4.776 -16.381
  419   HG13  VAL  58          3HG1      VAL  58   4.717  -5.152 -18.064
  420   HG21  VAL  58          3HG2      VAL  58   2.776  -7.314 -15.650
  421   HG22  VAL  58          1HG2      VAL  58   4.215  -8.195 -15.098
  422   HG23  VAL  58          2HG2      VAL  58   4.041  -6.476 -14.726
  423    H    GLN  59           H        GLN  59   6.695  -8.747 -18.614
  424    HA   GLN  59           HA       GLN  59   6.536 -11.414 -17.405
  425    HB2  GLN  59           2HB      GLN  59   7.732 -10.909 -19.563
  426    HB3  GLN  59           3HB      GLN  59   8.898  -9.951 -18.630
  427    HG2  GLN  59           2HG      GLN  59   9.481 -11.980 -17.309
  428    HG3  GLN  59           3HG      GLN  59   8.324 -12.928 -18.252
  429   HE21  GLN  59          2HE2      GLN  59   8.966 -13.759 -20.248
  430   HE22  GLN  59          1HE2      GLN  59  10.550 -13.435 -20.948
  431    H    VAL  60           H        VAL  60   7.460 -11.912 -15.417
  432    HA   VAL  60           HA       VAL  60   8.825  -9.783 -13.815
  433    HB   VAL  60           HB       VAL  60   7.519 -10.795 -11.867
  434   HG11  VAL  60          1HG1      VAL  60   5.937  -9.218 -13.930
  435   HG12  VAL  60          2HG1      VAL  60   5.529  -9.374 -12.211
  436   HG13  VAL  60          3HG1      VAL  60   7.020  -8.563 -12.670
  437   HG21  VAL  60          3HG2      VAL  60   5.670 -11.803 -14.055
  438   HG22  VAL  60          1HG2      VAL  60   6.616 -12.791 -12.915
  439   HG23  VAL  60          2HG2      VAL  60   5.325 -11.745 -12.326
  440    H    LYS  61           H        LYS  61  10.408 -10.504 -12.445
  441    HA   LYS  61           HA       LYS  61  11.088 -13.410 -12.554
  442    HB2  LYS  61           2HB      LYS  61  12.861 -11.756 -13.030
  443    HB3  LYS  61           3HB      LYS  61  12.599 -11.015 -11.436
  444    HG2  LYS  61           2HG      LYS  61  13.295 -13.064 -10.313
  445    HG3  LYS  61           3HG      LYS  61  13.405 -13.923 -11.861
  446    HD2  LYS  61           2HD      LYS  61  15.237 -12.422 -12.574
  447    HD3  LYS  61           3HD      LYS  61  15.120 -11.544 -11.028
  448    HE2  LYS  61           2HE      LYS  61  15.656 -13.630  -9.806
  449    HE3  LYS  61           3HE      LYS  61  15.768 -14.510 -11.347
  450    HZ1  LYS  61           3HZ      LYS  61  17.612 -13.080 -11.955
  451    HZ2  LYS  61           1HZ      LYS  61  17.512 -12.268 -10.522
  452    HZ3  LYS  61           2HZ      LYS  61  17.932 -13.854 -10.540
  453    H    VAL  62           H        VAL  62  10.638 -14.714 -10.831
  454    HA   VAL  62           HA       VAL  62   9.346 -13.772  -8.432
  455    HB   VAL  62           HB       VAL  62  10.783 -16.415  -8.924
  456   HG11  VAL  62          1HG1      VAL  62   8.572 -15.618  -6.978
  457   HG12  VAL  62          2HG1      VAL  62   9.239 -17.247  -7.158
  458   HG13  VAL  62          3HG1      VAL  62  10.252 -15.935  -6.538
  459   HG21  VAL  62          3HG2      VAL  62   7.853 -15.714  -9.405
  460   HG22  VAL  62          1HG2      VAL  62   9.062 -16.077 -10.660
  461   HG23  VAL  62          2HG2      VAL  62   8.583 -17.333  -9.516
  462    H    LEU  63           H        LEU  63  10.329 -12.571  -6.945
  463    HA   LEU  63           HA       LEU  63  13.274 -12.597  -6.680
  464    HB2  LEU  63           2HB      LEU  63  12.016 -10.504  -6.867
  465    HB3  LEU  63           3HB      LEU  63  11.091 -10.908  -5.419
  466    HG   LEU  63           HG       LEU  63  13.182 -10.853  -4.068
  467   HD11  LEU  63          1HD1      LEU  63  14.457  -9.761  -6.620
  468   HD12  LEU  63          2HD1      LEU  63  15.216  -9.813  -5.018
  469   HD13  LEU  63          3HD1      LEU  63  14.845 -11.323  -5.855
  470   HD21  LEU  63          3HD2      LEU  63  12.544  -8.360  -5.679
  471   HD22  LEU  63          1HD2      LEU  63  11.699  -8.906  -4.220
  472   HD23  LEU  63          2HD2      LEU  63  13.396  -8.381  -4.121
  473    H    ALA  64           H        ALA  64  10.350 -13.308  -4.769
  474    HA   ALA  64           HA       ALA  64  11.777 -15.117  -2.968
  475    HB1  ALA  64           1HB      ALA  64  10.557 -12.554  -1.894
  476    HB2  ALA  64           2HB      ALA  64  11.118 -13.920  -0.918
  477    HB3  ALA  64           3HB      ALA  64  12.280 -12.982  -1.873
  478    H    VAL  65           H        VAL  65  10.173 -16.232  -1.545
  479    HA   VAL  65           HA       VAL  65   7.298 -15.729  -2.053
  480    HB   VAL  65           HB       VAL  65   7.954 -17.360  -3.752
  481   HG11  VAL  65          1HG1      VAL  65   8.944 -19.117  -1.463
  482   HG12  VAL  65          2HG1      VAL  65   8.774 -19.623  -3.152
  483   HG13  VAL  65          3HG1      VAL  65   9.951 -18.376  -2.719
  484   HG21  VAL  65          3HG2      VAL  65   6.369 -18.652  -1.522
  485   HG22  VAL  65          1HG2      VAL  65   5.749 -17.621  -2.827
  486   HG23  VAL  65          2HG2      VAL  65   6.448 -19.206  -3.205
  487    H    ASP  66           H        ASP  66   6.001 -16.226  -0.376
  488    HA   ASP  66           HA       ASP  66   7.142 -17.720   1.924
  489    HB2  ASP  66           2HB      ASP  66   7.256 -15.305   2.499
  490    HB3  ASP  66           3HB      ASP  66   5.522 -15.160   2.201
  491    H    GLU  67           H        GLU  67   5.974 -19.528   1.601
  492    HA   GLU  67           HA       GLU  67   3.334 -19.440   0.401
  493    HB2  GLU  67           2HB      GLU  67   3.509 -21.813   0.345
  494    HB3  GLU  67           3HB      GLU  67   5.054 -21.115  -0.162
  495    HG2  GLU  67           2HG      GLU  67   5.969 -21.565   2.129
  496    HG3  GLU  67           3HG      GLU  67   4.422 -22.301   2.569
  497    H    GLU  68           H        GLU  68   4.360 -19.234   3.691
  498    HA   GLU  68           HA       GLU  68   1.905 -20.376   4.775
  499    HB2  GLU  68           2HB      GLU  68   3.854 -18.441   6.087
  500    HB3  GLU  68           3HB      GLU  68   2.631 -19.445   6.884
  501    HG2  GLU  68           2HG      GLU  68   3.830 -21.479   6.007
  502    HG3  GLU  68           3HG      GLU  68   5.127 -20.419   5.432
  503    H    LYS  69           H        LYS  69   3.224 -17.097   4.162
  504    HA   LYS  69           HA       LYS  69   0.699 -15.703   4.503
  505    HB2  LYS  69           2HB      LYS  69   3.264 -15.070   2.991
  506    HB3  LYS  69           3HB      LYS  69   1.900 -13.939   3.130
  507    HG2  LYS  69           2HG      LYS  69   2.103 -13.993   5.601
  508    HG3  LYS  69           3HG      LYS  69   3.475 -15.112   5.467
  509    HD2  LYS  69           2HD      LYS  69   4.759 -13.396   4.217
  510    HD3  LYS  69           3HD      LYS  69   3.384 -12.267   4.364
  511    HE2  LYS  69           2HE      LYS  69   3.544 -12.415   6.836
  512    HE3  LYS  69           3HE      LYS  69   4.921 -13.530   6.679
  513    HZ1  LYS  69           3HZ      LYS  69   6.154 -11.761   5.618
  514    HZ2  LYS  69           1HZ      LYS  69   4.866 -10.725   5.754
  515    HZ3  LYS  69           2HZ      LYS  69   5.639 -11.281   7.095
  516    H    GLY  70           H        GLY  70   2.056 -17.665   1.963
  517    HA2  GLY  70           2HA      GLY  70   1.213 -18.365  -0.062
  518    HA3  GLY  70           3HA      GLY  70  -0.345 -17.632   0.375
  519    H    LYS  71           H        LYS  71   2.892 -16.088   0.028
  520    HA   LYS  71           HA       LYS  71   1.817 -14.412  -2.197
  521    HB2  LYS  71           2HB      LYS  71   2.206 -12.421  -1.101
  522    HB3  LYS  71           3HB      LYS  71   1.471 -13.439   0.137
  523    HG2  LYS  71           2HG      LYS  71   3.134 -12.552   1.416
  524    HG3  LYS  71           3HG      LYS  71   4.042 -13.921   0.759
  525    HD2  LYS  71           2HD      LYS  71   5.071 -12.467  -0.932
  526    HD3  LYS  71           3HD      LYS  71   4.053 -11.104  -0.426
  527    HE2  LYS  71           2HE      LYS  71   5.123 -11.228   1.837
  528    HE3  LYS  71           3HE      LYS  71   6.196 -12.508   1.226
  529    HZ1  LYS  71           3HZ      LYS  71   7.049 -10.928  -0.385
  530    HZ2  LYS  71           1HZ      LYS  71   6.060  -9.745   0.175
  531    HZ3  LYS  71           2HZ      LYS  71   7.250 -10.353   1.139
  532    H    ILE  72           H        ILE  72   3.431 -13.141  -3.270
  533    HA   ILE  72           HA       ILE  72   6.163 -14.345  -3.298
  534    HB   ILE  72           HB       ILE  72   4.169 -13.984  -5.575
  535   HG12  ILE  72          2HG1      ILE  72   5.798 -16.404  -4.745
  536   HG13  ILE  72          3HG1      ILE  72   4.117 -16.114  -4.260
  537   HG21  ILE  72          1HG2      ILE  72   7.148 -14.574  -5.779
  538   HG22  ILE  72          2HG2      ILE  72   6.008 -14.598  -7.135
  539   HG23  ILE  72          3HG2      ILE  72   6.355 -13.094  -6.316
  540   HD11  ILE  72          3HD1      ILE  72   3.412 -16.149  -6.622
  541   HD12  ILE  72          1HD1      ILE  72   5.075 -16.481  -7.126
  542   HD13  ILE  72          2HD1      ILE  72   4.204 -17.666  -6.152
  543    H    SER  73           H        SER  73   7.752 -12.884  -3.581
  544    HA   SER  73           HA       SER  73   7.022 -10.031  -4.065
  545    HB2  SER  73           2HB      SER  73   9.713 -11.186  -3.300
  546    HB3  SER  73           3HB      SER  73   9.197  -9.494  -3.240
  547    HG   SER  73           HG       SER  73   9.172 -10.512  -1.181
  548    H    LEU  74           H        LEU  74   8.030  -8.977  -5.901
  549    HA   LEU  74           HA       LEU  74   9.078 -10.836  -7.996
  550    HB2  LEU  74           2HB      LEU  74   6.886  -8.771  -8.200
  551    HB3  LEU  74           3HB      LEU  74   7.588  -9.613  -9.588
  552    HG   LEU  74           HG       LEU  74   6.055 -10.974  -7.329
  553   HD11  LEU  74          1HD1      LEU  74   5.164 -10.245 -10.144
  554   HD12  LEU  74          2HD1      LEU  74   4.227 -11.194  -8.981
  555   HD13  LEU  74          3HD1      LEU  74   4.590  -9.489  -8.648
  556   HD21  LEU  74          3HD2      LEU  74   7.001 -12.028 -10.020
  557   HD22  LEU  74          1HD2      LEU  74   7.671 -12.454  -8.435
  558   HD23  LEU  74          2HD2      LEU  74   6.017 -12.910  -8.840
  559    H    SER  75           H        SER  75  10.071  -9.687  -9.792
  560    HA   SER  75           HA       SER  75  10.827  -6.855  -9.285
  561    HB2  SER  75           2HB      SER  75  12.708  -8.977 -10.365
  562    HB3  SER  75           3HB      SER  75  13.089  -7.280 -10.003
  563    HG   SER  75           HG       SER  75  13.774  -8.648  -8.317
  564    H    ILE  76           H        ILE  76  10.999  -5.604 -11.048
  565    HA   ILE  76           HA       ILE  76  10.473  -6.756 -13.773
  566    HB   ILE  76           HB       ILE  76   9.624  -4.158 -12.466
  567   HG12  ILE  76          2HG1      ILE  76   8.168  -6.077 -12.123
  568   HG13  ILE  76          3HG1      ILE  76   7.405  -4.756 -13.004
  569   HG21  ILE  76          1HG2      ILE  76   9.474  -4.824 -15.431
  570   HG22  ILE  76          2HG2      ILE  76   8.711  -3.416 -14.645
  571   HG23  ILE  76          3HG2      ILE  76  10.467  -3.568 -14.708
  572   HD11  ILE  76          3HD1      ILE  76   7.668  -6.003 -15.134
  573   HD12  ILE  76          1HD1      ILE  76   8.447  -7.324 -14.236
  574   HD13  ILE  76          2HD1      ILE  76   6.744  -6.907 -13.962
  575    H    ARG  77           H        ARG  77  12.606  -4.685 -11.828
  576    HA   ARG  77           HA       ARG  77  14.238  -3.762 -13.931
  577    HB2  ARG  77           2HB      ARG  77  15.946  -3.519 -12.314
  578    HB3  ARG  77           3HB      ARG  77  14.409  -3.211 -11.499
  579    HG2  ARG  77           2HG      ARG  77  14.482  -5.493 -10.507
  580    HG3  ARG  77           3HG      ARG  77  16.060  -5.762 -11.280
  581    HD2  ARG  77           2HD      ARG  77  17.054  -3.928 -10.021
  582    HD3  ARG  77           3HD      ARG  77  15.481  -3.478  -9.352
  583    HE   ARG  77           HE       ARG  77  15.412  -5.590  -8.146
  584   HH11  ARG  77          1HH1      ARG  77  18.644  -5.021  -9.521
  585   HH12  ARG  77          2HH1      ARG  77  19.449  -5.784  -8.189
  586   HH21  ARG  77          1HH2      ARG  77  16.447  -6.340  -6.357
  587   HH22  ARG  77          2HH2      ARG  77  18.188  -6.567  -6.351
  588    H    ALA  78           H        ALA  78  13.873  -7.015 -12.820
  589    HA   ALA  78           HA       ALA  78  16.238  -8.067 -14.138
  590    HB1  ALA  78           1HB      ALA  78  13.736  -9.419 -13.037
  591    HB2  ALA  78           2HB      ALA  78  15.244 -10.233 -13.502
  592    HB3  ALA  78           3HB      ALA  78  15.235  -9.106 -12.125
  593    H    THR  79           H        THR  79  13.049  -7.189 -15.294
  594    HA   THR  79           HA       THR  79  13.315  -9.045 -17.630
  595    HB   THR  79           HB       THR  79  10.840  -9.114 -17.600
  596    HG1  THR  79           1HG      THR  79   9.799  -8.322 -15.716
  597   HG21  THR  79          1HG2      THR  79  12.062  -9.901 -14.909
  598   HG22  THR  79          2HG2      THR  79  10.542 -10.508 -15.582
  599   HG23  THR  79          3HG2      THR  79  12.066 -10.898 -16.383
  600    H    GLN  80           H        GLN  80  12.819  -5.737 -16.624
  601    HA   GLN  80           HA       GLN  80  12.663  -4.867 -19.453
  602    HB2  GLN  80           2HB      GLN  80  10.893  -3.805 -17.222
  603    HB3  GLN  80           3HB      GLN  80  10.962  -3.219 -18.889
  604    HG2  GLN  80           2HG      GLN  80  10.107  -5.475 -19.647
  605    HG3  GLN  80           3HG      GLN  80   9.868  -5.906 -17.948
  606   HE21  GLN  80          2HE2      GLN  80   8.089  -4.953 -16.787
  607   HE22  GLN  80          1HE2      GLN  80   6.878  -3.985 -17.604
  608    H    ALA  81           H        ALA  81  13.577  -2.730 -19.726
  609    HA   ALA  81           HA       ALA  81  15.415  -1.759 -17.732
  610    HB1  ALA  81           1HB      ALA  81  14.210  -0.365 -20.170
  611    HB2  ALA  81           2HB      ALA  81  15.617   0.192 -19.236
  612    HB3  ALA  81           3HB      ALA  81  15.708  -1.328 -20.150
  613    H    ALA  82           H        ALA  82  12.114  -0.892 -18.649
  614    HA   ALA  82           HA       ALA  82  10.657   0.698 -17.937
  615    HB1  ALA  82           1HB      ALA  82  11.383  -0.587 -15.277
  616    HB2  ALA  82           2HB      ALA  82   9.874   0.273 -15.646
  617    HB3  ALA  82           3HB      ALA  82  10.252  -1.250 -16.476
  618    HA   PRO  83           HA       PRO  83  14.022   3.561 -16.431
  619    HB2  PRO  83           2HB      PRO  83  14.158   5.346 -18.511
  620    HB3  PRO  83           3HB      PRO  83  15.024   3.782 -18.517
  621    HG2  PRO  83           2HG      PRO  83  12.340   4.473 -19.792
  622    HG3  PRO  83           3HG      PRO  83  13.706   3.583 -20.526
  623    HD2  PRO  83           2HD      PRO  83  11.550   2.281 -19.383
  624    HD3  PRO  83           3HD      PRO  83  13.206   1.615 -19.301
  625    H    GLU  84           H        GLU  84  13.941   5.816 -15.782
  626    HA   GLU  84           HA       GLU  84  11.421   6.886 -14.992
  627    HB2  GLU  84           2HB      GLU  84  14.163   8.158 -15.319
  628    HB3  GLU  84           3HB      GLU  84  12.776   8.950 -14.549
  629    HG2  GLU  84           2HG      GLU  84  12.737   7.235 -12.785
  630    HG3  GLU  84           3HG      GLU  84  14.046   6.354 -13.596
  631    H    LYS  85           H        LYS  85  10.088   8.374 -15.928
  632    HA   LYS  85           HA       LYS  85  11.015  10.221 -17.979
  633    HB2  LYS  85           2HB      LYS  85   9.565   9.622 -19.716
  634    HB3  LYS  85           3HB      LYS  85  10.286   8.095 -19.201
  635    HG2  LYS  85           2HG      LYS  85   8.156   7.796 -17.741
  636    HG3  LYS  85           3HG      LYS  85   7.471   9.119 -18.715
  637    HD2  LYS  85           2HD      LYS  85   8.194   7.699 -20.766
  638    HD3  LYS  85           3HD      LYS  85   8.379   6.369 -19.608
  639    HE2  LYS  85           2HE      LYS  85   5.863   7.871 -20.408
  640    HE3  LYS  85           3HE      LYS  85   6.209   6.143 -20.577
  641    HZ1  LYS  85           3HZ      LYS  85   6.134   5.962 -18.159
  642    HZ2  LYS  85           1HZ      LYS  85   5.794   7.577 -18.014
  643    HZ3  LYS  85           2HZ      LYS  85   4.718   6.591 -18.751
  644    H    LYS  86           H        LYS  86   9.076  11.736 -18.523
  645    HA   LYS  86           HA       LYS  86   7.184  11.987 -16.233
  646    HB2  LYS  86           2HB      LYS  86   8.902  14.180 -17.461
  647    HB3  LYS  86           3HB      LYS  86   7.491  14.476 -16.426
  648    HG2  LYS  86           2HG      LYS  86   8.571  13.211 -14.584
  649    HG3  LYS  86           3HG      LYS  86   9.981  12.920 -15.618
  650    HD2  LYS  86           2HD      LYS  86  10.509  14.723 -14.114
  651    HD3  LYS  86           3HD      LYS  86  10.368  15.378 -15.759
  652    HE2  LYS  86           2HE      LYS  86   8.091  16.183 -15.255
  653    HE3  LYS  86           3HE      LYS  86   8.185  15.484 -13.626
  654    HZ1  LYS  86           3HZ      LYS  86   9.995  17.011 -13.151
  655    HZ2  LYS  86           1HZ      LYS  86   9.910  17.655 -14.664
  656    HZ3  LYS  86           2HZ      LYS  86   8.663  17.840 -13.609
  657    H    GLU  87           H        GLU  87   5.573  11.075 -17.439
  658    HA   GLU  87           HA       GLU  87   4.463  12.639 -19.716
  659    HB2  GLU  87           2HB      GLU  87   6.206  10.918 -20.479
  660    HB3  GLU  87           3HB      GLU  87   5.068   9.681 -19.922
  661    HG2  GLU  87           2HG      GLU  87   3.410  10.394 -21.535
  662    HG3  GLU  87           3HG      GLU  87   4.369  11.810 -21.991
  663    H    SER  88           H        SER  88   4.005  10.894 -16.868
  664    HA   SER  88           HA       SER  88   1.139  10.309 -17.421
  665    HB2  SER  88           2HB      SER  88   2.718   8.463 -15.684
  666    HB3  SER  88           3HB      SER  88   1.315   8.138 -16.716
  667    HG   SER  88           HG       SER  88   3.242   7.199 -17.491
  668    H    LYS  89           H        LYS  89   2.821  12.428 -15.884
  669    HA   LYS  89           HA       LYS  89   2.022  12.369 -13.179
  670    HB2  LYS  89           2HB      LYS  89   2.231  14.803 -13.255
  671    HB3  LYS  89           3HB      LYS  89   3.568  14.020 -14.105
  672    HG2  LYS  89           2HG      LYS  89   2.492  14.534 -16.282
  673    HG3  LYS  89           3HG      LYS  89   1.126  15.287 -15.434
  674    HD2  LYS  89           2HD      LYS  89   2.668  16.969 -14.449
  675    HD3  LYS  89           3HD      LYS  89   4.027  16.222 -15.327
  676    HE2  LYS  89           2HE      LYS  89   2.903  16.689 -17.478
  677    HE3  LYS  89           3HE      LYS  89   1.530  17.412 -16.612
  678    HZ1  LYS  89           3HZ      LYS  89   3.016  19.107 -15.782
  679    HZ2  LYS  89           1HZ      LYS  89   4.298  18.430 -16.587
  680    HZ3  LYS  89           2HZ      LYS  89   3.046  19.087 -17.424
  681    HA   PRO  90           HA       PRO  90  -2.397  12.874 -13.314
  682    HB2  PRO  90           2HB      PRO  90  -2.878  14.585 -11.187
  683    HB3  PRO  90           3HB      PRO  90  -2.576  12.831 -11.025
  684    HG2  PRO  90           2HG      PRO  90  -0.638  15.158 -10.707
  685    HG3  PRO  90           3HG      PRO  90  -0.788  13.705  -9.675
  686    HD2  PRO  90           2HD      PRO  90   1.140  13.913 -11.621
  687    HD3  PRO  90           3HD      PRO  90   0.364  12.351 -11.255
  688    H    ARG  91           H        ARG  91  -4.029  14.500 -13.805
  689    HA   ARG  91           HA       ARG  91  -2.870  16.957 -15.083
  690    HB2  ARG  91           2HB      ARG  91  -4.951  15.021 -16.179
  691    HB3  ARG  91           3HB      ARG  91  -4.433  16.527 -16.956
  692    HG2  ARG  91           2HG      ARG  91  -2.111  15.634 -17.120
  693    HG3  ARG  91           3HG      ARG  91  -2.660  14.115 -16.390
  694    HD2  ARG  91           2HD      ARG  91  -2.554  13.792 -18.776
  695    HD3  ARG  91           3HD      ARG  91  -4.261  13.814 -18.288
  696    HE   ARG  91           HE       ARG  91  -3.297  16.424 -19.079
  697   HH11  ARG  91          1HH1      ARG  91  -4.509  13.356 -20.387
  698   HH12  ARG  91          2HH1      ARG  91  -5.103  14.056 -21.853
  699   HH21  ARG  91          1HH2      ARG  91  -4.086  17.334 -21.036
  700   HH22  ARG  91          2HH2      ARG  91  -4.850  16.338 -22.227
  701    H    LYS  92           H        LYS  92  -4.854  16.130 -12.660
  702    HA   LYS  92           HA       LYS  92  -6.825  16.916 -11.721
  703    HB2  LYS  92           2HB      LYS  92  -5.393  19.475 -12.486
  704    HB3  LYS  92           3HB      LYS  92  -6.762  19.402 -11.371
  705    HG2  LYS  92           2HG      LYS  92  -4.222  17.817 -10.892
  706    HG3  LYS  92           3HG      LYS  92  -4.361  19.505 -10.399
  707    HD2  LYS  92           2HD      LYS  92  -6.339  17.372  -9.498
  708    HD3  LYS  92           3HD      LYS  92  -4.850  17.740  -8.608
  709    HE2  LYS  92           2HE      LYS  92  -5.556  20.101  -8.372
  710    HE3  LYS  92           3HE      LYS  92  -7.047  19.750  -9.268
  711    HZ1  LYS  92           3HZ      LYS  92  -7.689  18.234  -7.515
  712    HZ2  LYS  92           1HZ      LYS  92  -6.304  18.551  -6.671
  713    HZ3  LYS  92           2HZ      LYS  92  -7.425  19.727  -6.906
  714    HA   PRO  93           HA       PRO  93  -9.251  17.772 -15.574
  715    HB2  PRO  93           2HB      PRO  93 -10.731  15.450 -15.594
  716    HB3  PRO  93           3HB      PRO  93  -9.177  15.610 -16.461
  717    HG2  PRO  93           2HG      PRO  93  -9.768  14.400 -13.720
  718    HG3  PRO  93           3HG      PRO  93  -8.720  13.727 -14.999
  719    HD2  PRO  93           2HD      PRO  93  -7.728  15.167 -12.843
  720    HD3  PRO  93           3HD      PRO  93  -6.952  15.200 -14.453
  721    H    LYS  94           H        LYS  94 -11.549  18.332 -15.400
  722    HA   LYS  94           HA       LYS  94 -12.532  18.804 -12.737
  723    HB2  LYS  94           2HB      LYS  94 -13.111  20.100 -14.878
  724    HB3  LYS  94           3HB      LYS  94 -14.155  18.735 -15.315
  725    HG2  LYS  94           2HG      LYS  94 -15.490  19.063 -13.283
  726    HG3  LYS  94           3HG      LYS  94 -14.381  20.329 -12.727
  727    HD2  LYS  94           2HD      LYS  94 -16.370  21.375 -13.615
  728    HD3  LYS  94           3HD      LYS  94 -15.006  21.717 -14.703
  729    HE2  LYS  94           2HE      LYS  94 -15.761  19.937 -16.235
  730    HE3  LYS  94           3HE      LYS  94 -17.087  19.525 -15.130
  731    HZ1  LYS  94           3HZ      LYS  94 -18.001  21.722 -15.513
  732    HZ2  LYS  94           1HZ      LYS  94 -16.768  22.106 -16.543
  733    HZ3  LYS  94           2HZ      LYS  94 -17.832  20.925 -16.939
  734    H    ALA  95           H        ALA  95 -13.863  17.573 -11.455
  735    HA   ALA  95           HA       ALA  95 -15.584  15.485 -12.658
  736    HB1  ALA  95           1HB      ALA  95 -13.626  14.937 -10.381
  737    HB2  ALA  95           2HB      ALA  95 -14.923  13.848 -10.915
  738    HB3  ALA  95           3HB      ALA  95 -13.569  14.218 -12.003
  739    H    ALA  96           H        ALA  96 -17.465  15.206 -11.439
  740    HA   ALA  96           HA       ALA  96 -17.885  16.695  -8.933
  741    HB1  ALA  96           1HB      ALA  96 -19.419  17.267 -11.503
  742    HB2  ALA  96           2HB      ALA  96 -19.828  17.894  -9.893
  743    HB3  ALA  96           3HB      ALA  96 -18.312  18.393 -10.674
  744    H    GLN  97           H        GLN  97 -20.047  16.181  -8.041
  745    HA   GLN  97           HA       GLN  97 -20.695  13.420  -8.192
  746    HB2  GLN  97           2HB      GLN  97 -22.292  15.786  -7.131
  747    HB3  GLN  97           3HB      GLN  97 -22.723  14.083  -6.890
  748    HG2  GLN  97           2HG      GLN  97 -20.464  13.757  -5.768
  749    HG3  GLN  97           3HG      GLN  97 -20.244  15.513  -5.849
  750   HE21  GLN  97          2HE2      GLN  97 -22.461  12.946  -4.592
  751   HE22  GLN  97          1HE2      GLN  97 -22.997  13.905  -3.210
  752    H    VAL  98           H        VAL  98 -22.454  12.335  -9.022
  753    HA   VAL  98           HA       VAL  98 -24.213  13.563 -11.085
  754    HB   VAL  98           HB       VAL  98 -23.488  11.744 -12.696
  755   HG11  VAL  98          1HG1      VAL  98 -21.369  13.837 -12.065
  756   HG12  VAL  98          2HG1      VAL  98 -21.517  12.942 -13.581
  757   HG13  VAL  98          3HG1      VAL  98 -22.798  14.074 -13.094
  758   HG21  VAL  98          3HG2      VAL  98 -21.045  11.501 -10.917
  759   HG22  VAL  98          1HG2      VAL  98 -22.279  10.259 -11.218
  760   HG23  VAL  98          2HG2      VAL  98 -21.239  10.806 -12.542
  761    H    SER  99           H        SER  99 -25.758  11.849 -11.940
  762    HA   SER  99           HA       SER  99 -26.982  10.282  -9.931
  763    HB2  SER  99           2HB      SER  99 -26.974   9.738 -12.922
  764    HB3  SER  99           3HB      SER  99 -28.219   9.276 -11.742
  765    HG   SER  99           HG       SER  99 -28.785  11.179 -12.932
  766    H    GLU 100           H        GLU 100 -26.659   8.118  -9.253
  767    HA   GLU 100           HA       GLU 100 -24.450   6.544 -10.406
  768    HB2  GLU 100           2HB      GLU 100 -23.424   8.274  -8.952
  769    HB3  GLU 100           3HB      GLU 100 -24.428   7.720  -7.604
  770    HG2  GLU 100           2HG      GLU 100 -22.094   6.910  -7.492
  771    HG3  GLU 100           3HG      GLU 100 -23.260   5.590  -7.538
  772    H    GLU 101           H        GLU 101 -24.359   4.462  -9.551
  773    HA   GLU 101           HA       GLU 101 -26.601   3.487  -7.841
  774    HB2  GLU 101           2HB      GLU 101 -25.771   2.382 -10.550
  775    HB3  GLU 101           3HB      GLU 101 -26.850   1.561  -9.407
  776    HG2  GLU 101           2HG      GLU 101 -28.426   3.494  -9.550
  777    HG3  GLU 101           3HG      GLU 101 -27.393   4.222 -10.788
  778    H    ALA 102           H        ALA 102 -23.222   3.326  -8.820
  779    HA   ALA 102           HA       ALA 102 -22.550   0.850  -7.517
  780    HB1  ALA 102           1HB      ALA 102 -20.920   3.392  -7.945
  781    HB2  ALA 102           2HB      ALA 102 -20.263   1.808  -7.478
  782    HB3  ALA 102           3HB      ALA 102 -21.024   2.023  -9.073
  783    H    SER 103           H        SER 103 -21.630   0.528  -5.460
  784    HA   SER 103           HA       SER 103 -22.311   2.512  -3.342
  785    HB2  SER 103           2HB      SER 103 -22.964  -0.456  -3.366
  786    HB3  SER 103           3HB      SER 103 -23.238   0.659  -2.010
  787    HG   SER 103           HG       SER 103 -25.131   0.370  -3.274
  788    H    THR 104           H        THR 104 -21.200   2.151  -1.333
  789    HA   THR 104           HA       THR 104 -18.461   1.534  -1.478
  790    HB   THR 104           HB       THR 104 -18.849   1.379   1.129
  791    HG1  THR 104           1HG      THR 104 -20.828   2.411   1.691
  792   HG21  THR 104          1HG2      THR 104 -19.553   3.905  -0.436
  793   HG22  THR 104          2HG2      THR 104 -19.030   3.846   1.256
  794   HG23  THR 104          3HG2      THR 104 -17.910   3.362  -0.029
  795    HA   PRO 105           HA       PRO 105 -18.371  -2.814  -1.386
  796    HB2  PRO 105           2HB      PRO 105 -15.930  -3.395  -0.249
  797    HB3  PRO 105           3HB      PRO 105 -16.123  -2.715  -1.890
  798    HG2  PRO 105           2HG      PRO 105 -15.497  -1.240   0.697
  799    HG3  PRO 105           3HG      PRO 105 -14.732  -1.036  -0.906
  800    HD2  PRO 105           2HD      PRO 105 -16.741   0.640  -0.026
  801    HD3  PRO 105           3HD      PRO 105 -16.591   0.183  -1.746
  802    H    GLN 106           H        GLN 106 -17.995  -1.162   1.733
  803    HA   GLN 106           HA       GLN 106 -18.115  -3.437   3.449
  804    HB2  GLN 106           2HB      GLN 106 -19.080  -0.577   3.855
  805    HB3  GLN 106           3HB      GLN 106 -18.985  -1.804   5.123
  806    HG2  GLN 106           2HG      GLN 106 -17.046  -0.535   5.432
  807    HG3  GLN 106           3HG      GLN 106 -16.486  -1.989   4.597
  808   HE21  GLN 106          2HE2      GLN 106 -14.551  -0.536   4.176
  809   HE22  GLN 106          1HE2      GLN 106 -14.630   0.507   2.772
  810    H    GLY 107           H        GLY 107 -19.782  -4.580   4.297
  811    HA2  GLY 107           2HA      GLY 107 -22.541  -3.935   4.248
  812    HA3  GLY 107           3HA      GLY 107 -22.173  -4.927   2.823
  813    H    PHE 108           H        PHE 108 -20.675  -5.041   6.062
  814    HA   PHE 108           HA       PHE 108 -20.529  -7.898   6.011
  815    HB2  PHE 108           2HB      PHE 108 -20.136  -6.091   8.433
  816    HB3  PHE 108           3HB      PHE 108 -19.426  -7.678   8.119
  817    HD1  PHE 108           HD1      PHE 108 -17.945  -7.837   5.914
  818    HD2  PHE 108           HD2      PHE 108 -18.844  -4.181   8.018
  819    HE1  PHE 108           HE1      PHE 108 -15.995  -6.736   4.844
  820    HE2  PHE 108           HE2      PHE 108 -16.890  -3.089   6.955
  821    HZ   PHE 108           HZ       PHE 108 -15.463  -4.360   5.360
  822    H    ASN 109           H        ASN 109 -22.920  -5.735   7.384
  823    HA   ASN 109           HA       ASN 109 -24.730  -7.987   7.859
  824    HB2  ASN 109           2HB      ASN 109 -23.493  -7.695  10.039
  825    HB3  ASN 109           3HB      ASN 109 -24.055  -6.013  10.078
  826   HD21  ASN 109          2HD2      ASN 109 -25.276  -6.290  12.022
  827   HD22  ASN 109          1HD2      ASN 109 -26.736  -7.257  12.046
  828    H    THR 110           H        THR 110 -26.977  -7.151   8.024
  829    HA   THR 110           HA       THR 110 -27.565  -4.721   6.647
  830    HB   THR 110           HB       THR 110 -29.892  -5.199   7.707
  831    HG1  THR 110           1HG      THR 110 -30.060  -7.354   8.501
  832   HG21  THR 110          1HG2      THR 110 -28.512  -7.360   6.047
  833   HG22  THR 110          2HG2      THR 110 -30.268  -7.123   6.192
  834   HG23  THR 110          3HG2      THR 110 -29.269  -5.885   5.409
  835    H    LEU 111           H        LEU 111 -28.663  -2.819   7.490
  836    HA   LEU 111           HA       LEU 111 -28.308  -2.158  10.335
  837    HB2  LEU 111           2HB      LEU 111 -26.182  -1.552   9.300
  838    HB3  LEU 111           3HB      LEU 111 -27.023  -0.627   8.045
  839    HG   LEU 111           HG       LEU 111 -27.879   0.931   9.792
  840   HD11  LEU 111          1HD1      LEU 111 -26.031  -0.600  11.674
  841   HD12  LEU 111          2HD1      LEU 111 -26.879   0.913  12.053
  842   HD13  LEU 111          3HD1      LEU 111 -27.805  -0.567  11.772
  843   HD21  LEU 111          3HD2      LEU 111 -24.855   0.582   9.743
  844   HD22  LEU 111          1HD2      LEU 111 -25.839   1.477   8.559
  845   HD23  LEU 111          2HD2      LEU 111 -25.722   2.062  10.222
  846    H    LYS 112           H        LYS 112 -30.097  -1.032  10.973
  847    HA   LYS 112           HA       LYS 112 -32.209  -0.424   9.102
  848    HB2  LYS 112           2HB      LYS 112 -32.515  -1.144  11.490
  849    HB3  LYS 112           3HB      LYS 112 -31.878   0.433  12.009
  850    HG2  LYS 112           2HG      LYS 112 -33.740   1.589  10.927
  851    HG3  LYS 112           3HG      LYS 112 -34.322   0.067  10.226
  852    HD2  LYS 112           2HD      LYS 112 -35.717   0.642  12.115
  853    HD3  LYS 112           3HD      LYS 112 -34.765  -0.802  12.516
  854    HE2  LYS 112           2HE      LYS 112 -33.176   0.584  13.799
  855    HE3  LYS 112           3HE      LYS 112 -34.075   2.051  13.356
  856    HZ1  LYS 112           3HZ      LYS 112 -35.962   1.178  14.569
  857    HZ2  LYS 112           1HZ      LYS 112 -35.128  -0.183  14.978
  858    HZ3  LYS 112           2HZ      LYS 112 -34.651   1.281  15.557
  859    H    ASP 113           H        ASP 113 -29.852   1.617  10.860
  860    HA   ASP 113           HA       ASP 113 -30.810   4.145   9.990
  861    HB2  ASP 113           2HB      ASP 113 -29.197   3.886  11.812
  862    HB3  ASP 113           3HB      ASP 113 -28.003   3.220  10.689
  863    H    LYS 114           H        LYS 114 -30.336   5.445   8.265
  864    HA   LYS 114           HA       LYS 114 -28.552   4.545   6.101
  865    HB2  LYS 114           2HB      LYS 114 -30.767   3.467   5.676
  866    HB3  LYS 114           3HB      LYS 114 -31.529   5.070   5.695
  867    HG2  LYS 114           2HG      LYS 114 -30.156   5.731   3.734
  868    HG3  LYS 114           3HG      LYS 114 -29.401   4.129   3.716
  869    HD2  LYS 114           2HD      LYS 114 -32.360   4.718   3.325
  870    HD3  LYS 114           3HD      LYS 114 -31.205   4.420   2.017
  871    HE2  LYS 114           2HE      LYS 114 -31.915   2.416   4.204
  872    HE3  LYS 114           3HE      LYS 114 -32.641   2.444   2.584
  873    HZ1  LYS 114           3HZ      LYS 114 -30.454   2.059   1.639
  874    HZ2  LYS 114           1HZ      LYS 114 -29.778   2.030   3.141
  875    HZ3  LYS 114           2HZ      LYS 114 -30.847   0.860   2.709
  876    H    LEU 115           H        LEU 115 -27.864   6.317   4.873
  877    HA   LEU 115           HA       LEU 115 -29.198   8.944   5.142
  878    HB2  LEU 115           2HB      LEU 115 -27.497   8.959   6.882
  879    HB3  LEU 115           3HB      LEU 115 -26.256   8.429   5.734
  880    HG   LEU 115           HG       LEU 115 -26.501  10.556   4.474
  881   HD11  LEU 115          1HD1      LEU 115 -28.389  11.376   6.735
  882   HD12  LEU 115          2HD1      LEU 115 -27.773  12.443   5.449
  883   HD13  LEU 115          3HD1      LEU 115 -28.857  11.109   5.040
  884   HD21  LEU 115          3HD2      LEU 115 -25.991  10.906   7.458
  885   HD22  LEU 115          1HD2      LEU 115 -24.810  10.377   6.236
  886   HD23  LEU 115          2HD2      LEU 115 -25.462  12.023   6.175
  887    H    GLU 116           H        GLU 116 -26.515   7.078   3.714
  888    HA   GLU 116           HA       GLU 116 -27.484   7.587   1.007
  889    HB2  GLU 116           2HB      GLU 116 -25.315   8.340   0.197
  890    HB3  GLU 116           3HB      GLU 116 -25.995   9.482   1.363
  891    HG2  GLU 116           2HG      GLU 116 -24.503   8.536   3.125
  892    HG3  GLU 116           3HG      GLU 116 -23.777   7.464   1.921
  893    H    GLU 117           H        GLU 117 -26.307   6.110  -0.521
  894    HA   GLU 117           HA       GLU 117 -24.977   3.773   0.697
  895    HB2  GLU 117           2HB      GLU 117 -26.628   2.228  -0.224
  896    HB3  GLU 117           3HB      GLU 117 -27.331   3.292   0.998
  897    HG2  GLU 117           2HG      GLU 117 -28.408   4.652  -0.739
  898    HG3  GLU 117           3HG      GLU 117 -27.618   3.701  -2.007
  899    H    TRP 118           H        TRP 118 -24.074   5.873  -1.087
  900    HA   TRP 118           HA       TRP 118 -23.487   4.269  -3.520
  901    HB2  TRP 118           2HB      TRP 118 -24.093   7.254  -3.481
  902    HB3  TRP 118           3HB      TRP 118 -23.713   6.238  -4.876
  903    HD1  TRP 118           HD1      TRP 118 -25.494   4.479  -5.600
  904    HE1  TRP 118           HE1      TRP 118 -28.095   4.422  -5.417
  905    HE3  TRP 118           HE3      TRP 118 -26.099   8.057  -2.003
  906    HZ2  TRP 118           HZ2      TRP 118 -30.102   5.712  -3.805
  907    HZ3  TRP 118           HZ3      TRP 118 -28.311   8.617  -1.137
  908    HH2  TRP 118           HH2      TRP 118 -30.347   7.461  -1.993
  909    H    ILE 119           H        ILE 119 -21.542   5.075  -4.718
  910    HA   ILE 119           HA       ILE 119 -19.659   6.729  -3.135
  911    HB   ILE 119           HB       ILE 119 -19.149   4.357  -2.598
  912   HG12  ILE 119          2HG1      ILE 119 -16.790   4.284  -3.208
  913   HG13  ILE 119          3HG1      ILE 119 -17.038   5.622  -4.345
  914   HG21  ILE 119          1HG2      ILE 119 -18.645   4.007  -5.586
  915   HG22  ILE 119          2HG2      ILE 119 -18.245   2.825  -4.330
  916   HG23  ILE 119          3HG2      ILE 119 -19.935   3.240  -4.656
  917   HD11  ILE 119          3HD1      ILE 119 -17.693   7.094  -2.442
  918   HD12  ILE 119          1HD1      ILE 119 -17.454   5.740  -1.317
  919   HD13  ILE 119          2HD1      ILE 119 -16.078   6.421  -2.210
  920    H    GLU 120           H        GLU 120 -18.624   8.159  -4.251
  921    HA   GLU 120           HA       GLU 120 -18.073   7.978  -7.089
  922    HB2  GLU 120           2HB      GLU 120 -19.331   9.913  -7.759
  923    HB3  GLU 120           3HB      GLU 120 -20.432   8.692  -7.105
  924    HG2  GLU 120           2HG      GLU 120 -20.448   9.920  -4.936
  925    HG3  GLU 120           3HG      GLU 120 -19.496  11.218  -5.670
  926    H    MET 121           H        MET 121 -17.118  10.342  -7.673
  927    HA   MET 121           HA       MET 121 -15.676  11.531  -5.366
  928    HB2  MET 121           2HB      MET 121 -14.363  10.413  -7.875
  929    HB3  MET 121           3HB      MET 121 -13.556  11.458  -6.692
  930    HG2  MET 121           2HG      MET 121 -14.030   9.747  -4.932
  931    HG3  MET 121           3HG      MET 121 -14.672   8.682  -6.190
  932    HE1  MET 121           3HE      MET 121 -13.243   7.380  -7.958
  933    HE2  MET 121           1HE      MET 121 -12.742   8.948  -8.636
  934    HE3  MET 121           2HE      MET 121 -11.525   7.706  -8.278
  935    H    SER 122           H        SER 122 -14.737  13.580  -5.910
  936    HA   SER 122           HA       SER 122 -15.500  14.897  -8.449
  937    HB2  SER 122           2HB      SER 122 -15.931  16.076  -5.675
  938    HB3  SER 122           3HB      SER 122 -16.231  16.887  -7.227
  939    HG   SER 122           HG       SER 122 -18.149  15.992  -6.293
  940    H    ASN 123           H        ASN 123 -14.105  16.819  -8.831
  941    HA   ASN 123           HA       ASN 123 -11.755  17.219  -7.124
  942    HB2  ASN 123           2HB      ASN 123 -10.961  15.313  -8.362
  943    HB3  ASN 123           3HB      ASN 123 -11.461  16.003  -9.919
  944   HD21  ASN 123          2HD2      ASN 123  -9.896  17.147 -11.037
  945   HD22  ASN 123          1HD2      ASN 123  -8.478  17.840 -10.283
  946    H    ARG 124           H        ARG 124 -11.427  19.374  -7.153
  947    HA   ARG 124           HA       ARG 124 -12.384  21.196  -9.136
  948    HB2  ARG 124           2HB      ARG 124 -11.891  22.034  -6.983
  949    HB3  ARG 124           3HB      ARG 124 -10.282  21.300  -6.971
  950    HG2  ARG 124           2HG      ARG 124 -10.116  23.714  -7.174
  951    HG3  ARG 124           3HG      ARG 124  -9.471  22.900  -8.593
  952    HD2  ARG 124           2HD      ARG 124 -12.100  23.421  -9.360
  953    HD3  ARG 124           3HD      ARG 124 -11.709  24.829  -8.355
  954    HE   ARG 124           HE       ARG 124  -9.748  24.005 -10.406
  955   HH11  ARG 124          1HH2      ARG 124 -12.239  26.359  -9.500
  956   HH12  ARG 124          2HH2      ARG 124 -11.833  27.477 -10.752
  957   HH21  ARG 124          1HH1      ARG 124  -9.271  25.441 -12.116
  958   HH22  ARG 124          2HH1      ARG 124 -10.112  26.953 -12.254
  959    H    LYS 125           H        LYS 125 -11.712  21.446 -11.175
  960    HA   LYS 125           HA       LYS 125  -9.497  20.102 -12.297
  961    HB2  LYS 125           2HB      LYS 125  -9.869  21.539 -14.272
  962    HB3  LYS 125           3HB      LYS 125 -11.343  20.776 -13.681
  963    HG2  LYS 125           2HG      LYS 125 -12.266  22.773 -12.922
  964    HG3  LYS 125           3HG      LYS 125 -10.688  23.550 -12.724
  965    HD2  LYS 125           2HD      LYS 125 -10.426  23.752 -15.157
  966    HD3  LYS 125           3HD      LYS 125 -11.982  22.922 -15.413
  967    HE2  LYS 125           2HE      LYS 125 -13.212  24.703 -14.386
  968    HE3  LYS 125           3HE      LYS 125 -11.732  25.447 -13.743
  969    HZ1  LYS 125           3HZ      LYS 125 -11.084  25.934 -16.021
  970    HZ2  LYS 125           1HZ      LYS 125 -12.420  25.250 -16.625
  971    HZ3  LYS 125           2HZ      LYS 125 -12.543  26.611 -15.697
  972    H    ASP 126           H        ASP 126  -7.697  21.119 -13.501
  973    HA   ASP 126           HA       ASP 126  -5.960  22.786 -11.993
  974    HB2  ASP 126           2HB      ASP 126  -5.447  21.237 -13.926
  975    HB3  ASP 126           3HB      ASP 126  -6.097  22.472 -15.007
  976    H    LEU 127           H        LEU 127  -5.149  24.979 -12.893
  977    HA   LEU 127           HA       LEU 127  -7.304  26.891 -12.896
  978    HB2  LEU 127           2HB      LEU 127  -5.745  28.489 -12.721
  979    HB3  LEU 127           3HB      LEU 127  -4.850  27.112 -12.077
  980    HG   LEU 127           HG       LEU 127  -4.526  28.327 -14.873
  981   HD11  LEU 127          1HD1      LEU 127  -2.699  28.335 -12.431
  982   HD12  LEU 127          2HD1      LEU 127  -2.303  29.010 -14.026
  983   HD13  LEU 127          3HD1      LEU 127  -3.609  29.728 -13.061
  984   HD21  LEU 127          3HD2      LEU 127  -2.939  26.075 -13.592
  985   HD22  LEU 127          1HD2      LEU 127  -4.064  25.911 -14.950
  986   HD23  LEU 127          2HD2      LEU 127  -2.594  26.862 -15.147
  987    H    ILE 128           H        ILE 128  -6.576  24.970 -15.387
  988    HA   ILE 128           HA       ILE 128  -6.461  26.584 -17.704
  989    HB   ILE 128           HB       ILE 128  -6.027  24.126 -17.524
  990   HG12  ILE 128          2HG1      ILE 128  -8.052  24.835 -19.643
  991   HG13  ILE 128          3HG1      ILE 128  -6.335  25.294 -19.652
  992   HG21  ILE 128          1HG2      ILE 128  -9.076  23.872 -17.444
  993   HG22  ILE 128          2HG2      ILE 128  -7.943  22.530 -17.640
  994   HG23  ILE 128          3HG2      ILE 128  -7.959  23.433 -16.138
  995   HD11  ILE 128          3HD1      ILE 128  -5.686  22.902 -19.675
  996   HD12  ILE 128          1HD1      ILE 128  -7.398  22.434 -19.688
  997   HD13  ILE 128          2HD1      ILE 128  -6.722  23.306 -21.062
  998    H    LYS 129           H        LYS 129  -7.788  27.572 -19.045
  999    HA   LYS 129           HA       LYS 129 -10.266  28.538 -17.938
 1000    HB2  LYS 129           2HB      LYS 129 -10.412  29.895 -19.911
 1001    HB3  LYS 129           3HB      LYS 129  -8.750  29.918 -19.299
 1002    HG2  LYS 129           2HG      LYS 129  -8.088  28.277 -21.057
 1003    HG3  LYS 129           3HG      LYS 129  -9.754  28.275 -21.672
 1004    HD2  LYS 129           2HD      LYS 129  -9.578  30.700 -22.160
 1005    HD3  LYS 129           3HD      LYS 129  -7.904  30.701 -21.550
 1006    HE2  LYS 129           2HE      LYS 129  -7.271  29.053 -23.289
 1007    HE3  LYS 129           3HE      LYS 129  -8.945  29.050 -23.896
 1008    HZ1  LYS 129           3HZ      LYS 129  -8.676  31.379 -24.440
 1009    HZ2  LYS 129           1HZ      LYS 129  -7.129  31.382 -23.877
 1010    HZ3  LYS 129           2HZ      LYS 129  -7.523  30.490 -25.199
 1011    H    LYS 130           H        LYS 130  -9.664  25.762 -19.886
 1012    HA   LYS 130           HA       LYS 130 -12.104  25.575 -21.306
 1013    HB2  LYS 130           2HB      LYS 130 -10.282  23.435 -20.132
 1014    HB3  LYS 130           3HB      LYS 130 -11.705  23.071 -21.125
 1015    HG2  LYS 130           2HG      LYS 130 -10.729  24.467 -22.977
 1016    HG3  LYS 130           3HG      LYS 130  -9.261  24.678 -21.994
 1017    HD2  LYS 130           2HD      LYS 130  -8.808  22.296 -22.031
 1018    HD3  LYS 130           3HD      LYS 130 -10.376  21.963 -22.782
 1019    HE2  LYS 130           2HE      LYS 130  -8.734  21.774 -24.502
 1020    HE3  LYS 130           3HE      LYS 130  -9.658  23.260 -24.796
 1021    HZ1  LYS 130           3HZ      LYS 130  -7.833  24.498 -23.832
 1022    HZ2  LYS 130           1HZ      LYS 130  -6.972  23.117 -23.567
 1023    HZ3  LYS 130           2HZ      LYS 130  -7.295  23.592 -25.106
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1   0.068 -21.528   3.722
    2    H2   MET   1           H2       MET   1  -1.473 -21.624   4.343
    3    H3   MET   1           H3       MET   1  -0.769 -20.162   4.106
    4    HA   MET   1           HA       MET   1  -2.332 -21.603   2.354
    5    HB2  MET   1           2HB      MET   1  -0.744 -19.012   2.132
    6    HB3  MET   1           3HB      MET   1  -1.795 -19.598   0.842
    7    HG2  MET   1           2HG      MET   1  -3.066 -18.046   2.027
    8    HG3  MET   1           3HG      MET   1  -3.719 -19.631   2.379
    9    HE1  MET   1           3HE      MET   1  -0.711 -17.468   3.930
   10    HE2  MET   1           1HE      MET   1  -2.096 -16.368   3.741
   11    HE3  MET   1           2HE      MET   1  -1.527 -16.828   5.360
   12    H    ALA   2           H        ALA   2  -1.021 -20.940  -0.250
   13    HA   ALA   2           HA       ALA   2   1.396 -22.573  -0.312
   14    HB1  ALA   2           1HB      ALA   2  -1.181 -23.303  -1.790
   15    HB2  ALA   2           2HB      ALA   2   0.411 -24.043  -2.051
   16    HB3  ALA   2           3HB      ALA   2  -0.397 -24.254  -0.495
   17    H    ALA   3           H        ALA   3   2.332 -22.483  -2.504
   18    HA   ALA   3           HA       ALA   3   1.357 -20.322  -4.291
   19    HB1  ALA   3           1HB      ALA   3   4.194 -20.644  -3.224
   20    HB2  ALA   3           2HB      ALA   3   3.700 -19.496  -4.481
   21    HB3  ALA   3           3HB      ALA   3   3.075 -19.317  -2.832
   22    H    LYS   4           H        LYS   4   2.796 -20.416  -6.338
   23    HA   LYS   4           HA       LYS   4   3.126 -23.254  -7.202
   24    HB2  LYS   4           2HB      LYS   4   1.677 -21.040  -8.730
   25    HB3  LYS   4           3HB      LYS   4   1.910 -22.705  -9.269
   26    HG2  LYS   4           2HG      LYS   4   0.542 -23.511  -7.329
   27    HG3  LYS   4           3HG      LYS   4   0.274 -21.834  -6.846
   28    HD2  LYS   4           2HD      LYS   4  -1.677 -22.465  -7.993
   29    HD3  LYS   4           3HD      LYS   4  -0.799 -21.413  -9.108
   30    HE2  LYS   4           2HE      LYS   4   0.056 -23.385 -10.321
   31    HE3  LYS   4           3HE      LYS   4  -0.779 -24.459  -9.173
   32    HZ1  LYS   4           3HZ      LYS   4  -2.899 -23.475  -9.924
   33    HZ2  LYS   4           1HZ      LYS   4  -2.138 -22.510 -10.968
   34    HZ3  LYS   4           2HZ      LYS   4  -2.078 -24.130 -11.194
   35    H    PHE   5           H        PHE   5   5.110 -21.036  -6.508
   36    HA   PHE   5           HA       PHE   5   6.663 -20.957  -9.004
   37    HB2  PHE   5           2HB      PHE   5   5.778 -18.542  -7.350
   38    HB3  PHE   5           3HB      PHE   5   7.061 -18.486  -8.529
   39    HD1  PHE   5           HD1      PHE   5   3.437 -18.814  -8.045
   40    HD2  PHE   5           HD2      PHE   5   6.574 -18.445 -10.952
   41    HE1  PHE   5           HE1      PHE   5   1.739 -18.599  -9.864
   42    HE2  PHE   5           HE2      PHE   5   4.876 -18.212 -12.741
   43    HZ   PHE   5           HZ       PHE   5   2.474 -18.357 -12.217
   44    H    GLU   6           H        GLU   6   8.935 -20.191  -8.470
   45    HA   GLU   6           HA       GLU   6   9.782 -20.607  -5.669
   46    HB2  GLU   6           2HB      GLU   6  10.781 -22.118  -8.118
   47    HB3  GLU   6           3HB      GLU   6  11.666 -22.037  -6.603
   48    HG2  GLU   6           2HG      GLU   6   8.870 -23.201  -6.969
   49    HG3  GLU   6           3HG      GLU   6  10.345 -24.125  -6.862
   50    H    VAL   7           H        VAL   7  11.757 -19.552  -5.254
   51    HA   VAL   7           HA       VAL   7  12.127 -17.096  -6.516
   52    HB   VAL   7           HB       VAL   7  14.100 -16.832  -5.114
   53   HG11  VAL   7          1HG1      VAL   7  11.846 -18.300  -3.684
   54   HG12  VAL   7          2HG1      VAL   7  13.017 -17.233  -2.921
   55   HG13  VAL   7          3HG1      VAL   7  11.880 -16.590  -4.137
   56   HG21  VAL   7          3HG2      VAL   7  13.818 -19.787  -4.386
   57   HG22  VAL   7          1HG2      VAL   7  15.162 -19.051  -5.287
   58   HG23  VAL   7          2HG2      VAL   7  14.893 -18.602  -3.602
   59    H    GLY   8           H        GLY   8  13.446 -16.210  -7.953
   60    HA2  GLY   8           2HA      GLY   8  15.269 -16.025  -9.352
   61    HA3  GLY   8           3HA      GLY   8  15.629 -17.754  -9.181
   62    H    SER   9           H        SER   9  12.607 -18.323  -9.779
   63    HA   SER   9           HA       SER   9  12.861 -18.791 -12.550
   64    HB2  SER   9           2HB      SER   9  10.252 -18.585 -11.001
   65    HB3  SER   9           3HB      SER   9  10.624 -19.579 -12.433
   66    HG   SER   9           HG       SER   9  10.678 -20.752 -10.391
   67    H    VAL  10           H        VAL  10  11.243 -17.953 -14.248
   68    HA   VAL  10           HA       VAL  10  10.533 -15.115 -13.893
   69    HB   VAL  10           HB       VAL  10  12.164 -16.192 -16.236
   70   HG11  VAL  10          1HG1      VAL  10  11.236 -13.358 -15.552
   71   HG12  VAL  10          2HG1      VAL  10  12.268 -13.810 -16.928
   72   HG13  VAL  10          3HG1      VAL  10  10.602 -14.370 -16.862
   73   HG21  VAL  10          3HG2      VAL  10  13.042 -14.267 -14.048
   74   HG22  VAL  10          1HG2      VAL  10  13.643 -15.934 -14.272
   75   HG23  VAL  10          2HG2      VAL  10  13.976 -14.710 -15.491
   76    H    TYR  11           H        TYR  11   8.556 -14.771 -14.678
   77    HA   TYR  11           HA       TYR  11   7.431 -16.502 -16.800
   78    HB2  TYR  11           2HB      TYR  11   6.224 -16.045 -14.038
   79    HB3  TYR  11           3HB      TYR  11   5.313 -16.657 -15.399
   80    HD1  TYR  11           HD2      TYR  11   5.748 -18.882 -16.383
   81    HD2  TYR  11           HD1      TYR  11   7.824 -17.505 -12.873
   82    HE1  TYR  11           HE2      TYR  11   6.400 -21.215 -15.866
   83    HE2  TYR  11           HE1      TYR  11   8.423 -19.844 -12.310
   84    HH   TYR  11           HH       TYR  11   8.291 -22.065 -12.951
   85    H    THR  12           H        THR  12   4.999 -15.484 -17.096
   86    HA   THR  12           HA       THR  12   5.267 -12.527 -17.163
   87    HB   THR  12           HB       THR  12   3.814 -14.246 -19.196
   88    HG1  THR  12           1HG      THR  12   5.654 -13.839 -20.501
   89   HG21  THR  12          1HG2      THR  12   4.846 -11.373 -19.335
   90   HG22  THR  12          2HG2      THR  12   3.998 -12.238 -20.629
   91   HG23  THR  12          3HG2      THR  12   3.150 -11.853 -19.131
   92    H    GLY  13           H        GLY  13   3.360 -11.373 -16.680
   93    HA2  GLY  13           2HA      GLY  13   0.956 -12.794 -15.769
   94    HA3  GLY  13           3HA      GLY  13   1.920 -11.975 -14.527
   95    H    LYS  14           H        LYS  14  -0.364 -10.830 -14.531
   96    HA   LYS  14           HA       LYS  14  -0.154  -8.446 -16.321
   97    HB2  LYS  14           2HB      LYS  14  -2.573 -10.176 -15.755
   98    HB3  LYS  14           3HB      LYS  14  -2.760  -8.444 -16.110
   99    HG2  LYS  14           2HG      LYS  14  -1.528  -8.704 -18.229
  100    HG3  LYS  14           3HG      LYS  14  -1.262 -10.417 -17.891
  101    HD2  LYS  14           2HD      LYS  14  -3.030 -10.197 -19.494
  102    HD3  LYS  14           3HD      LYS  14  -3.709 -10.811 -17.975
  103    HE2  LYS  14           2HE      LYS  14  -4.512  -8.529 -17.405
  104    HE3  LYS  14           3HE      LYS  14  -3.783  -7.888 -18.891
  105    HZ1  LYS  14           3HZ      LYS  14  -5.285  -9.284 -20.148
  106    HZ2  LYS  14           1HZ      LYS  14  -5.962  -9.889 -18.762
  107    HZ3  LYS  14           2HZ      LYS  14  -6.143  -8.302 -19.152
  108    H    VAL  15           H        VAL  15  -0.412  -6.519 -15.413
  109    HA   VAL  15           HA       VAL  15   0.007  -6.397 -12.591
  110    HB   VAL  15           HB       VAL  15  -0.621  -4.108 -14.462
  111   HG11  VAL  15          1HG1      VAL  15   1.124  -4.314 -11.952
  112   HG12  VAL  15          2HG1      VAL  15   0.893  -2.845 -12.929
  113   HG13  VAL  15          3HG1      VAL  15  -0.471  -3.536 -12.045
  114   HG21  VAL  15          3HG2      VAL  15   2.096  -5.428 -14.053
  115   HG22  VAL  15          1HG2      VAL  15   1.164  -5.399 -15.556
  116   HG23  VAL  15          2HG2      VAL  15   1.797  -3.910 -14.932
  117    H    THR  16           H        THR  16  -1.483  -6.245 -11.015
  118    HA   THR  16           HA       THR  16  -4.310  -5.798 -11.756
  119    HB   THR  16           HB       THR  16  -4.539  -7.108  -9.478
  120    HG1  THR  16           1HG      THR  16  -2.857  -8.591  -9.217
  121   HG21  THR  16          1HG2      THR  16  -3.600  -8.454 -12.048
  122   HG22  THR  16          2HG2      THR  16  -4.535  -9.204 -10.732
  123   HG23  THR  16          3HG2      THR  16  -5.263  -7.934 -11.690
  124    H    GLY  17           H        GLY  17  -1.738  -4.265  -9.973
  125    HA2  GLY  17           2HA      GLY  17  -3.414  -2.001  -9.675
  126    HA3  GLY  17           3HA      GLY  17  -3.293  -2.802  -8.106
  127    H    LEU  18           H        LEU  18  -2.300  -0.225  -8.464
  128    HA   LEU  18           HA       LEU  18   0.602  -0.701  -7.961
  129    HB2  LEU  18           2HB      LEU  18  -0.766   1.829  -8.976
  130    HB3  LEU  18           3HB      LEU  18   0.917   1.716  -8.485
  131    HG   LEU  18           HG       LEU  18  -0.347   0.328 -10.856
  132   HD11  LEU  18          1HD1      LEU  18   1.682   2.578 -10.717
  133   HD12  LEU  18          2HD1      LEU  18   1.105   1.808 -12.199
  134   HD13  LEU  18          3HD1      LEU  18  -0.016   2.738 -11.194
  135   HD21  LEU  18          3HD2      LEU  18   2.548   0.249  -9.997
  136   HD22  LEU  18          1HD2      LEU  18   1.389  -1.106  -9.989
  137   HD23  LEU  18          2HD2      LEU  18   1.883  -0.394 -11.517
  138    H    GLN  19           H        GLN  19   1.423   0.331  -6.170
  139    HA   GLN  19           HA       GLN  19  -0.374   1.668  -4.230
  140    HB2  GLN  19           2HB      GLN  19   1.515  -0.676  -3.684
  141    HB3  GLN  19           3HB      GLN  19   0.682   0.254  -2.451
  142    HG2  GLN  19           2HG      GLN  19  -0.838  -1.340  -4.559
  143    HG3  GLN  19           3HG      GLN  19  -0.250  -2.044  -3.076
  144   HE21  GLN  19          2HE2      GLN  19  -1.660  -2.021  -1.337
  145   HE22  GLN  19          1HE2      GLN  19  -3.013  -0.917  -1.211
  146    H    ALA  20           H        ALA  20   1.020   2.877  -2.661
  147    HA   ALA  20           HA       ALA  20   3.242   4.177  -3.836
  148    HB1  ALA  20           1HB      ALA  20   2.479   3.986  -0.890
  149    HB2  ALA  20           2HB      ALA  20   3.532   5.207  -1.626
  150    HB3  ALA  20           3HB      ALA  20   1.814   5.155  -2.065
  151    H    TYR  21           H        TYR  21   3.224   1.049  -2.532
  152    HA   TYR  21           HA       TYR  21   6.166   1.078  -2.073
  153    HB2  TYR  21           2HB      TYR  21   5.727  -0.838  -0.551
  154    HB3  TYR  21           3HB      TYR  21   5.053   0.681  -0.025
  155    HD1  TYR  21           HD1      TYR  21   4.048  -2.474  -1.861
  156    HD2  TYR  21           HD2      TYR  21   2.806   0.778   0.686
  157    HE1  TYR  21           HE1      TYR  21   1.845  -3.534  -1.598
  158    HE2  TYR  21           HE2      TYR  21   0.611  -0.323   1.011
  159    HH   TYR  21           HH       TYR  21  -0.165  -3.485  -0.495
  160    H    GLY  22           H        GLY  22   3.936   0.077  -4.453
  161    HA2  GLY  22           2HA      GLY  22   5.740  -1.429  -5.878
  162    HA3  GLY  22           3HA      GLY  22   5.018  -2.595  -4.774
  163    H    ALA  23           H        ALA  23   4.609  -3.388  -7.103
  164    HA   ALA  23           HA       ALA  23   1.926  -2.513  -8.065
  165    HB1  ALA  23           1HB      ALA  23   4.320  -3.509  -9.679
  166    HB2  ALA  23           2HB      ALA  23   2.700  -3.212 -10.312
  167    HB3  ALA  23           3HB      ALA  23   3.679  -1.864  -9.687
  168    H    PHE  24           H        PHE  24   0.461  -4.124  -7.822
  169    HA   PHE  24           HA       PHE  24   1.308  -6.856  -7.201
  170    HB2  PHE  24           2HB      PHE  24  -1.404  -5.551  -7.677
  171    HB3  PHE  24           3HB      PHE  24  -1.187  -7.261  -7.373
  172    HD1  PHE  24           HD2      PHE  24   0.306  -7.851  -5.220
  173    HD2  PHE  24           HD1      PHE  24  -1.900  -4.196  -5.806
  174    HE1  PHE  24           HE2      PHE  24   0.242  -7.491  -2.768
  175    HE2  PHE  24           HE1      PHE  24  -1.986  -3.850  -3.368
  176    HZ   PHE  24           HZ       PHE  24  -0.905  -5.488  -1.830
  177    H    VAL  25           H        VAL  25   1.414  -8.524  -8.636
  178    HA   VAL  25           HA       VAL  25   0.321  -8.155 -11.367
  179    HB   VAL  25           HB       VAL  25   3.071  -9.313 -10.748
  180   HG11  VAL  25          1HG1      VAL  25   1.657  -8.711 -13.379
  181   HG12  VAL  25          2HG1      VAL  25   3.307  -9.330 -13.215
  182   HG13  VAL  25          3HG1      VAL  25   1.946 -10.325 -12.702
  183   HG21  VAL  25          3HG2      VAL  25   2.366  -6.656 -12.069
  184   HG22  VAL  25          1HG2      VAL  25   3.132  -6.852 -10.481
  185   HG23  VAL  25          2HG2      VAL  25   3.994  -7.356 -11.925
  186    H    ALA  26           H        ALA  26  -1.224  -9.612 -11.471
  187    HA   ALA  26           HA       ALA  26  -1.246 -12.098  -9.992
  188    HB1  ALA  26           1HB      ALA  26  -2.924 -11.124 -12.332
  189    HB2  ALA  26           2HB      ALA  26  -3.236 -12.585 -11.356
  190    HB3  ALA  26           3HB      ALA  26  -3.313 -11.000 -10.592
  191    H    LEU  27           H        LEU  27  -0.857 -14.151 -10.789
  192    HA   LEU  27           HA       LEU  27   1.085 -14.238 -13.076
  193    HB2  LEU  27           2HB      LEU  27   1.036 -15.707 -10.402
  194    HB3  LEU  27           3HB      LEU  27   2.171 -16.022 -11.705
  195    HG   LEU  27           HG       LEU  27   1.986 -13.342 -10.292
  196   HD11  LEU  27          1HD1      LEU  27   3.876 -15.666  -9.774
  197   HD12  LEU  27          2HD1      LEU  27   3.976 -14.052  -9.038
  198   HD13  LEU  27          3HD1      LEU  27   2.597 -15.090  -8.684
  199   HD21  LEU  27          3HD2      LEU  27   4.164 -14.548 -12.063
  200   HD22  LEU  27          1HD2      LEU  27   3.043 -13.242 -12.533
  201   HD23  LEU  27          2HD2      LEU  27   4.210 -12.980 -11.225
  202    H    ASP  28           H        ASP  28  -1.621 -15.766 -11.347
  203    HA   ASP  28           HA       ASP  28  -2.255 -17.452 -13.623
  204    HB2  ASP  28           2HB      ASP  28  -0.615 -18.814 -12.238
  205    HB3  ASP  28           3HB      ASP  28  -1.717 -18.670 -10.873
  206    H    GLU  29           H        GLU  29  -4.381 -18.575 -13.021
  207    HA   GLU  29           HA       GLU  29  -6.332 -16.688 -12.236
  208    HB2  GLU  29           2HB      GLU  29  -6.376 -19.711 -12.538
  209    HB3  GLU  29           3HB      GLU  29  -7.836 -18.758 -12.282
  210    HG2  GLU  29           2HG      GLU  29  -5.908 -18.414 -14.630
  211    HG3  GLU  29           3HG      GLU  29  -7.405 -19.315 -14.676
  212    H    GLU  30           H        GLU  30  -4.342 -18.576 -10.191
  213    HA   GLU  30           HA       GLU  30  -6.000 -17.878  -7.843
  214    HB2  GLU  30           2HB      GLU  30  -5.721 -20.067  -6.886
  215    HB3  GLU  30           3HB      GLU  30  -6.441 -20.217  -8.488
  216    HG2  GLU  30           2HG      GLU  30  -4.182 -20.778  -9.428
  217    HG3  GLU  30           3HG      GLU  30  -3.518 -20.741  -7.809
  218    H    THR  31           H        THR  31  -3.295 -16.886  -9.171
  219    HA   THR  31           HA       THR  31  -1.879 -16.738  -6.580
  220    HB   THR  31           HB       THR  31  -0.479 -17.790  -9.077
  221    HG1  THR  31           1HG      THR  31  -0.480 -19.794  -7.960
  222   HG21  THR  31          1HG2      THR  31   0.384 -17.714  -6.144
  223   HG22  THR  31          2HG2      THR  31   1.299 -18.428  -7.481
  224   HG23  THR  31          3HG2      THR  31   1.029 -16.685  -7.446
  225    H    GLN  32           H        GLN  32  -0.564 -14.945  -6.365
  226    HA   GLN  32           HA       GLN  32  -0.080 -13.083  -8.572
  227    HB2  GLN  32           2HB      GLN  32  -2.318 -12.459  -7.854
  228    HB3  GLN  32           3HB      GLN  32  -1.882 -12.582  -6.149
  229    HG2  GLN  32           2HG      GLN  32  -0.579 -10.592  -6.200
  230    HG3  GLN  32           3HG      GLN  32  -0.612 -10.505  -7.950
  231   HE21  GLN  32          2HE2      GLN  32  -1.914  -9.062  -5.270
  232   HE22  GLN  32          1HE2      GLN  32  -3.401  -8.505  -5.980
  233    H    GLY  33           H        GLY  33   1.515 -11.477  -7.956
  234    HA2  GLY  33           2HA      GLY  33   2.718 -11.765  -5.253
  235    HA3  GLY  33           3HA      GLY  33   3.765 -11.918  -6.672
  236    H    LEU  34           H        LEU  34   4.580  -9.999  -5.200
  237    HA   LEU  34           HA       LEU  34   3.339  -7.431  -6.086
  238    HB2  LEU  34           2HB      LEU  34   2.691  -7.893  -3.808
  239    HB3  LEU  34           3HB      LEU  34   4.354  -8.287  -3.357
  240    HG   LEU  34           HG       LEU  34   5.045  -5.940  -3.704
  241   HD11  LEU  34          1HD1      LEU  34   2.103  -5.385  -4.318
  242   HD12  LEU  34          2HD1      LEU  34   3.379  -4.172  -4.099
  243   HD13  LEU  34          3HD1      LEU  34   3.453  -5.263  -5.465
  244   HD21  LEU  34          3HD2      LEU  34   2.570  -6.247  -1.948
  245   HD22  LEU  34          1HD2      LEU  34   4.243  -6.634  -1.491
  246   HD23  LEU  34          2HD2      LEU  34   3.800  -4.966  -1.810
  247    H    VAL  35           H        VAL  35   4.750  -6.699  -7.565
  248    HA   VAL  35           HA       VAL  35   7.624  -6.845  -7.327
  249    HB   VAL  35           HB       VAL  35   5.902  -4.811  -8.807
  250   HG11  VAL  35          1HG1      VAL  35   8.796  -5.698  -9.186
  251   HG12  VAL  35          2HG1      VAL  35   7.928  -4.511 -10.182
  252   HG13  VAL  35          3HG1      VAL  35   8.271  -4.148  -8.514
  253   HG21  VAL  35          3HG2      VAL  35   7.017  -7.433  -9.896
  254   HG22  VAL  35          1HG2      VAL  35   5.289  -7.062  -9.591
  255   HG23  VAL  35          2HG2      VAL  35   6.158  -6.172 -10.806
  256    H    HIS  36           H        HIS  36   8.692  -5.814  -5.643
  257    HA   HIS  36           HA       HIS  36   7.352  -3.680  -4.133
  258    HB2  HIS  36           2HB      HIS  36  10.158  -4.864  -4.041
  259    HB3  HIS  36           3HB      HIS  36   9.592  -3.573  -2.975
  260    HD1  HIS  36           HD1      HIS  36   7.527  -6.803  -3.854
  261    HD2  HIS  36           HD2      HIS  36   9.465  -4.836  -0.658
  262    HE1  HIS  36           HE1      HIS  36   6.959  -8.085  -1.755
  263    H    ILE  37           H        ILE  37   7.915  -1.440  -4.229
  264    HA   ILE  37           HA       ILE  37   8.163  -0.425  -6.760
  265    HB   ILE  37           HB       ILE  37   7.156   0.747  -4.920
  266   HG12  ILE  37          2HG1      ILE  37   9.371   2.421  -6.146
  267   HG13  ILE  37          3HG1      ILE  37   7.909   1.892  -6.998
  268   HG21  ILE  37          1HG2      ILE  37   9.980   1.280  -3.888
  269   HG22  ILE  37          2HG2      ILE  37   8.511   2.008  -3.253
  270   HG23  ILE  37          3HG2      ILE  37   8.740   0.283  -3.090
  271   HD11  ILE  37          3HD1      ILE  37   6.491   3.120  -5.387
  272   HD12  ILE  37          1HD1      ILE  37   7.941   3.688  -4.533
  273   HD13  ILE  37          2HD1      ILE  37   7.656   4.189  -6.194
  274    H    SER  38           H        SER  38  10.899  -0.952  -4.533
  275    HA   SER  38           HA       SER  38  12.871   0.363  -6.037
  276    HB2  SER  38           2HB      SER  38  13.252  -2.070  -4.265
  277    HB3  SER  38           3HB      SER  38  14.386  -0.735  -4.550
  278    HG   SER  38           HG       SER  38  13.276  -0.544  -2.539
  279    H    GLU  39           H        GLU  39  11.169  -2.422  -6.954
  280    HA   GLU  39           HA       GLU  39  13.391  -3.512  -8.598
  281    HB2  GLU  39           2HB      GLU  39  10.916  -4.801  -7.381
  282    HB3  GLU  39           3HB      GLU  39  11.968  -5.591  -8.521
  283    HG2  GLU  39           2HG      GLU  39  12.914  -4.516  -5.846
  284    HG3  GLU  39           3HG      GLU  39  12.390  -6.159  -6.113
  285    H    VAL  40           H        VAL  40  10.815  -1.449  -8.933
  286    HA   VAL  40           HA       VAL  40   9.518  -2.635 -11.212
  287    HB   VAL  40           HB       VAL  40   9.469   0.186 -10.134
  288   HG11  VAL  40          1HG1      VAL  40   7.602  -1.175 -12.123
  289   HG12  VAL  40          2HG1      VAL  40   7.371   0.445 -11.412
  290   HG13  VAL  40          3HG1      VAL  40   8.727   0.126 -12.500
  291   HG21  VAL  40          3HG2      VAL  40   7.521  -2.154  -9.816
  292   HG22  VAL  40          1HG2      VAL  40   8.591  -1.529  -8.559
  293   HG23  VAL  40          2HG2      VAL  40   7.297  -0.514  -9.181
  294    H    THR  41           H        THR  41  12.234  -0.290 -10.891
  295    HA   THR  41           HA       THR  41  13.152  -0.962 -13.571
  296    HB   THR  41           HB       THR  41  12.045   1.788 -12.855
  297    HG1  THR  41           1HG      THR  41  10.948   1.441 -14.827
  298   HG21  THR  41          1HG2      THR  41  13.717   1.097 -15.318
  299   HG22  THR  41          2HG2      THR  41  12.868   2.623 -15.015
  300   HG23  THR  41          3HG2      THR  41  14.209   2.183 -13.987
  301    H    HIS  42           H        HIS  42  15.446  -0.211 -13.787
  302    HA   HIS  42           HA       HIS  42  16.854  -0.169 -11.274
  303    HB2  HIS  42           2HB      HIS  42  17.713   0.161 -14.178
  304    HB3  HIS  42           3HB      HIS  42  18.835   0.372 -12.845
  305    HD1  HIS  42           HD1      HIS  42  19.382  -1.781 -11.307
  306    HD2  HIS  42           HD2      HIS  42  17.205  -2.437 -14.853
  307    HE1  HIS  42           HE1      HIS  42  19.442  -4.302 -11.768
  308    H    GLY  43           H        GLY  43  16.077   2.400 -13.652
  309    HA2  GLY  43           2HA      GLY  43  17.388   4.543 -12.284
  310    HA3  GLY  43           3HA      GLY  43  16.031   4.688 -13.418
  311    H    PHE  44           H        PHE  44  16.381   6.190 -10.936
  312    HA   PHE  44           HA       PHE  44  15.003   5.106  -8.757
  313    HB2  PHE  44           2HB      PHE  44  16.445   7.055  -8.547
  314    HB3  PHE  44           3HB      PHE  44  15.395   7.998  -9.596
  315    HD1  PHE  44           HD1      PHE  44  15.054   5.890  -6.468
  316    HD2  PHE  44           HD2      PHE  44  14.044   9.553  -8.498
  317    HE1  PHE  44           HE1      PHE  44  13.725   6.617  -4.507
  318    HE2  PHE  44           HE2      PHE  44  12.730  10.283  -6.522
  319    HZ   PHE  44           HZ       PHE  44  12.559   8.808  -4.535
  320    H    VAL  45           H        VAL  45  12.957   4.582  -8.492
  321    HA   VAL  45           HA       VAL  45  10.939   5.268 -10.437
  322    HB   VAL  45           HB       VAL  45  10.792   3.530  -7.936
  323   HG11  VAL  45          1HG1      VAL  45   9.009   3.614 -10.413
  324   HG12  VAL  45          2HG1      VAL  45   8.872   2.463  -9.071
  325   HG13  VAL  45          3HG1      VAL  45   8.542   4.181  -8.797
  326   HG21  VAL  45          3HG2      VAL  45  11.328   2.767 -10.847
  327   HG22  VAL  45          1HG2      VAL  45  12.500   2.674  -9.522
  328   HG23  VAL  45          2HG2      VAL  45  11.102   1.637  -9.493
  329    H    LYS  46           H        LYS  46  11.293   7.596  -9.865
  330    HA   LYS  46           HA       LYS  46  10.481   8.704  -7.416
  331    HB2  LYS  46           2HB      LYS  46  10.314  10.832  -8.541
  332    HB3  LYS  46           3HB      LYS  46  11.722   9.942  -9.102
  333    HG2  LYS  46           2HG      LYS  46  10.447   9.305 -11.188
  334    HG3  LYS  46           3HG      LYS  46   9.105  10.328 -10.621
  335    HD2  LYS  46           2HD      LYS  46  10.631  12.296 -10.575
  336    HD3  LYS  46           3HD      LYS  46  11.968  11.268 -11.097
  337    HE2  LYS  46           2HE      LYS  46  11.248  12.417 -13.036
  338    HE3  LYS  46           3HE      LYS  46  10.689  10.750 -13.215
  339    HZ1  LYS  46           3HZ      LYS  46   8.461  11.467 -12.561
  340    HZ2  LYS  46           1HZ      LYS  46   8.989  13.023 -12.345
  341    HZ3  LYS  46           2HZ      LYS  46   8.958  12.292 -13.818
  342    H    ASP  47           H        ASP  47   8.375   7.652 -10.053
  343    HA   ASP  47           HA       ASP  47   6.213   7.573  -8.094
  344    HB2  ASP  47           2HB      ASP  47   5.854   9.754  -9.246
  345    HB3  ASP  47           3HB      ASP  47   5.832   8.915 -10.798
  346    H    ILE  48           H        ILE  48   5.284   5.574  -8.355
  347    HA   ILE  48           HA       ILE  48   6.497   3.735 -10.143
  348    HB   ILE  48           HB       ILE  48   5.764   3.223  -7.872
  349   HG12  ILE  48          2HG1      ILE  48   4.431   1.469  -9.957
  350   HG13  ILE  48          3HG1      ILE  48   6.153   1.477  -9.547
  351   HG21  ILE  48          1HG2      ILE  48   2.911   3.411  -8.926
  352   HG22  ILE  48          2HG2      ILE  48   3.369   2.814  -7.332
  353   HG23  ILE  48          3HG2      ILE  48   3.661   4.479  -7.730
  354   HD11  ILE  48          3HD1      ILE  48   5.626   0.794  -7.221
  355   HD12  ILE  48          1HD1      ILE  48   3.897   0.745  -7.630
  356   HD13  ILE  48          2HD1      ILE  48   5.004  -0.367  -8.413
  357    H    ASN  49           H        ASN  49   3.471   5.592 -10.510
  358    HA   ASN  49           HA       ASN  49   2.517   3.902 -12.665
  359    HB2  ASN  49           2HB      ASN  49   0.650   5.071 -12.435
  360    HB3  ASN  49           3HB      ASN  49   1.393   5.918 -11.089
  361   HD21  ASN  49          2HD2      ASN  49   2.674   7.949 -11.658
  362   HD22  ASN  49          1HD2      ASN  49   2.040   8.914 -12.987
  363    H    GLU  50           H        GLU  50   4.985   6.338 -12.542
  364    HA   GLU  50           HA       GLU  50   4.952   6.713 -15.451
  365    HB2  GLU  50           2HB      GLU  50   7.011   7.460 -13.324
  366    HB3  GLU  50           3HB      GLU  50   7.099   7.906 -15.029
  367    HG2  GLU  50           2HG      GLU  50   4.846   9.052 -14.754
  368    HG3  GLU  50           3HG      GLU  50   4.986   8.781 -13.023
  369    H    HIS  51           H        HIS  51   5.750   4.084 -13.533
  370    HA   HIS  51           HA       HIS  51   7.921   3.191 -15.369
  371    HB2  HIS  51           2HB      HIS  51   7.841   2.902 -12.363
  372    HB3  HIS  51           3HB      HIS  51   9.030   2.151 -13.424
  373    HD1  HIS  51           HD1      HIS  51   8.064   5.627 -12.099
  374    HD2  HIS  51           HD2      HIS  51  10.990   3.695 -14.414
  375    HE1  HIS  51           HE1      HIS  51   9.925   7.323 -12.502
  376    H    LEU  52           H        LEU  52   4.847   2.362 -14.029
  377    HA   LEU  52           HA       LEU  52   4.851   0.062 -15.730
  378    HB2  LEU  52           2HB      LEU  52   5.598  -0.575 -13.176
  379    HB3  LEU  52           3HB      LEU  52   3.866  -0.493 -12.933
  380    HG   LEU  52           HG       LEU  52   3.582  -2.216 -14.764
  381   HD11  LEU  52          1HD1      LEU  52   6.628  -2.317 -14.660
  382   HD12  LEU  52          2HD1      LEU  52   5.597  -3.454 -15.529
  383   HD13  LEU  52          3HD1      LEU  52   5.678  -1.803 -16.056
  384   HD21  LEU  52          3HD2      LEU  52   5.428  -3.001 -12.473
  385   HD22  LEU  52          1HD2      LEU  52   3.651  -2.907 -12.432
  386   HD23  LEU  52          2HD2      LEU  52   4.439  -4.121 -13.448
  387    H    SER  53           H        SER  53   2.428  -0.967 -15.479
  388    HA   SER  53           HA       SER  53   0.498   1.253 -15.149
  389    HB2  SER  53           2HB      SER  53   0.856  -0.401 -17.688
  390    HB3  SER  53           3HB      SER  53  -0.354   0.859 -17.403
  391    HG   SER  53           HG       SER  53   1.432   1.631 -18.575
  392    H    VAL  54           H        VAL  54  -1.424   0.440 -14.306
  393    HA   VAL  54           HA       VAL  54  -1.798  -2.364 -13.795
  394    HB   VAL  54           HB       VAL  54  -3.881  -0.129 -13.751
  395   HG11  VAL  54          1HG1      VAL  54  -3.751  -2.802 -12.261
  396   HG12  VAL  54          2HG1      VAL  54  -5.003  -1.559 -12.058
  397   HG13  VAL  54          3HG1      VAL  54  -4.866  -2.411 -13.579
  398   HG21  VAL  54          3HG2      VAL  54  -2.043  -1.104 -11.527
  399   HG22  VAL  54          1HG2      VAL  54  -1.982   0.494 -12.312
  400   HG23  VAL  54          2HG2      VAL  54  -3.375   0.067 -11.336
  401    H    GLY  55           H        GLY  55  -3.210  -3.826 -14.799
  402    HA2  GLY  55           2HA      GLY  55  -4.485  -4.742 -16.424
  403    HA3  GLY  55           3HA      GLY  55  -4.934  -3.117 -16.981
  404    H    ASP  56           H        ASP  56  -1.545  -4.172 -16.760
  405    HA   ASP  56           HA       ASP  56  -1.419  -4.540 -19.719
  406    HB2  ASP  56           2HB      ASP  56  -0.407  -2.389 -18.909
  407    HB3  ASP  56           3HB      ASP  56   0.679  -3.330 -17.886
  408    H    GLU  57           H        GLU  57   0.428  -5.976 -20.327
  409    HA   GLU  57           HA       GLU  57   0.721  -8.211 -18.389
  410    HB2  GLU  57           2HB      GLU  57  -0.417  -8.687 -20.525
  411    HB3  GLU  57           3HB      GLU  57   0.993  -8.088 -21.412
  412    HG2  GLU  57           2HG      GLU  57   2.372  -9.902 -20.432
  413    HG3  GLU  57           3HG      GLU  57   0.978 -10.476 -19.518
  414    H    VAL  58           H        VAL  58   2.739  -8.811 -17.719
  415    HA   VAL  58           HA       VAL  58   5.108  -7.320 -18.709
  416    HB   VAL  58           HB       VAL  58   5.673  -6.716 -16.362
  417   HG11  VAL  58          1HG1      VAL  58   3.016  -5.553 -17.327
  418   HG12  VAL  58          2HG1      VAL  58   4.071  -4.838 -16.134
  419   HG13  VAL  58          3HG1      VAL  58   4.628  -5.020 -17.810
  420   HG21  VAL  58          3HG2      VAL  58   2.815  -7.563 -15.682
  421   HG22  VAL  58          1HG2      VAL  58   4.313  -8.329 -15.108
  422   HG23  VAL  58          2HG2      VAL  58   3.938  -6.684 -14.619
  423    H    GLN  59           H        GLN  59   7.037  -8.383 -18.358
  424    HA   GLN  59           HA       GLN  59   6.949 -11.209 -17.497
  425    HB2  GLN  59           2HB      GLN  59   9.248  -9.389 -18.344
  426    HB3  GLN  59           3HB      GLN  59   9.385 -11.110 -17.942
  427    HG2  GLN  59           2HG      GLN  59   7.849 -11.672 -19.813
  428    HG3  GLN  59           3HG      GLN  59   7.745  -9.966 -20.243
  429   HE21  GLN  59          2HE2      GLN  59   9.786  -8.855 -20.944
  430   HE22  GLN  59          1HE2      GLN  59  11.052  -9.844 -21.658
  431    H    VAL  60           H        VAL  60   7.725 -11.891 -15.470
  432    HA   VAL  60           HA       VAL  60   8.859  -9.874 -13.629
  433    HB   VAL  60           HB       VAL  60   7.340 -11.051 -11.856
  434   HG11  VAL  60          1HG1      VAL  60   6.213  -9.014 -13.805
  435   HG12  VAL  60          2HG1      VAL  60   5.599  -9.326 -12.178
  436   HG13  VAL  60          3HG1      VAL  60   7.233  -8.681 -12.388
  437   HG21  VAL  60          3HG2      VAL  60   5.599 -11.480 -14.338
  438   HG22  VAL  60          1HG2      VAL  60   6.298 -12.755 -13.306
  439   HG23  VAL  60          2HG2      VAL  60   5.093 -11.615 -12.669
  440    H    LYS  61           H        LYS  61  10.504 -10.612 -12.449
  441    HA   LYS  61           HA       LYS  61  11.186 -13.505 -12.522
  442    HB2  LYS  61           2HB      LYS  61  12.940 -11.773 -12.938
  443    HB3  LYS  61           3HB      LYS  61  12.664 -11.125 -11.313
  444    HG2  LYS  61           2HG      LYS  61  13.416 -13.232 -10.296
  445    HG3  LYS  61           3HG      LYS  61  13.546 -13.995 -11.888
  446    HD2  LYS  61           2HD      LYS  61  15.272 -12.268 -12.525
  447    HD3  LYS  61           3HD      LYS  61  15.166 -11.634 -10.876
  448    HE2  LYS  61           2HE      LYS  61  17.070 -13.005 -10.855
  449    HE3  LYS  61           3HE      LYS  61  15.817 -13.957 -10.045
  450    HZ1  LYS  61           3HZ      LYS  61  15.509 -15.196 -12.113
  451    HZ2  LYS  61           1HZ      LYS  61  16.678 -14.280 -12.873
  452    HZ3  LYS  61           2HZ      LYS  61  17.039 -15.280 -11.629
  453    H    VAL  62           H        VAL  62  10.730 -14.808 -10.780
  454    HA   VAL  62           HA       VAL  62   9.355 -13.836  -8.444
  455    HB   VAL  62           HB       VAL  62  10.794 -16.487  -8.813
  456   HG11  VAL  62          1HG1      VAL  62   8.434 -15.627  -7.065
  457   HG12  VAL  62          2HG1      VAL  62   9.100 -17.265  -7.149
  458   HG13  VAL  62          3HG1      VAL  62  10.071 -15.951  -6.488
  459   HG21  VAL  62          3HG2      VAL  62   7.908 -15.796  -9.558
  460   HG22  VAL  62          1HG2      VAL  62   9.212 -16.204 -10.701
  461   HG23  VAL  62          2HG2      VAL  62   8.660 -17.416  -9.571
  462    H    LEU  63           H        LEU  63  10.280 -12.711  -6.846
  463    HA   LEU  63           HA       LEU  63  13.226 -12.806  -6.541
  464    HB2  LEU  63           2HB      LEU  63  12.115 -10.652  -7.045
  465    HB3  LEU  63           3HB      LEU  63  11.139 -10.812  -5.586
  466    HG   LEU  63           HG       LEU  63  13.166 -10.681  -4.174
  467   HD11  LEU  63          1HD1      LEU  63  14.654 -10.171  -6.801
  468   HD12  LEU  63          2HD1      LEU  63  15.327 -10.023  -5.171
  469   HD13  LEU  63          3HD1      LEU  63  14.859 -11.608  -5.756
  470   HD21  LEU  63          3HD2      LEU  63  12.893  -8.450  -6.229
  471   HD22  LEU  63          1HD2      LEU  63  11.920  -8.632  -4.759
  472   HD23  LEU  63          2HD2      LEU  63  13.654  -8.296  -4.635
  473    H    ALA  64           H        ALA  64  10.179 -13.343  -4.742
  474    HA   ALA  64           HA       ALA  64  11.602 -15.021  -2.831
  475    HB1  ALA  64           1HB      ALA  64  10.121 -12.569  -1.847
  476    HB2  ALA  64           2HB      ALA  64  10.708 -13.881  -0.841
  477    HB3  ALA  64           3HB      ALA  64  11.868 -12.865  -1.715
  478    H    VAL  65           H        VAL  65   9.986 -16.342  -1.586
  479    HA   VAL  65           HA       VAL  65   7.166 -15.805  -2.004
  480    HB   VAL  65           HB       VAL  65   7.475 -17.203  -3.873
  481   HG11  VAL  65          1HG1      VAL  65   9.066 -19.158  -2.179
  482   HG12  VAL  65          2HG1      VAL  65   8.557 -19.421  -3.852
  483   HG13  VAL  65          3HG1      VAL  65   9.686 -18.130  -3.490
  484   HG21  VAL  65          3HG2      VAL  65   6.496 -18.994  -1.614
  485   HG22  VAL  65          1HG2      VAL  65   5.527 -17.851  -2.558
  486   HG23  VAL  65          2HG2      VAL  65   6.248 -19.271  -3.346
  487    H    ASP  66           H        ASP  66   5.956 -16.467  -0.262
  488    HA   ASP  66           HA       ASP  66   7.191 -18.080   1.873
  489    HB2  ASP  66           2HB      ASP  66   7.707 -15.691   2.395
  490    HB3  ASP  66           3HB      ASP  66   5.988 -15.333   2.379
  491    H    GLU  67           H        GLU  67   5.722 -19.695   1.824
  492    HA   GLU  67           HA       GLU  67   3.000 -19.282   0.935
  493    HB2  GLU  67           2HB      GLU  67   4.470 -21.726   2.002
  494    HB3  GLU  67           3HB      GLU  67   2.831 -21.741   1.326
  495    HG2  GLU  67           2HG      GLU  67   3.718 -20.863  -0.822
  496    HG3  GLU  67           3HG      GLU  67   5.358 -20.931  -0.186
  497    H    GLU  68           H        GLU  68   4.557 -19.289   4.099
  498    HA   GLU  68           HA       GLU  68   2.131 -19.959   5.569
  499    HB2  GLU  68           2HB      GLU  68   4.767 -18.715   6.451
  500    HB3  GLU  68           3HB      GLU  68   3.433 -19.178   7.520
  501    HG2  GLU  68           2HG      GLU  68   3.632 -21.535   6.726
  502    HG3  GLU  68           3HG      GLU  68   5.015 -21.079   5.742
  503    H    LYS  69           H        LYS  69   3.955 -16.990   4.696
  504    HA   LYS  69           HA       LYS  69   1.854 -15.214   5.622
  505    HB2  LYS  69           2HB      LYS  69   4.405 -14.787   5.117
  506    HB3  LYS  69           3HB      LYS  69   3.880 -14.549   3.447
  507    HG2  LYS  69           2HG      LYS  69   2.333 -12.739   4.230
  508    HG3  LYS  69           3HG      LYS  69   2.848 -13.030   5.900
  509    HD2  LYS  69           2HD      LYS  69   5.178 -12.410   5.308
  510    HD3  LYS  69           3HD      LYS  69   4.699 -12.188   3.628
  511    HE2  LYS  69           2HE      LYS  69   4.814 -10.011   4.598
  512    HE3  LYS  69           3HE      LYS  69   3.106 -10.381   4.333
  513    HZ1  LYS  69           3HZ      LYS  69   2.951 -10.936   6.700
  514    HZ2  LYS  69           1HZ      LYS  69   4.535 -10.592   6.916
  515    HZ3  LYS  69           2HZ      LYS  69   3.492  -9.393   6.505
  516    H    GLY  70           H        GLY  70   2.292 -17.164   2.768
  517    HA2  GLY  70           2HA      GLY  70   0.964 -17.518   0.921
  518    HA3  GLY  70           3HA      GLY  70  -0.314 -16.533   1.678
  519    H    LYS  71           H        LYS  71   3.073 -15.869   0.498
  520    HA   LYS  71           HA       LYS  71   2.047 -13.657  -1.197
  521    HB2  LYS  71           2HB      LYS  71   4.195 -13.424   0.971
  522    HB3  LYS  71           3HB      LYS  71   3.842 -12.171  -0.217
  523    HG2  LYS  71           2HG      LYS  71   1.939 -13.170   1.919
  524    HG3  LYS  71           3HG      LYS  71   2.866 -11.688   2.002
  525    HD2  LYS  71           2HD      LYS  71   1.621 -10.642   0.273
  526    HD3  LYS  71           3HD      LYS  71   0.872 -12.139  -0.257
  527    HE2  LYS  71           2HE      LYS  71   0.377 -10.848   2.452
  528    HE3  LYS  71           3HE      LYS  71  -0.664 -10.674   1.028
  529    HZ1  LYS  71           3HZ      LYS  71  -1.003 -13.076   1.069
  530    HZ2  LYS  71           1HZ      LYS  71  -0.091 -13.259   2.382
  531    HZ3  LYS  71           2HZ      LYS  71  -1.483 -12.407   2.503
  532    H    ILE  72           H        ILE  72   3.593 -12.872  -2.700
  533    HA   ILE  72           HA       ILE  72   6.088 -14.366  -3.093
  534    HB   ILE  72           HB       ILE  72   3.998 -13.814  -5.257
  535   HG12  ILE  72          2HG1      ILE  72   4.958 -16.482  -4.165
  536   HG13  ILE  72          3HG1      ILE  72   3.367 -15.767  -3.868
  537   HG21  ILE  72          1HG2      ILE  72   6.733 -15.152  -5.449
  538   HG22  ILE  72          2HG2      ILE  72   5.598 -14.962  -6.798
  539   HG23  ILE  72          3HG2      ILE  72   6.316 -13.553  -6.092
  540   HD11  ILE  72          3HD1      ILE  72   2.831 -15.880  -6.256
  541   HD12  ILE  72          1HD1      ILE  72   4.375 -16.692  -6.582
  542   HD13  ILE  72          2HD1      ILE  72   3.191 -17.478  -5.570
  543    H    SER  73           H        SER  73   7.695 -12.897  -3.606
  544    HA   SER  73           HA       SER  73   6.902 -10.072  -4.174
  545    HB2  SER  73           2HB      SER  73   9.583 -11.093  -3.210
  546    HB3  SER  73           3HB      SER  73   9.055  -9.420  -3.327
  547    HG   SER  73           HG       SER  73   8.881 -10.232  -1.174
  548    H    LEU  74           H        LEU  74   7.965  -9.066  -5.976
  549    HA   LEU  74           HA       LEU  74   9.116 -10.976  -7.964
  550    HB2  LEU  74           2HB      LEU  74   6.871  -8.970  -8.326
  551    HB3  LEU  74           3HB      LEU  74   7.617  -9.877  -9.638
  552    HG   LEU  74           HG       LEU  74   6.007 -11.066  -7.333
  553   HD11  LEU  74          1HD1      LEU  74   5.275 -10.639 -10.252
  554   HD12  LEU  74          2HD1      LEU  74   4.282 -11.469  -9.055
  555   HD13  LEU  74          3HD1      LEU  74   4.619  -9.746  -8.869
  556   HD21  LEU  74          3HD2      LEU  74   7.114 -12.396  -9.856
  557   HD22  LEU  74          1HD2      LEU  74   7.678 -12.655  -8.186
  558   HD23  LEU  74          2HD2      LEU  74   6.063 -13.148  -8.637
  559    H    SER  75           H        SER  75  10.121  -9.842  -9.812
  560    HA   SER  75           HA       SER  75  10.712  -6.977  -9.358
  561    HB2  SER  75           2HB      SER  75  12.707  -8.238  -8.643
  562    HB3  SER  75           3HB      SER  75  12.699  -9.148 -10.166
  563    HG   SER  75           HG       SER  75  14.116  -7.244  -9.992
  564    H    ILE  76           H        ILE  76  10.808  -5.769 -11.184
  565    HA   ILE  76           HA       ILE  76   9.898  -6.977 -13.765
  566    HB   ILE  76           HB       ILE  76   9.714  -4.241 -12.483
  567   HG12  ILE  76          2HG1      ILE  76   8.030  -5.969 -11.864
  568   HG13  ILE  76          3HG1      ILE  76   7.388  -4.446 -12.482
  569   HG21  ILE  76          1HG2      ILE  76   8.906  -4.896 -15.307
  570   HG22  ILE  76          2HG2      ILE  76   8.553  -3.388 -14.457
  571   HG23  ILE  76          3HG2      ILE  76  10.215  -3.799 -14.823
  572   HD11  ILE  76          3HD1      ILE  76   6.902  -5.537 -14.654
  573   HD12  ILE  76          1HD1      ILE  76   7.587  -7.045 -14.019
  574   HD13  ILE  76          2HD1      ILE  76   6.111  -6.358 -13.315
  575    H    ARG  77           H        ARG  77  12.171  -4.614 -12.240
  576    HA   ARG  77           HA       ARG  77  13.635  -4.025 -14.546
  577    HB2  ARG  77           2HB      ARG  77  15.273  -3.089 -13.105
  578    HB3  ARG  77           3HB      ARG  77  13.703  -2.835 -12.345
  579    HG2  ARG  77           2HG      ARG  77  14.136  -4.698 -10.782
  580    HG3  ARG  77           3HG      ARG  77  15.714  -4.978 -11.538
  581    HD2  ARG  77           2HD      ARG  77  16.462  -2.744 -10.917
  582    HD3  ARG  77           3HD      ARG  77  14.876  -2.370 -10.206
  583    HE   ARG  77           HE       ARG  77  15.577  -4.651  -8.877
  584   HH11  ARG  77          1HH2      ARG  77  17.238  -1.552  -9.338
  585   HH12  ARG  77          2HH2      ARG  77  18.043  -1.607  -7.805
  586   HH21  ARG  77          1HH1      ARG  77  16.518  -4.656  -6.832
  587   HH22  ARG  77          2HH1      ARG  77  17.654  -3.449  -6.358
  588    H    ALA  78           H        ALA  78  13.854  -6.892 -12.535
  589    HA   ALA  78           HA       ALA  78  16.364  -7.812 -13.515
  590    HB1  ALA  78           1HB      ALA  78  13.957  -9.372 -12.477
  591    HB2  ALA  78           2HB      ALA  78  15.628  -9.968 -12.598
  592    HB3  ALA  78           3HB      ALA  78  15.248  -8.659 -11.472
  593    H    THR  79           H        THR  79  13.437  -7.527 -15.346
  594    HA   THR  79           HA       THR  79  14.395  -9.508 -17.330
  595    HB   THR  79           HB       THR  79  13.061 -10.750 -15.762
  596    HG1  THR  79           1HG      THR  79  11.439 -11.512 -17.181
  597   HG21  THR  79          1HG2      THR  79  10.784  -8.805 -16.285
  598   HG22  THR  79          2HG2      THR  79  10.676 -10.325 -15.378
  599   HG23  THR  79          3HG2      THR  79  11.652  -9.006 -14.753
  600    H    GLN  80           H        GLN  80  12.465  -6.616 -16.627
  601    HA   GLN  80           HA       GLN  80  12.742  -5.883 -19.452
  602    HB2  GLN  80           2HB      GLN  80  10.440  -5.140 -19.645
  603    HB3  GLN  80           3HB      GLN  80  10.465  -6.858 -19.269
  604    HG2  GLN  80           2HG      GLN  80   9.825  -6.453 -16.970
  605    HG3  GLN  80           3HG      GLN  80  10.098  -4.724 -17.143
  606   HE21  GLN  80          2HE2      GLN  80   8.383  -3.408 -17.698
  607   HE22  GLN  80          1HE2      GLN  80   6.810  -4.044 -18.190
  608    H    ALA  81           H        ALA  81  11.464  -3.373 -19.227
  609    HA   ALA  81           HA       ALA  81  12.474  -2.080 -16.769
  610    HB1  ALA  81           1HB      ALA  81  12.857  -1.082 -19.628
  611    HB2  ALA  81           2HB      ALA  81  13.251  -0.156 -18.169
  612    HB3  ALA  81           3HB      ALA  81  14.142  -1.642 -18.532
  613    H    ALA  82           H        ALA  82  11.487   0.415 -17.162
  614    HA   ALA  82           HA       ALA  82   8.724   0.308 -16.912
  615    HB1  ALA  82           1HB      ALA  82  10.489   2.592 -17.896
  616    HB2  ALA  82           2HB      ALA  82   8.818   2.763 -17.340
  617    HB3  ALA  82           3HB      ALA  82  10.073   2.235 -16.203
  618    HA   PRO  83           HA       PRO  83   7.188  -0.190 -21.098
  619    HB2  PRO  83           2HB      PRO  83   5.130   1.875 -20.306
  620    HB3  PRO  83           3HB      PRO  83   4.891   0.290 -21.098
  621    HG2  PRO  83           2HG      PRO  83   4.376   0.624 -18.436
  622    HG3  PRO  83           3HG      PRO  83   5.169  -0.863 -19.037
  623    HD2  PRO  83           2HD      PRO  83   6.444   1.537 -17.713
  624    HD3  PRO  83           3HD      PRO  83   6.787  -0.211 -17.502
  625    H    GLU  84           H        GLU  84   7.566   3.105 -19.771
  626    HA   GLU  84           HA       GLU  84   7.978   5.128 -20.645
  627    HB2  GLU  84           2HB      GLU  84   9.730   3.516 -22.522
  628    HB3  GLU  84           3HB      GLU  84   9.800   5.271 -22.331
  629    HG2  GLU  84           2HG      GLU  84  10.285   4.935 -19.884
  630    HG3  GLU  84           3HG      GLU  84  10.387   3.207 -20.186
  631    H    LYS  85           H        LYS  85   5.657   3.646 -21.793
  632    HA   LYS  85           HA       LYS  85   5.209   4.613 -24.439
  633    HB2  LYS  85           2HB      LYS  85   3.914   2.800 -23.192
  634    HB3  LYS  85           3HB      LYS  85   3.173   4.072 -22.219
  635    HG2  LYS  85           2HG      LYS  85   1.601   3.480 -23.907
  636    HG3  LYS  85           3HG      LYS  85   2.228   5.055 -24.355
  637    HD2  LYS  85           2HD      LYS  85   3.815   3.883 -25.981
  638    HD3  LYS  85           3HD      LYS  85   3.052   2.363 -25.528
  639    HE2  LYS  85           2HE      LYS  85   1.953   2.972 -27.511
  640    HE3  LYS  85           3HE      LYS  85   0.812   3.427 -26.234
  641    HZ1  LYS  85           3HZ      LYS  85   1.653   5.735 -26.466
  642    HZ2  LYS  85           1HZ      LYS  85   2.690   5.286 -27.597
  643    HZ3  LYS  85           2HZ      LYS  85   1.075   5.187 -27.901
  644    H    LYS  86           H        LYS  86   4.202   6.520 -25.157
  645    HA   LYS  86           HA       LYS  86   3.212   8.494 -23.186
  646    HB2  LYS  86           2HB      LYS  86   5.023   9.195 -25.537
  647    HB3  LYS  86           3HB      LYS  86   4.232  10.337 -24.455
  648    HG2  LYS  86           2HG      LYS  86   5.550   9.411 -22.542
  649    HG3  LYS  86           3HG      LYS  86   6.398   8.337 -23.669
  650    HD2  LYS  86           2HD      LYS  86   7.237  10.298 -24.926
  651    HD3  LYS  86           3HD      LYS  86   6.409  11.378 -23.776
  652    HE2  LYS  86           2HE      LYS  86   7.744  10.398 -21.911
  653    HE3  LYS  86           3HE      LYS  86   8.567   9.332 -23.059
  654    HZ1  LYS  86           3HZ      LYS  86   9.466  11.300 -24.145
  655    HZ2  LYS  86           1HZ      LYS  86   8.690  12.294 -23.082
  656    HZ3  LYS  86           2HZ      LYS  86   9.881  11.288 -22.563
  657    H    GLU  87           H        GLU  87   2.107  10.353 -24.910
  658    HA   GLU  87           HA       GLU  87  -0.008   9.026 -26.225
  659    HB2  GLU  87           2HB      GLU  87   1.187  11.790 -26.698
  660    HB3  GLU  87           3HB      GLU  87  -0.331  11.204 -27.365
  661    HG2  GLU  87           2HG      GLU  87  -0.886  12.552 -25.499
  662    HG3  GLU  87           3HG      GLU  87  -1.251  10.884 -25.090
  663    H    SER  88           H        SER  88  -0.191   8.125 -28.272
  664    HA   SER  88           HA       SER  88   2.189   7.523 -29.745
  665    HB2  SER  88           2HB      SER  88  -0.696   7.200 -30.639
  666    HB3  SER  88           3HB      SER  88   0.710   6.266 -31.173
  667    HG   SER  88           HG       SER  88  -0.466   5.114 -29.589
  668    H    LYS  89           H        LYS  89  -0.009  10.218 -29.946
  669    HA   LYS  89           HA       LYS  89   1.388  11.319 -32.278
  670    HB2  LYS  89           2HB      LYS  89  -1.588  10.673 -32.115
  671    HB3  LYS  89           3HB      LYS  89  -1.045  12.052 -33.060
  672    HG2  LYS  89           2HG      LYS  89   0.520  10.549 -34.331
  673    HG3  LYS  89           3HG      LYS  89  -0.160   9.163 -33.474
  674    HD2  LYS  89           2HD      LYS  89  -1.757  11.064 -35.244
  675    HD3  LYS  89           3HD      LYS  89  -1.078   9.514 -35.758
  676    HE2  LYS  89           2HE      LYS  89  -2.401   8.450 -33.812
  677    HE3  LYS  89           3HE      LYS  89  -3.243   9.998 -33.672
  678    HZ1  LYS  89           3HZ      LYS  89  -3.962   9.704 -35.985
  679    HZ2  LYS  89           1HZ      LYS  89  -3.188   8.255 -36.081
  680    HZ3  LYS  89           2HZ      LYS  89  -4.432   8.412 -35.043
  681    HA   PRO  90           HA       PRO  90   1.017  14.958 -29.781
  682    HB2  PRO  90           2HB      PRO  90   0.381  17.002 -31.563
  683    HB3  PRO  90           3HB      PRO  90   2.008  16.291 -31.356
  684    HG2  PRO  90           2HG      PRO  90  -0.076  15.618 -33.436
  685    HG3  PRO  90           3HG      PRO  90   1.680  15.869 -33.674
  686    HD2  PRO  90           2HD      PRO  90   0.610  13.382 -33.505
  687    HD3  PRO  90           3HD      PRO  90   2.190  13.739 -32.758
  688    H    ARG  91           H        ARG  91  -0.467  16.593 -28.969
  689    HA   ARG  91           HA       ARG  91  -2.965  15.538 -28.348
  690    HB2  ARG  91           2HB      ARG  91  -1.670  17.214 -27.018
  691    HB3  ARG  91           3HB      ARG  91  -2.082  18.463 -28.207
  692    HG2  ARG  91           2HG      ARG  91  -4.489  18.169 -27.683
  693    HG3  ARG  91           3HG      ARG  91  -4.101  16.892 -26.523
  694    HD2  ARG  91           2HD      ARG  91  -3.130  19.779 -26.342
  695    HD3  ARG  91           3HD      ARG  91  -4.552  19.142 -25.499
  696    HE   ARG  91           HE       ARG  91  -2.489  17.433 -24.791
  697   HH11  ARG  91          1HH1      ARG  91  -3.113  20.924 -24.440
  698   HH12  ARG  91          2HH1      ARG  91  -2.192  21.097 -22.994
  699   HH21  ARG  91          1HH2      ARG  91  -1.248  17.668 -22.833
  700   HH22  ARG  91          2HH2      ARG  91  -1.109  19.194 -22.082
  701    H    LYS  92           H        LYS  92  -4.967  15.662 -29.150
  702    HA   LYS  92           HA       LYS  92  -5.807  17.704 -31.043
  703    HB2  LYS  92           2HB      LYS  92  -4.803  15.879 -32.424
  704    HB3  LYS  92           3HB      LYS  92  -5.887  14.713 -31.655
  705    HG2  LYS  92           2HG      LYS  92  -7.837  15.865 -32.639
  706    HG3  LYS  92           3HG      LYS  92  -6.769  17.091 -33.355
  707    HD2  LYS  92           2HD      LYS  92  -5.697  15.392 -34.753
  708    HD3  LYS  92           3HD      LYS  92  -6.664  14.109 -33.976
  709    HE2  LYS  92           2HE      LYS  92  -8.746  15.170 -34.790
  710    HE3  LYS  92           3HE      LYS  92  -7.798  16.458 -35.560
  711    HZ1  LYS  92           3HZ      LYS  92  -6.790  14.799 -36.964
  712    HZ2  LYS  92           1HZ      LYS  92  -7.678  13.593 -36.263
  713    HZ3  LYS  92           2HZ      LYS  92  -8.424  14.766 -37.144
  714    HA   PRO  93           HA       PRO  93  -9.284  17.320 -28.304
  715    HB2  PRO  93           2HB      PRO  93 -11.059  17.368 -30.757
  716    HB3  PRO  93           3HB      PRO  93 -11.240  18.257 -29.209
  717    HG2  PRO  93           2HG      PRO  93 -10.167  19.504 -31.377
  718    HG3  PRO  93           3HG      PRO  93  -9.451  19.725 -29.755
  719    HD2  PRO  93           2HD      PRO  93  -8.479  17.988 -32.003
  720    HD3  PRO  93           3HD      PRO  93  -7.537  18.972 -30.841
  721    H    LYS  94           H        LYS  94  -9.540  15.179 -31.182
  722    HA   LYS  94           HA       LYS  94  -9.958  12.898 -29.374
  723    HB2  LYS  94           2HB      LYS  94 -11.641  13.454 -31.870
  724    HB3  LYS  94           3HB      LYS  94 -11.551  11.894 -31.040
  725    HG2  LYS  94           2HG      LYS  94 -12.464  12.960 -28.964
  726    HG3  LYS  94           3HG      LYS  94 -12.591  14.493 -29.834
  727    HD2  LYS  94           2HD      LYS  94 -14.757  13.510 -29.798
  728    HD3  LYS  94           3HD      LYS  94 -14.157  13.439 -31.462
  729    HE2  LYS  94           2HE      LYS  94 -13.533  11.057 -31.139
  730    HE3  LYS  94           3HE      LYS  94 -14.070  11.133 -29.453
  731    HZ1  LYS  94           3HZ      LYS  94 -16.313  11.558 -30.252
  732    HZ2  LYS  94           1HZ      LYS  94 -15.808  11.498 -31.820
  733    HZ3  LYS  94           2HZ      LYS  94 -15.728  10.157 -30.878
  734    H    ALA  95           H        ALA  95  -8.684  11.153 -30.084
  735    HA   ALA  95           HA       ALA  95  -7.872  10.846 -32.833
  736    HB1  ALA  95           1HB      ALA  95  -5.799  11.465 -30.667
  737    HB2  ALA  95           2HB      ALA  95  -5.422  10.871 -32.298
  738    HB3  ALA  95           3HB      ALA  95  -6.152  12.467 -32.088
  739    H    ALA  96           H        ALA  96  -6.723   8.786 -33.076
  740    HA   ALA  96           HA       ALA  96  -6.280   7.048 -30.785
  741    HB1  ALA  96           1HB      ALA  96  -8.159   6.290 -33.081
  742    HB2  ALA  96           2HB      ALA  96  -7.526   5.163 -31.859
  743    HB3  ALA  96           3HB      ALA  96  -8.603   6.482 -31.371
  744    H    GLN  97           H        GLN  97  -4.820   5.296 -31.450
  745    HA   GLN  97           HA       GLN  97  -2.958   6.147 -33.474
  746    HB2  GLN  97           2HB      GLN  97  -1.517   4.423 -32.602
  747    HB3  GLN  97           3HB      GLN  97  -2.221   5.387 -31.312
  748    HG2  GLN  97           2HG      GLN  97  -3.826   3.570 -30.789
  749    HG3  GLN  97           3HG      GLN  97  -3.186   2.619 -32.124
  750   HE21  GLN  97          2HE2      GLN  97  -2.607   0.889 -30.637
  751   HE22  GLN  97          1HE2      GLN  97  -1.234   1.045 -29.578
  752    H    VAL  98           H        VAL  98  -5.608   5.137 -34.451
  753    HA   VAL  98           HA       VAL  98  -5.123   2.734 -35.946
  754    HB   VAL  98           HB       VAL  98  -7.322   3.279 -36.962
  755   HG11  VAL  98          1HG1      VAL  98  -7.241   3.647 -33.922
  756   HG12  VAL  98          2HG1      VAL  98  -8.648   3.186 -34.883
  757   HG13  VAL  98          3HG1      VAL  98  -7.251   2.113 -34.807
  758   HG21  VAL  98          3HG2      VAL  98  -7.210   5.863 -35.308
  759   HG22  VAL  98          1HG2      VAL  98  -7.169   5.737 -37.086
  760   HG23  VAL  98          2HG2      VAL  98  -8.606   5.233 -36.202
  761    H    SER  99           H        SER  99  -3.251   5.132 -36.357
  762    HA   SER  99           HA       SER  99  -3.556   6.400 -38.809
  763    HB2  SER  99           2HB      SER  99  -0.926   5.465 -37.618
  764    HB3  SER  99           3HB      SER  99  -1.249   6.941 -38.532
  765    HG   SER  99           HG       SER  99  -1.043   7.214 -36.273
  766    H    GLU 100           H        GLU 100  -3.199   5.850 -40.933
  767    HA   GLU 100           HA       GLU 100  -3.164   3.161 -41.740
  768    HB2  GLU 100           2HB      GLU 100  -4.087   5.143 -42.962
  769    HB3  GLU 100           3HB      GLU 100  -2.438   5.666 -43.325
  770    HG2  GLU 100           2HG      GLU 100  -2.065   3.609 -44.634
  771    HG3  GLU 100           3HG      GLU 100  -3.649   2.991 -44.170
  772    H    GLU 101           H        GLU 101  -0.499   5.418 -41.189
  773    HA   GLU 101           HA       GLU 101   1.570   3.956 -42.474
  774    HB2  GLU 101           2HB      GLU 101   1.641   5.867 -40.094
  775    HB3  GLU 101           3HB      GLU 101   3.068   5.309 -40.987
  776    HG2  GLU 101           2HG      GLU 101   2.113   6.328 -43.074
  777    HG3  GLU 101           3HG      GLU 101   0.753   6.938 -42.132
  778    H    ALA 102           H        ALA 102  -0.126   3.343 -39.509
  779    HA   ALA 102           HA       ALA 102   0.118   1.946 -37.792
  780    HB1  ALA 102           1HB      ALA 102   1.259   0.111 -39.918
  781    HB2  ALA 102           2HB      ALA 102   0.505  -0.384 -38.393
  782    HB3  ALA 102           3HB      ALA 102  -0.471   0.421 -39.633
  783    H    SER 103           H        SER 103   2.382   3.754 -38.030
  784    HA   SER 103           HA       SER 103   4.877   2.741 -37.611
  785    HB2  SER 103           2HB      SER 103   3.705   5.081 -36.082
  786    HB3  SER 103           3HB      SER 103   5.363   4.888 -36.673
  787    HG   SER 103           HG       SER 103   4.098   6.277 -38.041
  788    H    THR 104           H        THR 104   6.137   2.158 -35.763
  789    HA   THR 104           HA       THR 104   4.840   0.749 -33.671
  790    HB   THR 104           HB       THR 104   7.245   0.963 -32.641
  791    HG1  THR 104           1HG      THR 104   8.791   1.480 -34.241
  792   HG21  THR 104          1HG2      THR 104   6.863  -0.351 -35.361
  793   HG22  THR 104          2HG2      THR 104   8.135  -0.738 -34.195
  794   HG23  THR 104          3HG2      THR 104   6.444  -1.068 -33.809
  795    HA   PRO 105           HA       PRO 105   4.259   4.195 -30.797
  796    HB2  PRO 105           2HB      PRO 105   4.196   2.871 -28.385
  797    HB3  PRO 105           3HB      PRO 105   2.844   2.803 -29.562
  798    HG2  PRO 105           2HG      PRO 105   5.032   0.790 -29.080
  799    HG3  PRO 105           3HG      PRO 105   3.296   0.475 -29.346
  800    HD2  PRO 105           2HD      PRO 105   5.253   0.292 -31.316
  801    HD3  PRO 105           3HD      PRO 105   3.532   0.679 -31.665
  802    H    GLN 106           H        GLN 106   5.504   5.155 -28.894
  803    HA   GLN 106           HA       GLN 106   8.356   4.552 -29.003
  804    HB2  GLN 106           2HB      GLN 106   8.641   6.376 -27.492
  805    HB3  GLN 106           3HB      GLN 106   7.590   6.874 -28.803
  806    HG2  GLN 106           2HG      GLN 106   6.538   6.042 -26.058
  807    HG3  GLN 106           3HG      GLN 106   6.999   7.679 -26.457
  808   HE21  GLN 106          2HE2      GLN 106   5.745   8.886 -28.078
  809   HE22  GLN 106          1HE2      GLN 106   4.097   8.446 -28.367
  810    H    GLY 107           H        GLY 107   9.586   4.006 -27.045
  811    HA2  GLY 107           2HA      GLY 107   9.872   3.301 -24.864
  812    HA3  GLY 107           3HA      GLY 107   8.135   3.068 -24.707
  813    H    PHE 108           H        PHE 108   7.686   1.292 -26.933
  814    HA   PHE 108           HA       PHE 108   9.583  -0.937 -26.636
  815    HB2  PHE 108           2HB      PHE 108   7.784  -2.547 -26.151
  816    HB3  PHE 108           3HB      PHE 108   8.031  -1.394 -24.867
  817    HD1  PHE 108           HD1      PHE 108   5.737  -2.349 -27.658
  818    HD2  PHE 108           HD2      PHE 108   6.283   0.049 -24.118
  819    HE1  PHE 108           HE1      PHE 108   3.313  -1.844 -27.618
  820    HE2  PHE 108           HE2      PHE 108   3.856   0.522 -24.063
  821    HZ   PHE 108           HZ       PHE 108   2.363  -0.405 -25.832
  822    H    ASN 109           H        ASN 109   9.223  -2.626 -28.242
  823    HA   ASN 109           HA       ASN 109   8.508  -1.457 -30.843
  824    HB2  ASN 109           2HB      ASN 109  10.664  -2.687 -30.463
  825    HB3  ASN 109           3HB      ASN 109   9.740  -4.145 -30.080
  826   HD21  ASN 109          2HD2      ASN 109  10.940  -5.176 -31.912
  827   HD22  ASN 109          1HD2      ASN 109  10.384  -4.903 -33.527
  828    H    THR 110           H        THR 110   6.912  -2.311 -32.223
  829    HA   THR 110           HA       THR 110   5.360  -4.679 -31.354
  830    HB   THR 110           HB       THR 110   3.344  -3.535 -32.338
  831    HG1  THR 110           1HG      THR 110   3.506  -1.269 -32.565
  832   HG21  THR 110          1HG2      THR 110   4.643  -2.021 -30.022
  833   HG22  THR 110          2HG2      THR 110   2.925  -2.009 -30.444
  834   HG23  THR 110          3HG2      THR 110   3.688  -3.508 -29.883
  835    H    LEU 111           H        LEU 111   7.299  -3.265 -33.799
  836    HA   LEU 111           HA       LEU 111   6.282  -4.672 -36.092
  837    HB2  LEU 111           2HB      LEU 111   7.836  -2.719 -36.156
  838    HB3  LEU 111           3HB      LEU 111   9.067  -3.681 -35.337
  839    HG   LEU 111           HG       LEU 111   9.122  -5.236 -37.310
  840   HD11  LEU 111          1HD1      LEU 111   7.399  -3.102 -38.632
  841   HD12  LEU 111          2HD1      LEU 111   8.169  -4.468 -39.442
  842   HD13  LEU 111          3HD1      LEU 111   6.881  -4.760 -38.270
  843   HD21  LEU 111          3HD2      LEU 111   9.711  -2.301 -37.866
  844   HD22  LEU 111          1HD2      LEU 111  10.787  -3.458 -37.055
  845   HD23  LEU 111          2HD2      LEU 111  10.390  -3.684 -38.752
  846    H    LYS 112           H        LYS 112   6.891  -6.766 -36.821
  847    HA   LYS 112           HA       LYS 112   7.609  -8.716 -34.863
  848    HB2  LYS 112           2HB      LYS 112   6.282  -9.162 -36.945
  849    HB3  LYS 112           3HB      LYS 112   7.746  -8.920 -37.917
  850    HG2  LYS 112           2HG      LYS 112   8.827 -10.838 -36.785
  851    HG3  LYS 112           3HG      LYS 112   7.404 -11.044 -35.746
  852    HD2  LYS 112           2HD      LYS 112   6.013 -11.524 -37.743
  853    HD3  LYS 112           3HD      LYS 112   7.441 -11.309 -38.788
  854    HE2  LYS 112           2HE      LYS 112   8.587 -13.168 -37.597
  855    HE3  LYS 112           3HE      LYS 112   7.169 -13.382 -36.558
  856    HZ1  LYS 112           3HZ      LYS 112   5.888 -13.951 -38.526
  857    HZ2  LYS 112           1HZ      LYS 112   7.207 -13.753 -39.494
  858    HZ3  LYS 112           2HZ      LYS 112   7.180 -14.953 -38.376
  859    H    ASP 113           H        ASP 113   9.534  -7.253 -37.536
  860    HA   ASP 113           HA       ASP 113  12.055  -8.320 -36.630
  861    HB2  ASP 113           2HB      ASP 113  11.586  -7.632 -38.963
  862    HB3  ASP 113           3HB      ASP 113  11.420  -5.962 -38.437
  863    H    LYS 114           H        LYS 114  13.814  -6.948 -35.849
  864    HA   LYS 114           HA       LYS 114  13.096  -5.436 -33.487
  865    HB2  LYS 114           2HB      LYS 114  15.737  -5.730 -34.993
  866    HB3  LYS 114           3HB      LYS 114  15.550  -4.888 -33.444
  867    HG2  LYS 114           2HG      LYS 114  14.738  -6.988 -32.384
  868    HG3  LYS 114           3HG      LYS 114  14.882  -7.832 -33.928
  869    HD2  LYS 114           2HD      LYS 114  16.778  -8.403 -32.589
  870    HD3  LYS 114           3HD      LYS 114  17.325  -7.405 -33.947
  871    HE2  LYS 114           2HE      LYS 114  17.410  -5.417 -32.467
  872    HE3  LYS 114           3HE      LYS 114  16.802  -6.388 -31.110
  873    HZ1  LYS 114           3HZ      LYS 114  18.809  -7.715 -31.254
  874    HZ2  LYS 114           1HZ      LYS 114  19.364  -6.806 -32.516
  875    HZ3  LYS 114           2HZ      LYS 114  19.192  -6.134 -31.025
  876    H    LEU 115           H        LEU 115  12.239  -3.465 -33.538
  877    HA   LEU 115           HA       LEU 115  12.516  -1.519 -35.601
  878    HB2  LEU 115           2HB      LEU 115  10.751  -1.478 -33.937
  879    HB3  LEU 115           3HB      LEU 115  11.922  -1.336 -32.616
  880    HG   LEU 115           HG       LEU 115  12.518   0.962 -33.500
  881   HD11  LEU 115          1HD1      LEU 115  10.096   0.485 -35.314
  882   HD12  LEU 115          2HD1      LEU 115  10.976   2.017 -35.106
  883   HD13  LEU 115          3HD1      LEU 115  11.770   0.653 -35.860
  884   HD21  LEU 115          3HD2      LEU 115   9.615   0.473 -32.753
  885   HD22  LEU 115          1HD2      LEU 115  10.968   0.670 -31.647
  886   HD23  LEU 115          2HD2      LEU 115  10.477   2.031 -32.653
  887    H    GLU 116           H        GLU 116  13.863   0.342 -35.689
  888    HA   GLU 116           HA       GLU 116  15.987   0.690 -33.684
  889    HB2  GLU 116           2HB      GLU 116  16.308   0.768 -36.728
  890    HB3  GLU 116           3HB      GLU 116  17.483   1.407 -35.576
  891    HG2  GLU 116           2HG      GLU 116  17.695  -0.900 -34.584
  892    HG3  GLU 116           3HG      GLU 116  16.625  -1.503 -35.845
  893    H    GLU 117           H        GLU 117  16.398   2.934 -33.374
  894    HA   GLU 117           HA       GLU 117  14.242   4.725 -33.925
  895    HB2  GLU 117           2HB      GLU 117  17.029   5.409 -32.901
  896    HB3  GLU 117           3HB      GLU 117  15.540   6.321 -32.680
  897    HG2  GLU 117           2HG      GLU 117  15.501   5.347 -30.660
  898    HG3  GLU 117           3HG      GLU 117  14.732   4.027 -31.513
  899    H    TRP 118           H        TRP 118  16.062   3.665 -36.242
  900    HA   TRP 118           HA       TRP 118  16.614   6.246 -37.611
  901    HB2  TRP 118           2HB      TRP 118  18.429   3.816 -37.494
  902    HB3  TRP 118           3HB      TRP 118  18.772   5.330 -38.324
  903    HD1  TRP 118           HD1      TRP 118  18.867   3.658 -34.964
  904    HE1  TRP 118           HE1      TRP 118  19.936   5.127 -33.211
  905    HE3  TRP 118           HE3      TRP 118  19.228   7.970 -37.699
  906    HZ2  TRP 118           HZ2      TRP 118  20.805   7.914 -32.978
  907    HZ3  TRP 118           HZ3      TRP 118  20.238  10.002 -36.696
  908    HH2  TRP 118           HH2      TRP 118  20.999   9.996 -34.336
  909    H    ILE 119           H        ILE 119  14.532   3.840 -37.750
  910    HA   ILE 119           HA       ILE 119  14.501   3.940 -40.721
  911    HB   ILE 119           HB       ILE 119  13.288   1.796 -40.711
  912   HG12  ILE 119          2HG1      ILE 119  14.094   1.452 -37.797
  913   HG13  ILE 119          3HG1      ILE 119  12.465   1.930 -38.303
  914   HG21  ILE 119          1HG2      ILE 119  16.060   1.681 -39.415
  915   HG22  ILE 119          2HG2      ILE 119  15.301   0.361 -40.284
  916   HG23  ILE 119          3HG2      ILE 119  15.705   1.838 -41.145
  917   HD11  ILE 119          3HD1      ILE 119  12.229  -0.170 -39.589
  918   HD12  ILE 119          1HD1      ILE 119  13.838  -0.688 -39.047
  919   HD13  ILE 119          2HD1      ILE 119  12.553  -0.473 -37.873
  920    H    GLU 120           H        GLU 120  12.373   4.123 -41.647
  921    HA   GLU 120           HA       GLU 120  11.037   6.292 -40.542
  922    HB2  GLU 120           2HB      GLU 120  11.233   5.628 -42.937
  923    HB3  GLU 120           3HB      GLU 120  10.066   4.329 -42.656
  924    HG2  GLU 120           2HG      GLU 120   8.323   5.960 -42.108
  925    HG3  GLU 120           3HG      GLU 120   9.487   7.290 -42.193
  926    H    MET 121           H        MET 121  10.332   2.871 -40.116
  927    HA   MET 121           HA       MET 121   7.710   2.917 -39.214
  928    HB2  MET 121           2HB      MET 121   9.250   0.915 -39.590
  929    HB3  MET 121           3HB      MET 121   9.975   1.259 -38.015
  930    HG2  MET 121           2HG      MET 121   8.347  -0.458 -37.712
  931    HG3  MET 121           3HG      MET 121   7.693   1.003 -36.986
  932    HE1  MET 121           3HE      MET 121   6.007  -1.677 -37.684
  933    HE2  MET 121           1HE      MET 121   5.294  -0.250 -36.896
  934    HE3  MET 121           2HE      MET 121   4.518  -0.950 -38.318
  935    H    SER 122           H        SER 122  10.633   4.001 -37.457
  936    HA   SER 122           HA       SER 122   9.495   4.053 -34.839
  937    HB2  SER 122           2HB      SER 122  11.413   5.468 -34.300
  938    HB3  SER 122           3HB      SER 122  11.935   4.137 -35.350
  939    HG   SER 122           HG       SER 122  12.819   6.105 -36.064
  940    H    ASN 123           H        ASN 123   9.101   6.191 -37.581
  941    HA   ASN 123           HA       ASN 123   8.418   8.292 -37.890
  942    HB2  ASN 123           2HB      ASN 123   6.291   7.082 -37.404
  943    HB3  ASN 123           3HB      ASN 123   6.403   7.642 -35.731
  944   HD21  ASN 123          2HD2      ASN 123   4.609   9.017 -35.690
  945   HD22  ASN 123          1HD2      ASN 123   4.471  10.411 -36.772
  946    H    ARG 124           H        ARG 124  10.588   8.024 -35.984
  947    HA   ARG 124           HA       ARG 124  10.310   9.959 -33.920
  948    HB2  ARG 124           2HB      ARG 124  12.099   8.195 -34.113
  949    HB3  ARG 124           3HB      ARG 124  12.881   9.169 -35.371
  950    HG2  ARG 124           2HG      ARG 124  13.405  10.923 -33.818
  951    HG3  ARG 124           3HG      ARG 124  12.264  10.307 -32.611
  952    HD2  ARG 124           2HD      ARG 124  14.499   9.814 -31.872
  953    HD3  ARG 124           3HD      ARG 124  13.684   8.311 -32.268
  954    HE   ARG 124           HE       ARG 124  14.955   8.108 -34.299
  955   HH11  ARG 124          1HH1      ARG 124  16.167  10.829 -32.216
  956   HH12  ARG 124          2HH1      ARG 124  17.719  10.775 -32.959
  957   HH21  ARG 124          1HH2      ARG 124  16.995   8.073 -35.122
  958   HH22  ARG 124          2HH2      ARG 124  18.238   9.177 -34.612
  959    H    LYS 125           H        LYS 125  11.206  12.119 -33.827
  960    HA   LYS 125           HA       LYS 125  10.289  13.790 -35.910
  961    HB2  LYS 125           2HB      LYS 125  12.310  14.415 -33.697
  962    HB3  LYS 125           3HB      LYS 125  11.439  15.613 -34.644
  963    HG2  LYS 125           2HG      LYS 125  10.183  13.641 -32.684
  964    HG3  LYS 125           3HG      LYS 125  10.480  15.350 -32.405
  965    HD2  LYS 125           2HD      LYS 125   8.919  15.905 -34.294
  966    HD3  LYS 125           3HD      LYS 125   8.555  14.166 -34.453
  967    HE2  LYS 125           2HE      LYS 125   7.769  14.111 -32.103
  968    HE3  LYS 125           3HE      LYS 125   8.143  15.834 -31.929
  969    HZ1  LYS 125           3HZ      LYS 125   6.490  16.301 -33.632
  970    HZ2  LYS 125           1HZ      LYS 125   6.145  14.695 -33.790
  971    HZ3  LYS 125           2HZ      LYS 125   5.802  15.475 -32.382
  972    H    ASP 126           H        ASP 126  11.409  15.229 -37.285
  973    HA   ASP 126           HA       ASP 126  13.525  14.194 -38.829
  974    HB2  ASP 126           2HB      ASP 126  11.885  15.853 -39.633
  975    HB3  ASP 126           3HB      ASP 126  12.523  17.047 -38.510
  976    H    LEU 127           H        LEU 127  13.596  16.240 -35.939
  977    HA   LEU 127           HA       LEU 127  16.418  16.739 -36.036
  978    HB2  LEU 127           2HB      LEU 127  14.807  18.144 -34.783
  979    HB3  LEU 127           3HB      LEU 127  14.481  16.795 -33.689
  980    HG   LEU 127           HG       LEU 127  16.834  16.879 -32.867
  981   HD11  LEU 127          1HD1      LEU 127  17.153  19.283 -34.711
  982   HD12  LEU 127          2HD1      LEU 127  18.324  18.719 -33.504
  983   HD13  LEU 127          3HD1      LEU 127  17.971  17.723 -34.910
  984   HD21  LEU 127          3HD2      LEU 127  15.430  19.582 -32.842
  985   HD22  LEU 127          1HD2      LEU 127  15.127  18.223 -31.738
  986   HD23  LEU 127          2HD2      LEU 127  16.690  19.043 -31.703
  987    H    ILE 128           H        ILE 128  16.708  14.364 -36.746
  988    HA   ILE 128           HA       ILE 128  16.608  12.238 -34.962
  989    HB   ILE 128           HB       ILE 128  18.074  11.051 -36.398
  990   HG12  ILE 128          2HG1      ILE 128  19.909  12.561 -36.728
  991   HG13  ILE 128          3HG1      ILE 128  19.318  11.915 -38.244
  992   HG21  ILE 128          1HG2      ILE 128  16.255  12.858 -38.035
  993   HG22  ILE 128          2HG2      ILE 128  16.960  11.347 -38.589
  994   HG23  ILE 128          3HG2      ILE 128  15.831  11.352 -37.228
  995   HD11  ILE 128          3HD1      ILE 128  18.225  14.078 -38.772
  996   HD12  ILE 128          1HD1      ILE 128  18.828  14.746 -37.231
  997   HD13  ILE 128          2HD1      ILE 128  19.963  14.250 -38.481
  998    H    LYS 129           H        LYS 129  18.729  14.896 -34.623
  999    HA   LYS 129           HA       LYS 129  20.809  13.713 -33.106
 1000    HB2  LYS 129           2HB      LYS 129  20.643  16.105 -33.868
 1001    HB3  LYS 129           3HB      LYS 129  19.387  16.383 -32.649
 1002    HG2  LYS 129           2HG      LYS 129  20.997  15.855 -30.851
 1003    HG3  LYS 129           3HG      LYS 129  22.243  15.473 -32.056
 1004    HD2  LYS 129           2HD      LYS 129  22.167  17.813 -32.875
 1005    HD3  LYS 129           3HD      LYS 129  20.906  18.192 -31.673
 1006    HE2  LYS 129           2HE      LYS 129  22.472  17.572 -29.844
 1007    HE3  LYS 129           3HE      LYS 129  23.726  17.193 -31.037
 1008    HZ1  LYS 129           3HZ      LYS 129  23.685  19.508 -31.722
 1009    HZ2  LYS 129           1HZ      LYS 129  22.525  19.865 -30.610
 1010    HZ3  LYS 129           2HZ      LYS 129  24.017  19.394 -30.118
 1011    H    LYS 130           H        LYS 130  17.365  14.395 -32.171
 1012    HA   LYS 130           HA       LYS 130  17.714  12.619 -29.906
 1013    HB2  LYS 130           2HB      LYS 130  18.362  14.962 -29.082
 1014    HB3  LYS 130           3HB      LYS 130  16.740  15.481 -29.514
 1015    HG2  LYS 130           2HG      LYS 130  16.361  15.028 -27.321
 1016    HG3  LYS 130           3HG      LYS 130  16.036  13.415 -27.930
 1017    HD2  LYS 130           2HD      LYS 130  18.648  14.407 -26.698
 1018    HD3  LYS 130           3HD      LYS 130  17.432  13.395 -25.909
 1019    HE2  LYS 130           2HE      LYS 130  17.832  11.618 -27.635
 1020    HE3  LYS 130           3HE      LYS 130  19.108  12.621 -28.339
 1021    HZ1  LYS 130           3HZ      LYS 130  20.293  12.484 -26.249
 1022    HZ2  LYS 130           1HZ      LYS 130  19.106  11.546 -25.584
 1023    HZ3  LYS 130           2HZ      LYS 130  20.008  10.984 -26.837
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1  -5.560 -24.818  -9.875
    2    H2   MET   1           H2       MET   1  -5.790 -25.312  -8.348
    3    H3   MET   1           H3       MET   1  -6.018 -26.383  -9.600
    4    HA   MET   1           HA       MET   1  -3.737 -25.948  -8.147
    5    HB2  MET   1           2HB      MET   1  -4.572 -28.120  -9.096
    6    HB3  MET   1           3HB      MET   1  -4.132 -27.553 -10.715
    7    HG2  MET   1           2HG      MET   1  -1.776 -27.422 -10.057
    8    HG3  MET   1           3HG      MET   1  -2.193 -27.833  -8.391
    9    HE1  MET   1           3HE      MET   1  -3.336 -29.416 -11.894
   10    HE2  MET   1           1HE      MET   1  -1.584 -29.125 -12.039
   11    HE3  MET   1           2HE      MET   1  -2.210 -30.785 -11.979
   12    H    ALA   2           H        ALA   2  -1.771 -25.010  -8.596
   13    HA   ALA   2           HA       ALA   2  -1.218 -23.880 -11.261
   14    HB1  ALA   2           1HB      ALA   2  -1.206 -22.293  -8.653
   15    HB2  ALA   2           2HB      ALA   2  -0.585 -21.720 -10.215
   16    HB3  ALA   2           3HB      ALA   2  -2.311 -22.051 -10.022
   17    H    ALA   3           H        ALA   3   1.107 -23.156 -11.325
   18    HA   ALA   3           HA       ALA   3   2.922 -25.086 -10.290
   19    HB1  ALA   3           1HB      ALA   3   3.432 -22.264 -11.348
   20    HB2  ALA   3           2HB      ALA   3   4.660 -23.531 -11.146
   21    HB3  ALA   3           3HB      ALA   3   3.355 -23.748 -12.326
   22    H    LYS   4           H        LYS   4   4.544 -24.903  -8.678
   23    HA   LYS   4           HA       LYS   4   3.823 -23.452  -6.298
   24    HB2  LYS   4           2HB      LYS   4   5.977 -24.293  -5.409
   25    HB3  LYS   4           3HB      LYS   4   4.952 -25.570  -6.070
   26    HG2  LYS   4           2HG      LYS   4   6.350 -25.965  -7.900
   27    HG3  LYS   4           3HG      LYS   4   7.067 -24.361  -7.859
   28    HD2  LYS   4           2HD      LYS   4   8.286 -24.940  -5.764
   29    HD3  LYS   4           3HD      LYS   4   7.656 -26.605  -5.906
   30    HE2  LYS   4           2HE      LYS   4   8.679 -26.792  -8.158
   31    HE3  LYS   4           3HE      LYS   4   9.277 -25.123  -8.032
   32    HZ1  LYS   4           3HZ      LYS   4  10.703 -25.781  -6.216
   33    HZ2  LYS   4           1HZ      LYS   4  10.124 -27.344  -6.274
   34    HZ3  LYS   4           2HZ      LYS   4  11.006 -26.679  -7.496
   35    H    PHE   5           H        PHE   5   5.991 -22.735  -8.935
   36    HA   PHE   5           HA       PHE   5   7.520 -21.165  -9.399
   37    HB2  PHE   5           2HB      PHE   5   6.011 -19.398  -7.445
   38    HB3  PHE   5           3HB      PHE   5   7.243 -18.864  -8.563
   39    HD1  PHE   5           HD2      PHE   5   3.811 -20.260  -8.299
   40    HD2  PHE   5           HD1      PHE   5   6.735 -18.461 -10.901
   41    HE1  PHE   5           HE2      PHE   5   2.089 -19.999 -10.058
   42    HE2  PHE   5           HE1      PHE   5   4.987 -18.145 -12.628
   43    HZ   PHE   5           HZ       PHE   5   2.668 -18.919 -12.225
   44    H    GLU   6           H        GLU   6   9.461 -19.965  -8.572
   45    HA   GLU   6           HA       GLU   6  10.294 -20.515  -5.860
   46    HB2  GLU   6           2HB      GLU   6  10.642 -22.684  -7.276
   47    HB3  GLU   6           3HB      GLU   6  11.930 -21.785  -8.086
   48    HG2  GLU   6           2HG      GLU   6  13.141 -21.525  -6.002
   49    HG3  GLU   6           3HG      GLU   6  11.777 -22.119  -5.057
   50    H    VAL   7           H        VAL   7  12.191 -19.283  -5.379
   51    HA   VAL   7           HA       VAL   7  12.448 -16.819  -6.643
   52    HB   VAL   7           HB       VAL   7  14.439 -16.524  -5.225
   53   HG11  VAL   7          1HG1      VAL   7  12.121 -17.987  -3.856
   54   HG12  VAL   7          2HG1      VAL   7  13.287 -16.920  -3.061
   55   HG13  VAL   7          3HG1      VAL   7  12.191 -16.278  -4.306
   56   HG21  VAL   7          3HG2      VAL   7  14.140 -19.473  -4.486
   57   HG22  VAL   7          1HG2      VAL   7  15.490 -18.751  -5.380
   58   HG23  VAL   7          2HG2      VAL   7  15.206 -18.287  -3.699
   59    H    GLY   8           H        GLY   8  13.597 -15.916  -8.159
   60    HA2  GLY   8           2HA      GLY   8  15.229 -15.634  -9.750
   61    HA3  GLY   8           3HA      GLY   8  15.891 -17.239  -9.396
   62    H    SER   9           H        SER   9  12.783 -18.162  -9.831
   63    HA   SER   9           HA       SER   9  12.970 -18.753 -12.619
   64    HB2  SER   9           2HB      SER   9  10.425 -18.555 -10.964
   65    HB3  SER   9           3HB      SER   9  10.721 -19.530 -12.420
   66    HG   SER   9           HG       SER   9  10.861 -20.746 -10.442
   67    H    VAL  10           H        VAL  10  11.368 -17.961 -14.288
   68    HA   VAL  10           HA       VAL  10  10.554 -15.145 -13.951
   69    HB   VAL  10           HB       VAL  10  12.176 -16.178 -16.316
   70   HG11  VAL  10          1HG1      VAL  10  11.182 -13.370 -15.618
   71   HG12  VAL  10          2HG1      VAL  10  12.201 -13.793 -17.009
   72   HG13  VAL  10          3HG1      VAL  10  10.547 -14.402 -16.915
   73   HG21  VAL  10          3HG2      VAL  10  13.037 -14.239 -14.136
   74   HG22  VAL  10          1HG2      VAL  10  13.675 -15.881 -14.375
   75   HG23  VAL  10          2HG2      VAL  10  13.960 -14.647 -15.596
   76    H    TYR  11           H        TYR  11   8.572 -14.879 -14.681
   77    HA   TYR  11           HA       TYR  11   7.407 -16.654 -16.758
   78    HB2  TYR  11           2HB      TYR  11   6.379 -16.214 -13.933
   79    HB3  TYR  11           3HB      TYR  11   5.336 -16.768 -15.226
   80    HD1  TYR  11           HD1      TYR  11   5.649 -19.000 -16.288
   81    HD2  TYR  11           HD2      TYR  11   8.012 -17.732 -12.919
   82    HE1  TYR  11           HE1      TYR  11   6.257 -21.352 -15.851
   83    HE2  TYR  11           HE2      TYR  11   8.577 -20.110 -12.429
   84    HH   TYR  11           HH       TYR  11   7.410 -22.807 -14.467
   85    H    THR  12           H        THR  12   4.938 -15.651 -16.981
   86    HA   THR  12           HA       THR  12   5.199 -12.688 -17.061
   87    HB   THR  12           HB       THR  12   3.791 -14.504 -19.049
   88    HG1  THR  12           1HG      THR  12   5.487 -13.921 -20.417
   89   HG21  THR  12          1HG2      THR  12   4.426 -11.524 -19.169
   90   HG22  THR  12          2HG2      THR  12   3.655 -12.476 -20.458
   91   HG23  THR  12          3HG2      THR  12   2.817 -12.221 -18.929
   92    H    GLY  13           H        GLY  13   3.326 -11.518 -16.576
   93    HA2  GLY  13           2HA      GLY  13   0.893 -12.890 -15.678
   94    HA3  GLY  13           3HA      GLY  13   1.845 -12.072 -14.424
   95    H    LYS  14           H        LYS  14  -0.479 -10.953 -14.551
   96    HA   LYS  14           HA       LYS  14  -0.153  -8.534 -16.280
   97    HB2  LYS  14           2HB      LYS  14  -2.643 -10.152 -15.682
   98    HB3  LYS  14           3HB      LYS  14  -2.741  -8.424 -16.082
   99    HG2  LYS  14           2HG      LYS  14  -1.494  -8.831 -18.185
  100    HG3  LYS  14           3HG      LYS  14  -1.432 -10.566 -17.815
  101    HD2  LYS  14           2HD      LYS  14  -3.921 -10.635 -17.839
  102    HD3  LYS  14           3HD      LYS  14  -3.951  -8.900 -18.253
  103    HE2  LYS  14           2HE      LYS  14  -2.669  -9.369 -20.325
  104    HE3  LYS  14           3HE      LYS  14  -2.599 -11.085 -19.918
  105    HZ1  LYS  14           3HZ      LYS  14  -5.010 -11.157 -20.084
  106    HZ2  LYS  14           1HZ      LYS  14  -5.069  -9.546 -20.467
  107    HZ3  LYS  14           2HZ      LYS  14  -4.344 -10.620 -21.478
  108    H    VAL  15           H        VAL  15  -0.384  -6.613 -15.371
  109    HA   VAL  15           HA       VAL  15   0.008  -6.472 -12.529
  110    HB   VAL  15           HB       VAL  15  -0.561  -4.189 -14.432
  111   HG11  VAL  15          1HG1      VAL  15   1.130  -4.402 -11.890
  112   HG12  VAL  15          2HG1      VAL  15   0.925  -2.936 -12.870
  113   HG13  VAL  15          3HG1      VAL  15  -0.460  -3.621 -12.010
  114   HG21  VAL  15          3HG2      VAL  15   2.143  -5.515 -13.978
  115   HG22  VAL  15          1HG2      VAL  15   1.224  -5.489 -15.493
  116   HG23  VAL  15          2HG2      VAL  15   1.852  -3.995 -14.855
  117    H    THR  16           H        THR  16  -1.502  -6.312 -10.999
  118    HA   THR  16           HA       THR  16  -4.336  -5.935 -11.796
  119    HB   THR  16           HB       THR  16  -4.583  -7.272  -9.540
  120    HG1  THR  16           1HG      THR  16  -2.807  -8.667  -9.238
  121   HG21  THR  16          1HG2      THR  16  -3.508  -8.583 -12.077
  122   HG22  THR  16          2HG2      THR  16  -4.447  -9.380 -10.795
  123   HG23  THR  16          3HG2      THR  16  -5.199  -8.131 -11.775
  124    H    GLY  17           H        GLY  17  -1.837  -4.332 -10.042
  125    HA2  GLY  17           2HA      GLY  17  -3.616  -2.162  -9.607
  126    HA3  GLY  17           3HA      GLY  17  -3.345  -2.983  -8.066
  127    H    LEU  18           H        LEU  18  -2.543  -0.414  -8.310
  128    HA   LEU  18           HA       LEU  18   0.422  -0.637  -8.140
  129    HB2  LEU  18           2HB      LEU  18  -1.234   1.775  -8.961
  130    HB3  LEU  18           3HB      LEU  18   0.499   1.789  -8.672
  131    HG   LEU  18           HG       LEU  18  -0.928   0.333 -10.930
  132   HD11  LEU  18          1HD1      LEU  18   0.930   2.747 -10.946
  133   HD12  LEU  18          2HD1      LEU  18   0.256   1.957 -12.383
  134   HD13  LEU  18          3HD1      LEU  18  -0.816   2.772 -11.233
  135   HD21  LEU  18          3HD2      LEU  18   2.058   0.513 -10.398
  136   HD22  LEU  18          1HD2      LEU  18   1.042  -0.947 -10.270
  137   HD23  LEU  18          2HD2      LEU  18   1.288  -0.191 -11.842
  138    H    GLN  19           H        GLN  19   1.297   0.677  -6.451
  139    HA   GLN  19           HA       GLN  19  -0.476   2.016  -4.536
  140    HB2  GLN  19           2HB      GLN  19   1.581  -0.082  -3.705
  141    HB3  GLN  19           3HB      GLN  19   0.592   0.913  -2.638
  142    HG2  GLN  19           2HG      GLN  19  -1.457  -0.241  -3.470
  143    HG3  GLN  19           3HG      GLN  19  -0.439  -1.296  -4.464
  144   HE21  GLN  19          2HE2      GLN  19   1.354  -2.515  -3.236
  145   HE22  GLN  19          1HE2      GLN  19   0.902  -3.094  -1.630
  146    H    ALA  20           H        ALA  20   0.820   3.543  -3.276
  147    HA   ALA  20           HA       ALA  20   2.969   4.772  -4.545
  148    HB1  ALA  20           1HB      ALA  20   2.311   4.781  -1.571
  149    HB2  ALA  20           2HB      ALA  20   3.256   6.011  -2.442
  150    HB3  ALA  20           3HB      ALA  20   1.530   5.790  -2.812
  151    H    TYR  21           H        TYR  21   3.269   1.753  -3.021
  152    HA   TYR  21           HA       TYR  21   6.231   2.059  -2.888
  153    HB2  TYR  21           2HB      TYR  21   6.331   0.768  -0.900
  154    HB3  TYR  21           3HB      TYR  21   5.225   2.099  -0.629
  155    HD1  TYR  21           HD1      TYR  21   2.766   1.678  -0.376
  156    HD2  TYR  21           HD2      TYR  21   5.571  -1.554  -0.908
  157    HE1  TYR  21           HE1      TYR  21   1.058   0.073   0.420
  158    HE2  TYR  21           HE2      TYR  21   3.864  -3.169  -0.113
  159    HH   TYR  21           HH       TYR  21   0.571  -2.147   0.842
  160    H    GLY  22           H        GLY  22   3.915   0.527  -4.715
  161    HA2  GLY  22           2HA      GLY  22   5.694  -1.118  -6.013
  162    HA3  GLY  22           3HA      GLY  22   5.036  -2.136  -4.727
  163    H    ALA  23           H        ALA  23   4.505  -3.151  -7.052
  164    HA   ALA  23           HA       ALA  23   1.677  -2.388  -7.713
  165    HB1  ALA  23           1HB      ALA  23   3.878  -3.261  -9.628
  166    HB2  ALA  23           2HB      ALA  23   2.178  -3.009 -10.046
  167    HB3  ALA  23           3HB      ALA  23   3.170  -1.634  -9.524
  168    H    PHE  24           H        PHE  24   0.276  -4.075  -7.987
  169    HA   PHE  24           HA       PHE  24   1.224  -6.744  -7.147
  170    HB2  PHE  24           2HB      PHE  24  -1.558  -5.674  -7.773
  171    HB3  PHE  24           3HB      PHE  24  -1.198  -7.297  -7.205
  172    HD1  PHE  24           HD2      PHE  24   0.520  -7.177  -4.993
  173    HD2  PHE  24           HD1      PHE  24  -2.505  -4.319  -6.123
  174    HE1  PHE  24           HE2      PHE  24   0.298  -6.469  -2.626
  175    HE2  PHE  24           HE1      PHE  24  -2.719  -3.615  -3.756
  176    HZ   PHE  24           HZ       PHE  24  -1.338  -4.698  -2.004
  177    H    VAL  25           H        VAL  25   1.363  -8.469  -8.550
  178    HA   VAL  25           HA       VAL  25   0.277  -8.196 -11.296
  179    HB   VAL  25           HB       VAL  25   3.028  -9.314 -10.643
  180   HG11  VAL  25          1HG1      VAL  25   1.663  -8.726 -13.301
  181   HG12  VAL  25          2HG1      VAL  25   3.310  -9.329 -13.108
  182   HG13  VAL  25          3HG1      VAL  25   1.947 -10.340 -12.615
  183   HG21  VAL  25          3HG2      VAL  25   2.365  -6.656 -11.954
  184   HG22  VAL  25          1HG2      VAL  25   3.125  -6.876 -10.364
  185   HG23  VAL  25          2HG2      VAL  25   3.984  -7.378 -11.812
  186    H    ALA  26           H        ALA  26  -1.124  -9.767 -11.556
  187    HA   ALA  26           HA       ALA  26  -1.037 -12.203  -9.919
  188    HB1  ALA  26           1HB      ALA  26  -2.988 -11.262 -12.039
  189    HB2  ALA  26           2HB      ALA  26  -3.177 -12.704 -11.006
  190    HB3  ALA  26           3HB      ALA  26  -3.169 -11.094 -10.272
  191    H    LEU  27           H        LEU  27  -0.900 -14.265 -10.764
  192    HA   LEU  27           HA       LEU  27   0.685 -14.523 -13.296
  193    HB2  LEU  27           2HB      LEU  27   0.897 -15.833 -10.559
  194    HB3  LEU  27           3HB      LEU  27   1.624 -16.555 -11.981
  195    HG   LEU  27           HG       LEU  27   2.284 -13.711 -11.112
  196   HD11  LEU  27          1HD1      LEU  27   3.727 -16.297 -10.378
  197   HD12  LEU  27          2HD1      LEU  27   4.308 -14.655 -10.042
  198   HD13  LEU  27          3HD1      LEU  27   2.839 -15.251  -9.263
  199   HD21  LEU  27          3HD2      LEU  27   3.763 -15.728 -12.869
  200   HD22  LEU  27          1HD2      LEU  27   2.879 -14.306 -13.445
  201   HD23  LEU  27          2HD2      LEU  27   4.324 -14.095 -12.452
  202    H    ASP  28           H        ASP  28  -1.897 -15.764 -11.219
  203    HA   ASP  28           HA       ASP  28  -3.066 -17.388 -13.328
  204    HB2  ASP  28           2HB      ASP  28  -1.411 -18.944 -12.386
  205    HB3  ASP  28           3HB      ASP  28  -1.997 -18.619 -10.754
  206    H    GLU  29           H        GLU  29  -5.251 -18.127 -12.496
  207    HA   GLU  29           HA       GLU  29  -6.736 -16.234 -11.039
  208    HB2  GLU  29           2HB      GLU  29  -7.159 -19.190 -11.600
  209    HB3  GLU  29           3HB      GLU  29  -8.389 -18.144 -10.863
  210    HG2  GLU  29           2HG      GLU  29  -8.297 -16.665 -12.880
  211    HG3  GLU  29           3HG      GLU  29  -7.136 -17.766 -13.617
  212    H    GLU  30           H        GLU  30  -4.665 -18.783  -9.795
  213    HA   GLU  30           HA       GLU  30  -5.636 -18.214  -7.027
  214    HB2  GLU  30           2HB      GLU  30  -4.350 -20.730  -8.153
  215    HB3  GLU  30           3HB      GLU  30  -4.879 -20.482  -6.484
  216    HG2  GLU  30           2HG      GLU  30  -7.225 -20.168  -7.322
  217    HG3  GLU  30           3HG      GLU  30  -6.674 -20.620  -8.935
  218    H    THR  31           H        THR  31  -3.135 -17.209  -8.942
  219    HA   THR  31           HA       THR  31  -1.267 -17.143  -6.630
  220    HB   THR  31           HB       THR  31  -0.324 -17.844  -9.433
  221    HG1  THR  31           1HG      THR  31  -0.102 -19.978  -8.602
  222   HG21  THR  31          1HG2      THR  31   0.970 -18.095  -6.678
  223   HG22  THR  31          2HG2      THR  31   1.708 -18.569  -8.212
  224   HG23  THR  31          3HG2      THR  31   1.359 -16.867  -7.906
  225    H    GLN  32           H        GLN  32  -0.344 -15.188  -6.347
  226    HA   GLN  32           HA       GLN  32  -0.092 -13.185  -8.441
  227    HB2  GLN  32           2HB      GLN  32  -2.498 -13.144  -7.918
  228    HB3  GLN  32           3HB      GLN  32  -2.159 -13.030  -6.196
  229    HG2  GLN  32           2HG      GLN  32  -1.070 -10.837  -7.934
  230    HG3  GLN  32           3HG      GLN  32  -2.815 -10.923  -7.785
  231   HE21  GLN  32          2HE2      GLN  32  -0.074  -9.543  -6.393
  232   HE22  GLN  32          1HE2      GLN  32  -0.779  -9.218  -4.813
  233    H    GLY  33           H        GLY  33   1.182 -11.383  -7.690
  234    HA2  GLY  33           2HA      GLY  33   2.329 -11.571  -4.973
  235    HA3  GLY  33           3HA      GLY  33   3.410 -11.831  -6.346
  236    H    LEU  34           H        LEU  34   4.394  -9.908  -5.186
  237    HA   LEU  34           HA       LEU  34   3.258  -7.274  -6.029
  238    HB2  LEU  34           2HB      LEU  34   2.621  -7.539  -3.757
  239    HB3  LEU  34           3HB      LEU  34   4.161  -8.286  -3.325
  240    HG   LEU  34           HG       LEU  34   5.317  -6.094  -3.621
  241   HD11  LEU  34          1HD1      LEU  34   2.498  -4.951  -3.928
  242   HD12  LEU  34          2HD1      LEU  34   4.003  -4.021  -3.727
  243   HD13  LEU  34          3HD1      LEU  34   3.755  -4.973  -5.176
  244   HD21  LEU  34          3HD2      LEU  34   2.953  -6.086  -1.694
  245   HD22  LEU  34          1HD2      LEU  34   4.552  -6.813  -1.410
  246   HD23  LEU  34          2HD2      LEU  34   4.401  -5.062  -1.575
  247    H    VAL  35           H        VAL  35   4.796  -6.141  -7.131
  248    HA   VAL  35           HA       VAL  35   7.683  -6.642  -6.545
  249    HB   VAL  35           HB       VAL  35   7.299  -6.889  -8.862
  250   HG11  VAL  35          1HG1      VAL  35   5.778  -4.263  -8.919
  251   HG12  VAL  35          2HG1      VAL  35   6.227  -5.232 -10.333
  252   HG13  VAL  35          3HG1      VAL  35   5.078  -5.881  -9.167
  253   HG21  VAL  35          3HG2      VAL  35   8.317  -4.063  -8.404
  254   HG22  VAL  35          1HG2      VAL  35   9.251  -5.548  -8.326
  255   HG23  VAL  35          2HG2      VAL  35   8.560  -5.013  -9.873
  256    H    HIS  36           H        HIS  36   8.705  -5.269  -5.258
  257    HA   HIS  36           HA       HIS  36   7.333  -2.986  -4.155
  258    HB2  HIS  36           2HB      HIS  36  10.311  -3.462  -3.995
  259    HB3  HIS  36           3HB      HIS  36   9.256  -2.669  -2.832
  260    HD1  HIS  36           HD1      HIS  36  11.087  -5.696  -3.235
  261    HD2  HIS  36           HD2      HIS  36   7.226  -4.728  -1.830
  262    HE1  HIS  36           HE1      HIS  36  10.296  -7.668  -1.809
  263    H    ILE  37           H        ILE  37   7.887  -0.774  -4.489
  264    HA   ILE  37           HA       ILE  37   8.245   0.039  -7.135
  265    HB   ILE  37           HB       ILE  37   7.137   1.326  -5.372
  266   HG12  ILE  37          2HG1      ILE  37   9.328   2.913  -6.715
  267   HG13  ILE  37          3HG1      ILE  37   7.882   2.280  -7.528
  268   HG21  ILE  37          1HG2      ILE  37   9.948   1.979  -4.369
  269   HG22  ILE  37          2HG2      ILE  37   8.465   2.744  -3.808
  270   HG23  ILE  37          3HG2      ILE  37   8.719   1.035  -3.496
  271   HD11  ILE  37          3HD1      ILE  37   6.429   3.612  -6.028
  272   HD12  ILE  37          1HD1      ILE  37   7.862   4.278  -5.223
  273   HD13  ILE  37          2HD1      ILE  37   7.572   4.640  -6.921
  274    H    SER  38           H        SER  38  10.865  -0.410  -4.743
  275    HA   SER  38           HA       SER  38  12.909   0.740  -6.346
  276    HB2  SER  38           2HB      SER  38  14.350  -0.731  -4.820
  277    HB3  SER  38           3HB      SER  38  13.289   0.455  -4.037
  278    HG   SER  38           HG       SER  38  13.229  -1.718  -3.115
  279    H    GLU  39           H        GLU  39  11.275  -2.330  -6.602
  280    HA   GLU  39           HA       GLU  39  13.363  -3.455  -8.362
  281    HB2  GLU  39           2HB      GLU  39  10.982  -4.552  -6.838
  282    HB3  GLU  39           3HB      GLU  39  11.681  -5.441  -8.182
  283    HG2  GLU  39           2HG      GLU  39  12.711  -6.366  -6.368
  284    HG3  GLU  39           3HG      GLU  39  13.926  -5.306  -7.010
  285    H    VAL  40           H        VAL  40  10.787  -1.393  -8.823
  286    HA   VAL  40           HA       VAL  40   9.625  -2.574 -11.178
  287    HB   VAL  40           HB       VAL  40   9.639   0.236 -10.047
  288   HG11  VAL  40          1HG1      VAL  40   7.960  -0.809 -12.358
  289   HG12  VAL  40          2HG1      VAL  40   7.765   0.767 -11.547
  290   HG13  VAL  40          3HG1      VAL  40   9.227   0.413 -12.467
  291   HG21  VAL  40          3HG2      VAL  40   7.498  -1.950 -10.140
  292   HG22  VAL  40          1HG2      VAL  40   8.415  -1.452  -8.710
  293   HG23  VAL  40          2HG2      VAL  40   7.296  -0.324  -9.461
  294    H    THR  41           H        THR  41  12.537  -0.556 -10.677
  295    HA   THR  41           HA       THR  41  13.316  -0.995 -13.475
  296    HB   THR  41           HB       THR  41  12.721   1.755 -12.311
  297    HG1  THR  41           1HG      THR  41  11.320   1.834 -14.172
  298   HG21  THR  41          1HG2      THR  41  13.922   1.101 -15.036
  299   HG22  THR  41          2HG2      THR  41  13.393   2.706 -14.482
  300   HG23  THR  41          3HG2      THR  41  14.765   1.924 -13.701
  301    H    HIS  42           H        HIS  42  15.572  -0.546 -13.767
  302    HA   HIS  42           HA       HIS  42  17.227  -0.924 -11.420
  303    HB2  HIS  42           2HB      HIS  42  19.026  -1.158 -13.104
  304    HB3  HIS  42           3HB      HIS  42  17.647  -2.186 -13.458
  305    HD1  HIS  42           HD1      HIS  42  18.931   1.278 -14.572
  306    HD2  HIS  42           HD2      HIS  42  16.859  -2.100 -15.990
  307    HE1  HIS  42           HE1      HIS  42  18.513   1.674 -17.074
  308    H    GLY  43           H        GLY  43  15.944   1.548 -11.174
  309    HA2  GLY  43           2HA      GLY  43  18.074   3.402 -10.745
  310    HA3  GLY  43           3HA      GLY  43  17.141   3.845 -12.186
  311    H    PHE  44           H        PHE  44  16.821   5.732 -10.426
  312    HA   PHE  44           HA       PHE  44  14.958   5.278  -8.341
  313    HB2  PHE  44           2HB      PHE  44  16.471   7.322  -8.680
  314    HB3  PHE  44           3HB      PHE  44  15.312   7.874  -9.886
  315    HD1  PHE  44           HD1      PHE  44  15.167   6.472  -6.365
  316    HD2  PHE  44           HD2      PHE  44  13.906   9.567  -9.095
  317    HE1  PHE  44           HE1      PHE  44  13.839   7.531  -4.562
  318    HE2  PHE  44           HE2      PHE  44  12.626  10.640  -7.256
  319    HZ   PHE  44           HZ       PHE  44  12.566   9.615  -5.007
  320    H    VAL  45           H        VAL  45  12.763   5.657  -8.179
  321    HA   VAL  45           HA       VAL  45  11.145   5.769 -10.668
  322    HB   VAL  45           HB       VAL  45  10.846   3.859  -8.312
  323   HG11  VAL  45          1HG1      VAL  45   9.085   4.140 -10.790
  324   HG12  VAL  45          2HG1      VAL  45   8.943   2.887  -9.556
  325   HG13  VAL  45          3HG1      VAL  45   8.612   4.570  -9.141
  326   HG21  VAL  45          3HG2      VAL  45  11.415   3.330 -11.262
  327   HG22  VAL  45          1HG2      VAL  45  12.564   3.119  -9.917
  328   HG23  VAL  45          2HG2      VAL  45  11.148   2.090 -10.012
  329    H    LYS  46           H        LYS  46  11.167   8.055 -10.107
  330    HA   LYS  46           HA       LYS  46  10.291   9.053  -7.631
  331    HB2  LYS  46           2HB      LYS  46   9.821  11.153  -8.770
  332    HB3  LYS  46           3HB      LYS  46  11.396  10.482  -9.204
  333    HG2  LYS  46           2HG      LYS  46  10.476   9.736 -11.392
  334    HG3  LYS  46           3HG      LYS  46   8.903  10.450 -10.956
  335    HD2  LYS  46           2HD      LYS  46   9.930  12.680 -10.769
  336    HD3  LYS  46           3HD      LYS  46  11.534  11.990 -11.053
  337    HE2  LYS  46           2HE      LYS  46  10.956  12.912 -13.132
  338    HE3  LYS  46           3HE      LYS  46  10.647  11.179 -13.325
  339    HZ1  LYS  46           3HZ      LYS  46   8.275  11.632 -12.972
  340    HZ2  LYS  46           1HZ      LYS  46   8.591  13.250 -12.812
  341    HZ3  LYS  46           2HZ      LYS  46   8.878  12.489 -14.215
  342    H    ASP  47           H        ASP  47   8.270   7.858 -10.274
  343    HA   ASP  47           HA       ASP  47   6.197   7.532  -8.251
  344    HB2  ASP  47           2HB      ASP  47   5.680   9.725  -9.395
  345    HB3  ASP  47           3HB      ASP  47   5.500   8.831 -10.912
  346    H    ILE  48           H        ILE  48   5.164   5.577  -8.594
  347    HA   ILE  48           HA       ILE  48   6.392   3.728 -10.393
  348    HB   ILE  48           HB       ILE  48   5.466   3.211  -8.148
  349   HG12  ILE  48          2HG1      ILE  48   4.281   1.495 -10.341
  350   HG13  ILE  48          3HG1      ILE  48   5.995   1.526  -9.888
  351   HG21  ILE  48          1HG2      ILE  48   2.736   3.415  -9.496
  352   HG22  ILE  48          2HG2      ILE  48   3.028   2.783  -7.880
  353   HG23  ILE  48          3HG2      ILE  48   3.346   4.469  -8.205
  354   HD11  ILE  48          3HD1      ILE  48   5.425   0.810  -7.585
  355   HD12  ILE  48          1HD1      ILE  48   3.706   0.744  -8.031
  356   HD13  ILE  48          2HD1      ILE  48   4.856  -0.350  -8.796
  357    H    ASN  49           H        ASN  49   3.411   5.682 -10.800
  358    HA   ASN  49           HA       ASN  49   2.491   4.026 -12.976
  359    HB2  ASN  49           2HB      ASN  49   0.671   5.335 -13.000
  360    HB3  ASN  49           3HB      ASN  49   1.291   5.950 -11.472
  361   HD21  ASN  49          2HD2      ASN  49   2.738   7.927 -11.622
  362   HD22  ASN  49          1HD2      ASN  49   2.315   9.124 -12.809
  363    H    GLU  50           H        GLU  50   4.990   6.412 -12.859
  364    HA   GLU  50           HA       GLU  50   5.005   6.840 -15.751
  365    HB2  GLU  50           2HB      GLU  50   7.019   7.430 -13.550
  366    HB3  GLU  50           3HB      GLU  50   7.282   7.825 -15.252
  367    HG2  GLU  50           2HG      GLU  50   5.221   9.240 -15.209
  368    HG3  GLU  50           3HG      GLU  50   5.054   8.915 -13.478
  369    H    HIS  51           H        HIS  51   5.864   4.165 -13.821
  370    HA   HIS  51           HA       HIS  51   7.945   3.241 -15.760
  371    HB2  HIS  51           2HB      HIS  51   7.955   2.984 -12.734
  372    HB3  HIS  51           3HB      HIS  51   9.149   2.290 -13.827
  373    HD1  HIS  51           HD1      HIS  51   8.016   5.703 -12.468
  374    HD2  HIS  51           HD2      HIS  51  11.131   3.909 -14.662
  375    HE1  HIS  51           HE1      HIS  51   9.799   7.473 -12.745
  376    H    LEU  52           H        LEU  52   5.031   2.415 -14.013
  377    HA   LEU  52           HA       LEU  52   4.904  -0.043 -15.598
  378    HB2  LEU  52           2HB      LEU  52   5.698  -0.384 -13.027
  379    HB3  LEU  52           3HB      LEU  52   3.968  -0.229 -12.743
  380    HG   LEU  52           HG       LEU  52   3.719  -2.065 -14.612
  381   HD11  LEU  52          1HD1      LEU  52   6.639  -2.462 -13.846
  382   HD12  LEU  52          2HD1      LEU  52   5.661  -3.572 -14.824
  383   HD13  LEU  52          3HD1      LEU  52   6.058  -1.958 -15.437
  384   HD21  LEU  52          3HD2      LEU  52   4.958  -2.750 -11.929
  385   HD22  LEU  52          1HD2      LEU  52   3.236  -2.470 -12.263
  386   HD23  LEU  52          2HD2      LEU  52   4.048  -3.865 -12.983
  387    H    SER  53           H        SER  53   2.496  -0.946 -15.188
  388    HA   SER  53           HA       SER  53   0.543   1.261 -15.073
  389    HB2  SER  53           2HB      SER  53   1.028  -0.491 -17.528
  390    HB3  SER  53           3HB      SER  53  -0.261   0.709 -17.328
  391    HG   SER  53           HG       SER  53   1.542   1.504 -18.508
  392    H    VAL  54           H        VAL  54  -1.227   0.373 -14.001
  393    HA   VAL  54           HA       VAL  54  -1.683  -2.457 -13.715
  394    HB   VAL  54           HB       VAL  54  -2.472  -0.875 -12.071
  395   HG11  VAL  54          1HG1      VAL  54  -4.347   0.235 -14.195
  396   HG12  VAL  54          2HG1      VAL  54  -4.387   0.638 -12.470
  397   HG13  VAL  54          3HG1      VAL  54  -2.992   1.100 -13.448
  398   HG21  VAL  54          3HG2      VAL  54  -4.783  -2.275 -13.435
  399   HG22  VAL  54          1HG2      VAL  54  -3.678  -2.947 -12.215
  400   HG23  VAL  54          2HG2      VAL  54  -4.788  -1.632 -11.790
  401    H    GLY  55           H        GLY  55  -3.157  -3.802 -14.697
  402    HA2  GLY  55           2HA      GLY  55  -4.461  -4.630 -16.349
  403    HA3  GLY  55           3HA      GLY  55  -4.825  -2.973 -16.877
  404    H    ASP  56           H        ASP  56  -1.510  -4.273 -16.638
  405    HA   ASP  56           HA       ASP  56  -1.379  -4.578 -19.608
  406    HB2  ASP  56           2HB      ASP  56  -0.316  -2.444 -18.795
  407    HB3  ASP  56           3HB      ASP  56   0.752  -3.424 -17.784
  408    H    GLU  57           H        GLU  57   0.480  -6.025 -20.223
  409    HA   GLU  57           HA       GLU  57   0.742  -8.284 -18.287
  410    HB2  GLU  57           2HB      GLU  57  -0.496  -8.713 -20.401
  411    HB3  GLU  57           3HB      GLU  57   0.931  -8.214 -21.320
  412    HG2  GLU  57           2HG      GLU  57   2.223 -10.081 -20.317
  413    HG3  GLU  57           3HG      GLU  57   0.804 -10.564 -19.382
  414    H    VAL  58           H        VAL  58   2.773  -8.930 -17.682
  415    HA   VAL  58           HA       VAL  58   5.159  -7.642 -18.882
  416    HB   VAL  58           HB       VAL  58   5.897  -6.912 -16.599
  417   HG11  VAL  58          1HG1      VAL  58   3.346  -5.557 -17.589
  418   HG12  VAL  58          2HG1      VAL  58   4.535  -4.846 -16.495
  419   HG13  VAL  58          3HG1      VAL  58   4.985  -5.244 -18.161
  420   HG21  VAL  58          3HG2      VAL  58   3.006  -7.389 -15.765
  421   HG22  VAL  58          1HG2      VAL  58   4.436  -8.252 -15.165
  422   HG23  VAL  58          2HG2      VAL  58   4.242  -6.530 -14.823
  423    H    GLN  59           H        GLN  59   7.013  -8.821 -18.645
  424    HA   GLN  59           HA       GLN  59   6.898 -11.499 -17.503
  425    HB2  GLN  59           2HB      GLN  59   9.081  -9.749 -18.693
  426    HB3  GLN  59           3HB      GLN  59   9.456 -11.247 -17.835
  427    HG2  GLN  59           2HG      GLN  59   9.384 -11.775 -20.164
  428    HG3  GLN  59           3HG      GLN  59   7.995 -12.516 -19.388
  429   HE21  GLN  59          2HE2      GLN  59   6.190 -12.350 -20.635
  430   HE22  GLN  59          1HE2      GLN  59   5.789 -11.020 -21.727
  431    H    VAL  60           H        VAL  60   7.650 -12.052 -15.453
  432    HA   VAL  60           HA       VAL  60   8.780  -9.954 -13.668
  433    HB   VAL  60           HB       VAL  60   7.380 -11.229 -11.869
  434   HG11  VAL  60          1HG1      VAL  60   6.054  -9.286 -13.785
  435   HG12  VAL  60          2HG1      VAL  60   5.505  -9.648 -12.136
  436   HG13  VAL  60          3HG1      VAL  60   7.073  -8.880 -12.378
  437   HG21  VAL  60          3HG2      VAL  60   5.608 -11.798 -14.287
  438   HG22  VAL  60          1HG2      VAL  60   6.429 -13.005 -13.266
  439   HG23  VAL  60          2HG2      VAL  60   5.161 -11.969 -12.586
  440    H    LYS  61           H        LYS  61  10.501 -10.604 -12.515
  441    HA   LYS  61           HA       LYS  61  11.235 -13.486 -12.562
  442    HB2  LYS  61           2HB      LYS  61  13.016 -11.827 -13.029
  443    HB3  LYS  61           3HB      LYS  61  12.709 -11.067 -11.461
  444    HG2  LYS  61           2HG      LYS  61  13.249 -13.314 -10.374
  445    HG3  LYS  61           3HG      LYS  61  13.699 -13.904 -11.969
  446    HD2  LYS  61           2HD      LYS  61  15.699 -13.338 -10.822
  447    HD3  LYS  61           3HD      LYS  61  15.461 -12.094 -12.057
  448    HE2  LYS  61           2HE      LYS  61  14.548 -10.562 -10.376
  449    HE3  LYS  61           3HE      LYS  61  14.619 -11.827  -9.130
  450    HZ1  LYS  61           3HZ      LYS  61  17.021 -11.815  -9.347
  451    HZ2  LYS  61           1HZ      LYS  61  16.958 -10.652 -10.507
  452    HZ3  LYS  61           2HZ      LYS  61  16.488 -10.318  -8.959
  453    H    VAL  62           H        VAL  62  10.753 -14.758 -10.827
  454    HA   VAL  62           HA       VAL  62   9.338 -13.813  -8.523
  455    HB   VAL  62           HB       VAL  62  10.899 -16.393  -8.906
  456   HG11  VAL  62          1HG1      VAL  62   8.568 -15.662  -7.065
  457   HG12  VAL  62          2HG1      VAL  62   9.301 -17.271  -7.208
  458   HG13  VAL  62          3HG1      VAL  62  10.239 -15.928  -6.550
  459   HG21  VAL  62          3HG2      VAL  62   7.964 -15.803  -9.522
  460   HG22  VAL  62          1HG2      VAL  62   9.231 -16.142 -10.722
  461   HG23  VAL  62          2HG2      VAL  62   8.753 -17.399  -9.587
  462    H    LEU  63           H        LEU  63  10.122 -12.608  -6.962
  463    HA   LEU  63           HA       LEU  63  13.040 -12.392  -6.520
  464    HB2  LEU  63           2HB      LEU  63  11.570 -10.393  -6.844
  465    HB3  LEU  63           3HB      LEU  63  10.677 -10.850  -5.394
  466    HG   LEU  63           HG       LEU  63  12.841 -10.614  -4.071
  467   HD11  LEU  63          1HD1      LEU  63  13.763  -9.244  -6.643
  468   HD12  LEU  63          2HD1      LEU  63  14.625  -9.244  -5.086
  469   HD13  LEU  63          3HD1      LEU  63  14.441 -10.763  -5.973
  470   HD21  LEU  63          3HD2      LEU  63  11.730  -8.178  -5.519
  471   HD22  LEU  63          1HD2      LEU  63  11.072  -8.912  -4.059
  472   HD23  LEU  63          2HD2      LEU  63  12.663  -8.145  -4.006
  473    H    ALA  64           H        ALA  64  10.044 -13.362  -4.804
  474    HA   ALA  64           HA       ALA  64  11.582 -14.946  -2.872
  475    HB1  ALA  64           1HB      ALA  64   9.822 -12.664  -1.938
  476    HB2  ALA  64           2HB      ALA  64  10.519 -13.911  -0.914
  477    HB3  ALA  64           3HB      ALA  64  11.588 -12.769  -1.753
  478    H    VAL  65           H        VAL  65  10.150 -16.434  -1.725
  479    HA   VAL  65           HA       VAL  65   7.273 -16.416  -2.422
  480    HB   VAL  65           HB       VAL  65   9.118 -18.843  -2.600
  481   HG11  VAL  65          1HG1      VAL  65   6.111 -18.622  -3.096
  482   HG12  VAL  65          2HG1      VAL  65   7.098 -20.064  -3.366
  483   HG13  VAL  65          3HG1      VAL  65   6.876 -19.442  -1.728
  484   HG21  VAL  65          3HG2      VAL  65   7.595 -17.437  -4.829
  485   HG22  VAL  65          1HG2      VAL  65   9.361 -17.464  -4.616
  486   HG23  VAL  65          2HG2      VAL  65   8.497 -18.962  -4.980
  487    H    ASP  66           H        ASP  66   6.062 -16.885  -0.590
  488    HA   ASP  66           HA       ASP  66   7.347 -18.197   1.728
  489    HB2  ASP  66           2HB      ASP  66   7.665 -15.722   2.027
  490    HB3  ASP  66           3HB      ASP  66   5.918 -15.529   1.992
  491    H    GLU  67           H        GLU  67   6.048 -19.953   1.440
  492    HA   GLU  67           HA       GLU  67   3.250 -19.781   0.785
  493    HB2  GLU  67           2HB      GLU  67   5.090 -22.023   1.668
  494    HB3  GLU  67           3HB      GLU  67   3.380 -22.283   1.311
  495    HG2  GLU  67           2HG      GLU  67   5.340 -21.085  -0.689
  496    HG3  GLU  67           3HG      GLU  67   4.991 -22.798  -0.572
  497    H    GLU  68           H        GLU  68   4.911 -19.471   3.845
  498    HA   GLU  68           HA       GLU  68   2.675 -20.471   5.439
  499    HB2  GLU  68           2HB      GLU  68   4.923 -18.597   6.277
  500    HB3  GLU  68           3HB      GLU  68   3.859 -19.513   7.331
  501    HG2  GLU  68           2HG      GLU  68   5.948 -20.642   5.424
  502    HG3  GLU  68           3HG      GLU  68   6.092 -20.546   7.166
  503    H    LYS  69           H        LYS  69   3.982 -17.283   4.452
  504    HA   LYS  69           HA       LYS  69   1.659 -15.756   5.344
  505    HB2  LYS  69           2HB      LYS  69   3.865 -15.199   3.303
  506    HB3  LYS  69           3HB      LYS  69   2.644 -14.010   3.791
  507    HG2  LYS  69           2HG      LYS  69   3.424 -14.092   6.123
  508    HG3  LYS  69           3HG      LYS  69   4.595 -15.360   5.710
  509    HD2  LYS  69           2HD      LYS  69   5.690 -13.771   4.100
  510    HD3  LYS  69           3HD      LYS  69   4.570 -12.513   4.637
  511    HE2  LYS  69           2HE      LYS  69   6.737 -12.265   5.742
  512    HE3  LYS  69           3HE      LYS  69   5.467 -12.637   6.925
  513    HZ1  LYS  69           3HZ      LYS  69   6.248 -14.940   6.879
  514    HZ2  LYS  69           1HZ      LYS  69   7.381 -14.615   5.798
  515    HZ3  LYS  69           2HZ      LYS  69   7.479 -13.929   7.319
  516    H    GLY  70           H        GLY  70   2.336 -17.740   2.530
  517    HA2  GLY  70           2HA      GLY  70   1.075 -18.268   0.692
  518    HA3  GLY  70           3HA      GLY  70  -0.298 -17.378   1.394
  519    H    LYS  71           H        LYS  71   3.040 -16.357   0.449
  520    HA   LYS  71           HA       LYS  71   1.881 -14.279  -1.359
  521    HB2  LYS  71           2HB      LYS  71   3.803 -13.893   0.977
  522    HB3  LYS  71           3HB      LYS  71   3.661 -12.724  -0.343
  523    HG2  LYS  71           2HG      LYS  71   1.204 -12.514   0.151
  524    HG3  LYS  71           3HG      LYS  71   1.439 -13.559   1.565
  525    HD2  LYS  71           2HD      LYS  71   3.033 -11.934   2.523
  526    HD3  LYS  71           3HD      LYS  71   2.853 -10.895   1.088
  527    HE2  LYS  71           2HE      LYS  71   0.434 -10.652   1.566
  528    HE3  LYS  71           3HE      LYS  71   0.599 -11.692   2.990
  529    HZ1  LYS  71           3HZ      LYS  71   2.071 -10.026   3.954
  530    HZ2  LYS  71           1HZ      LYS  71   1.928  -9.069   2.625
  531    HZ3  LYS  71           2HZ      LYS  71   0.626  -9.364   3.580
  532    H    ILE  72           H        ILE  72   3.363 -13.422  -2.847
  533    HA   ILE  72           HA       ILE  72   6.005 -14.691  -3.194
  534    HB   ILE  72           HB       ILE  72   3.851 -14.321  -5.339
  535   HG12  ILE  72          2HG1      ILE  72   5.212 -16.802  -4.220
  536   HG13  ILE  72          3HG1      ILE  72   3.512 -16.351  -4.048
  537   HG21  ILE  72          1HG2      ILE  72   6.745 -15.221  -5.659
  538   HG22  ILE  72          2HG2      ILE  72   5.539 -15.169  -6.957
  539   HG23  ILE  72          3HG2      ILE  72   6.075 -13.680  -6.230
  540   HD11  ILE  72          3HD1      ILE  72   3.164 -16.633  -6.469
  541   HD12  ILE  72          1HD1      ILE  72   4.850 -17.159  -6.661
  542   HD13  ILE  72          2HD1      ILE  72   3.751 -18.126  -5.701
  543    H    SER  73           H        SER  73   7.526 -13.149  -3.684
  544    HA   SER  73           HA       SER  73   6.572 -10.399  -4.331
  545    HB2  SER  73           2HB      SER  73   9.306 -11.176  -3.308
  546    HB3  SER  73           3HB      SER  73   8.625  -9.558  -3.460
  547    HG   SER  73           HG       SER  73   8.509 -10.329  -1.300
  548    H    LEU  74           H        LEU  74   7.692  -9.326  -6.043
  549    HA   LEU  74           HA       LEU  74   8.851 -11.134  -8.121
  550    HB2  LEU  74           2HB      LEU  74   6.559  -9.152  -8.395
  551    HB3  LEU  74           3HB      LEU  74   7.291 -10.043  -9.729
  552    HG   LEU  74           HG       LEU  74   5.797 -11.327  -7.390
  553   HD11  LEU  74          1HD1      LEU  74   4.882 -10.836 -10.245
  554   HD12  LEU  74          2HD1      LEU  74   3.993 -11.740  -9.010
  555   HD13  LEU  74          3HD1      LEU  74   4.287 -10.010  -8.789
  556   HD21  LEU  74          3HD2      LEU  74   6.780 -12.550 -10.007
  557   HD22  LEU  74          1HD2      LEU  74   7.451 -12.850  -8.387
  558   HD23  LEU  74          2HD2      LEU  74   5.812 -13.361  -8.757
  559    H    SER  75           H        SER  75   9.804  -9.788  -9.939
  560    HA   SER  75           HA       SER  75  10.371  -6.973  -9.262
  561    HB2  SER  75           2HB      SER  75  12.813  -7.428  -9.798
  562    HB3  SER  75           3HB      SER  75  12.213  -7.951  -8.217
  563    HG   SER  75           HG       SER  75  13.478  -9.550  -9.177
  564    H    ILE  76           H        ILE  76  11.013  -5.696 -11.019
  565    HA   ILE  76           HA       ILE  76  10.461  -6.828 -13.715
  566    HB   ILE  76           HB       ILE  76   9.635  -4.197 -12.466
  567   HG12  ILE  76          2HG1      ILE  76   8.134  -6.057 -11.906
  568   HG13  ILE  76          3HG1      ILE  76   7.367  -4.799 -12.867
  569   HG21  ILE  76          1HG2      ILE  76   9.348  -5.069 -15.364
  570   HG22  ILE  76          2HG2      ILE  76   8.596  -3.610 -14.640
  571   HG23  ILE  76          3HG2      ILE  76  10.340  -3.741 -14.768
  572   HD11  ILE  76          3HD1      ILE  76   7.552  -6.223 -14.902
  573   HD12  ILE  76          1HD1      ILE  76   8.355  -7.471 -13.918
  574   HD13  ILE  76          2HD1      ILE  76   6.665  -7.013 -13.617
  575    H    ARG  77           H        ARG  77  12.500  -4.583 -11.787
  576    HA   ARG  77           HA       ARG  77  14.085  -3.734 -13.970
  577    HB2  ARG  77           2HB      ARG  77  15.758  -3.178 -12.423
  578    HB3  ARG  77           3HB      ARG  77  14.209  -2.915 -11.613
  579    HG2  ARG  77           2HG      ARG  77  14.512  -4.960 -10.286
  580    HG3  ARG  77           3HG      ARG  77  16.029  -5.309 -11.141
  581    HD2  ARG  77           2HD      ARG  77  16.967  -3.144 -10.314
  582    HD3  ARG  77           3HD      ARG  77  15.475  -2.854  -9.423
  583    HE   ARG  77           HE       ARG  77  17.368  -5.144  -8.946
  584   HH11  ARG  77          1HH1      ARG  77  15.306  -2.523  -7.539
  585   HH12  ARG  77          2HH1      ARG  77  15.416  -3.143  -5.968
  586   HH21  ARG  77          1HH2      ARG  77  17.461  -5.918  -6.774
  587   HH22  ARG  77          2HH2      ARG  77  16.698  -5.002  -5.508
  588    H    ALA  78           H        ALA  78  13.823  -6.887 -12.668
  589    HA   ALA  78           HA       ALA  78  16.250  -7.973 -13.847
  590    HB1  ALA  78           1HB      ALA  78  13.699  -9.278 -12.792
  591    HB2  ALA  78           2HB      ALA  78  15.218 -10.110 -13.172
  592    HB3  ALA  78           3HB      ALA  78  15.164  -8.933 -11.834
  593    H    THR  79           H        THR  79  13.068  -7.180 -15.157
  594    HA   THR  79           HA       THR  79  13.453  -9.129 -17.384
  595    HB   THR  79           HB       THR  79  10.986  -9.242 -17.430
  596    HG1  THR  79           1HG      THR  79   9.838  -8.340 -15.692
  597   HG21  THR  79          1HG2      THR  79  12.097  -9.829 -14.644
  598   HG22  THR  79          2HG2      THR  79  10.628 -10.505 -15.355
  599   HG23  THR  79          3HG2      THR  79  12.193 -10.922 -16.047
  600    H    GLN  80           H        GLN  80  12.853  -5.795 -16.540
  601    HA   GLN  80           HA       GLN  80  12.719  -5.031 -19.401
  602    HB2  GLN  80           2HB      GLN  80  10.987  -3.894 -17.164
  603    HB3  GLN  80           3HB      GLN  80  11.023  -3.350 -18.843
  604    HG2  GLN  80           2HG      GLN  80  10.273  -5.709 -19.501
  605    HG3  GLN  80           3HG      GLN  80   9.958  -5.991 -17.786
  606   HE21  GLN  80          2HE2      GLN  80   8.447  -4.256 -16.706
  607   HE22  GLN  80          1HE2      GLN  80   7.115  -3.704 -17.717
  608    H    ALA  81           H        ALA  81  12.949  -2.440 -19.370
  609    HA   ALA  81           HA       ALA  81  15.217  -1.728 -17.596
  610    HB1  ALA  81           1HB      ALA  81  15.121  -1.506 -20.631
  611    HB2  ALA  81           2HB      ALA  81  16.421  -0.900 -19.591
  612    HB3  ALA  81           3HB      ALA  81  16.126  -2.644 -19.698
  613    H    ALA  82           H        ALA  82  15.716   0.547 -17.629
  614    HA   ALA  82           HA       ALA  82  13.469   2.267 -17.312
  615    HB1  ALA  82           1HB      ALA  82  16.410   2.933 -17.779
  616    HB2  ALA  82           2HB      ALA  82  15.197   4.063 -17.163
  617    HB3  ALA  82           3HB      ALA  82  15.650   2.638 -16.198
  618    HA   PRO  83           HA       PRO  83  12.834   3.692 -21.519
  619    HB2  PRO  83           2HB      PRO  83  11.880   6.251 -21.104
  620    HB3  PRO  83           3HB      PRO  83  10.905   4.780 -20.823
  621    HG2  PRO  83           2HG      PRO  83  12.457   6.428 -18.808
  622    HG3  PRO  83           3HG      PRO  83  10.791   5.797 -18.651
  623    HD2  PRO  83           2HD      PRO  83  12.958   4.530 -17.536
  624    HD3  PRO  83           3HD      PRO  83  11.576   3.607 -18.197
  625    H    GLU  84           H        GLU  84  13.690   5.324 -23.036
  626    HA   GLU  84           HA       GLU  84  16.462   5.833 -22.596
  627    HB2  GLU  84           2HB      GLU  84  14.529   6.806 -24.738
  628    HB3  GLU  84           3HB      GLU  84  16.277   7.016 -24.813
  629    HG2  GLU  84           2HG      GLU  84  14.836   4.332 -24.724
  630    HG3  GLU  84           3HG      GLU  84  15.464   5.107 -26.165
  631    H    LYS  85           H        LYS  85  13.659   7.779 -21.889
  632    HA   LYS  85           HA       LYS  85  15.315   9.971 -20.878
  633    HB2  LYS  85           2HB      LYS  85  14.849  10.483 -23.293
  634    HB3  LYS  85           3HB      LYS  85  13.119  10.368 -22.962
  635    HG2  LYS  85           2HG      LYS  85  13.851  12.688 -23.140
  636    HG3  LYS  85           3HG      LYS  85  13.221  12.354 -21.532
  637    HD2  LYS  85           2HD      LYS  85  15.445  12.330 -20.568
  638    HD3  LYS  85           3HD      LYS  85  16.195  12.294 -22.172
  639    HE2  LYS  85           2HE      LYS  85  16.440  14.509 -21.312
  640    HE3  LYS  85           3HE      LYS  85  15.248  14.569 -22.629
  641    HZ1  LYS  85           3HZ      LYS  85  13.488  14.627 -20.921
  642    HZ2  LYS  85           1HZ      LYS  85  14.613  14.574 -19.715
  643    HZ3  LYS  85           2HZ      LYS  85  14.513  15.844 -20.709
  644    H    LYS  86           H        LYS  86  14.056  11.280 -19.365
  645    HA   LYS  86           HA       LYS  86  11.278  10.434 -18.798
  646    HB2  LYS  86           2HB      LYS  86  13.426  10.993 -16.704
  647    HB3  LYS  86           3HB      LYS  86  11.718  10.663 -16.383
  648    HG2  LYS  86           2HG      LYS  86  12.007   8.375 -17.390
  649    HG3  LYS  86           3HG      LYS  86  13.741   8.713 -17.569
  650    HD2  LYS  86           2HD      LYS  86  13.830   9.136 -15.069
  651    HD3  LYS  86           3HD      LYS  86  12.152   8.541 -14.979
  652    HE2  LYS  86           2HE      LYS  86  12.910   6.404 -16.058
  653    HE3  LYS  86           3HE      LYS  86  14.582   6.999 -16.012
  654    HZ1  LYS  86           3HZ      LYS  86  14.394   7.074 -13.577
  655    HZ2  LYS  86           1HZ      LYS  86  12.855   6.505 -13.661
  656    HZ3  LYS  86           2HZ      LYS  86  14.075   5.558 -14.129
  657    H    GLU  87           H        GLU  87  10.278  12.275 -17.346
  658    HA   GLU  87           HA       GLU  87  11.464  14.935 -17.929
  659    HB2  GLU  87           2HB      GLU  87   8.596  14.056 -18.455
  660    HB3  GLU  87           3HB      GLU  87   9.145  15.727 -18.455
  661    HG2  GLU  87           2HG      GLU  87  10.003  13.531 -20.385
  662    HG3  GLU  87           3HG      GLU  87   8.925  14.877 -20.728
  663    H    SER  88           H        SER  88  10.661  16.536 -16.401
  664    HA   SER  88           HA       SER  88  10.692  15.637 -13.751
  665    HB2  SER  88           2HB      SER  88   9.577  18.294 -14.720
  666    HB3  SER  88           3HB      SER  88  10.369  17.950 -13.170
  667    HG   SER  88           HG       SER  88  11.728  18.951 -14.774
  668    H    LYS  89           H        LYS  89   7.930  16.955 -15.591
  669    HA   LYS  89           HA       LYS  89   5.904  16.084 -13.665
  670    HB2  LYS  89           2HB      LYS  89   5.723  18.173 -14.970
  671    HB3  LYS  89           3HB      LYS  89   5.842  17.252 -16.478
  672    HG2  LYS  89           2HG      LYS  89   3.678  16.090 -15.804
  673    HG3  LYS  89           3HG      LYS  89   3.544  17.232 -14.470
  674    HD2  LYS  89           2HD      LYS  89   3.004  18.992 -15.853
  675    HD3  LYS  89           3HD      LYS  89   4.024  18.436 -17.182
  676    HE2  LYS  89           2HE      LYS  89   1.387  17.122 -16.409
  677    HE3  LYS  89           3HE      LYS  89   1.548  18.365 -17.660
  678    HZ1  LYS  89           3HZ      LYS  89   3.036  16.896 -18.865
  679    HZ2  LYS  89           1HZ      LYS  89   2.903  15.726 -17.716
  680    HZ3  LYS  89           2HZ      LYS  89   1.603  16.129 -18.591
  681    HA   PRO  90           HA       PRO  90   5.330  11.992 -15.544
  682    HB2  PRO  90           2HB      PRO  90   2.410  12.609 -15.107
  683    HB3  PRO  90           3HB      PRO  90   3.310  11.098 -14.763
  684    HG2  PRO  90           2HG      PRO  90   2.709  12.843 -12.755
  685    HG3  PRO  90           3HG      PRO  90   4.306  12.042 -12.812
  686    HD2  PRO  90           2HD      PRO  90   3.588  14.858 -13.645
  687    HD3  PRO  90           3HD      PRO  90   5.049  14.266 -12.796
  688    H    ARG  91           H        ARG  91   4.549  11.100 -17.514
  689    HA   ARG  91           HA       ARG  91   4.468  13.059 -19.612
  690    HB2  ARG  91           2HB      ARG  91   4.654  11.214 -21.126
  691    HB3  ARG  91           3HB      ARG  91   5.716  10.948 -19.742
  692    HG2  ARG  91           2HG      ARG  91   4.001   9.362 -18.782
  693    HG3  ARG  91           3HG      ARG  91   3.019   9.606 -20.234
  694    HD2  ARG  91           2HD      ARG  91   4.236   7.567 -20.561
  695    HD3  ARG  91           3HD      ARG  91   4.958   8.772 -21.617
  696    HE   ARG  91           HE       ARG  91   6.883   8.853 -20.291
  697   HH11  ARG  91          1HH1      ARG  91   4.574   6.457 -18.968
  698   HH12  ARG  91          2HH1      ARG  91   5.767   5.753 -17.913
  699   HH21  ARG  91          1HH2      ARG  91   8.376   7.911 -18.779
  700   HH22  ARG  91          2HH2      ARG  91   7.836   6.569 -17.791
  701    H    LYS  92           H        LYS  92   1.837  11.664 -17.921
  702    HA   LYS  92           HA       LYS  92  -0.113  11.660 -20.000
  703    HB2  LYS  92           2HB      LYS  92  -0.421  12.238 -17.014
  704    HB3  LYS  92           3HB      LYS  92  -1.767  11.962 -18.128
  705    HG2  LYS  92           2HG      LYS  92  -0.853   9.690 -18.647
  706    HG3  LYS  92           3HG      LYS  92   0.448   9.970 -17.484
  707    HD2  LYS  92           2HD      LYS  92  -1.172   8.635 -16.365
  708    HD3  LYS  92           3HD      LYS  92  -1.253  10.250 -15.677
  709    HE2  LYS  92           2HE      LYS  92  -3.512   9.486 -15.927
  710    HE3  LYS  92           3HE      LYS  92  -3.252  10.737 -17.140
  711    HZ1  LYS  92           3HZ      LYS  92  -2.941   8.966 -18.785
  712    HZ2  LYS  92           1HZ      LYS  92  -3.189   7.827 -17.626
  713    HZ3  LYS  92           2HZ      LYS  92  -4.408   8.838 -18.051
  714    HA   PRO  93           HA       PRO  93  -0.264  15.757 -21.194
  715    HB2  PRO  93           2HB      PRO  93  -2.917  16.291 -21.819
  716    HB3  PRO  93           3HB      PRO  93  -1.783  15.332 -22.809
  717    HG2  PRO  93           2HG      PRO  93  -3.841  14.302 -20.845
  718    HG3  PRO  93           3HG      PRO  93  -3.459  13.695 -22.486
  719    HD2  PRO  93           2HD      PRO  93  -2.441  12.487 -20.267
  720    HD3  PRO  93           3HD      PRO  93  -1.444  12.674 -21.740
  721    H    LYS  94           H        LYS  94  -2.461  15.086 -18.510
  722    HA   LYS  94           HA       LYS  94  -1.888  17.813 -17.442
  723    HB2  LYS  94           2HB      LYS  94  -4.166  17.968 -16.589
  724    HB3  LYS  94           3HB      LYS  94  -4.116  17.865 -18.346
  725    HG2  LYS  94           2HG      LYS  94  -4.788  15.488 -18.264
  726    HG3  LYS  94           3HG      LYS  94  -4.761  15.531 -16.494
  727    HD2  LYS  94           2HD      LYS  94  -6.562  17.230 -16.496
  728    HD3  LYS  94           3HD      LYS  94  -6.579  17.212 -18.277
  729    HE2  LYS  94           2HE      LYS  94  -7.171  14.796 -18.235
  730    HE3  LYS  94           3HE      LYS  94  -7.177  14.827 -16.461
  731    HZ1  LYS  94           3HZ      LYS  94  -8.983  16.412 -16.556
  732    HZ2  LYS  94           1HZ      LYS  94  -8.990  16.388 -18.205
  733    HZ3  LYS  94           2HZ      LYS  94  -9.398  15.043 -17.358
  734    H    ALA  95           H        ALA  95  -0.774  15.033 -16.985
  735    HA   ALA  95           HA       ALA  95  -0.110  13.687 -15.322
  736    HB1  ALA  95           1HB      ALA  95  -0.065  16.243 -13.686
  737    HB2  ALA  95           2HB      ALA  95   0.872  14.775 -13.379
  738    HB3  ALA  95           3HB      ALA  95   1.197  15.719 -14.832
  739    H    ALA  96           H        ALA  96  -3.107  13.962 -15.480
  740    HA   ALA  96           HA       ALA  96  -4.067  13.556 -12.774
  741    HB1  ALA  96           1HB      ALA  96  -5.388  13.036 -15.476
  742    HB2  ALA  96           2HB      ALA  96  -6.193  13.053 -13.892
  743    HB3  ALA  96           3HB      ALA  96  -5.480  14.545 -14.516
  744    H    GLN  97           H        GLN  97  -2.083  11.943 -12.689
  745    HA   GLN  97           HA       GLN  97  -2.412   9.262 -13.625
  746    HB2  GLN  97           2HB      GLN  97  -0.598   8.747 -12.141
  747    HB3  GLN  97           3HB      GLN  97  -0.260  10.276 -12.953
  748    HG2  GLN  97           2HG      GLN  97  -0.864  11.523 -10.925
  749    HG3  GLN  97           3HG      GLN  97  -1.356  10.040 -10.116
  750   HE21  GLN  97          2HE2      GLN  97   0.215   9.043  -8.821
  751   HE22  GLN  97          1HE2      GLN  97   1.901   9.342  -8.931
  752    H    VAL  98           H        VAL  98  -2.429   7.407 -12.075
  753    HA   VAL  98           HA       VAL  98  -4.212   7.723  -9.732
  754    HB   VAL  98           HB       VAL  98  -5.030   5.387 -10.250
  755   HG11  VAL  98          1HG1      VAL  98  -5.671   7.515 -12.349
  756   HG12  VAL  98          2HG1      VAL  98  -6.660   6.092 -11.983
  757   HG13  VAL  98          3HG1      VAL  98  -6.432   7.350 -10.762
  758   HG21  VAL  98          3HG2      VAL  98  -3.797   5.834 -13.009
  759   HG22  VAL  98          1HG2      VAL  98  -3.300   4.621 -11.805
  760   HG23  VAL  98          2HG2      VAL  98  -4.904   4.528 -12.538
  761    H    SER  99           H        SER  99  -3.580   6.408  -7.972
  762    HA   SER  99           HA       SER  99  -0.786   5.329  -8.157
  763    HB2  SER  99           2HB      SER  99  -1.910   7.151  -6.002
  764    HB3  SER  99           3HB      SER  99  -0.275   6.477  -6.067
  765    HG   SER  99           HG       SER  99  -0.417   8.600  -6.879
  766    H    GLU 100           H        GLU 100  -3.957   5.094  -6.737
  767    HA   GLU 100           HA       GLU 100  -3.451   2.258  -6.094
  768    HB2  GLU 100           2HB      GLU 100  -4.793   4.281  -4.215
  769    HB3  GLU 100           3HB      GLU 100  -5.007   2.543  -4.118
  770    HG2  GLU 100           2HG      GLU 100  -3.402   2.959  -2.487
  771    HG3  GLU 100           3HG      GLU 100  -2.505   2.312  -3.850
  772    H    GLU 101           H        GLU 101  -5.649   4.979  -6.078
  773    HA   GLU 101           HA       GLU 101  -7.248   4.031  -8.358
  774    HB2  GLU 101           2HB      GLU 101  -8.355   5.135  -5.729
  775    HB3  GLU 101           3HB      GLU 101  -9.289   4.935  -7.222
  776    HG2  GLU 101           2HG      GLU 101  -8.838   2.481  -7.152
  777    HG3  GLU 101           3HG      GLU 101  -8.036   2.693  -5.594
  778    H    ALA 102           H        ALA 102  -8.771   6.637  -8.109
  779    HA   ALA 102           HA       ALA 102  -6.774   8.623  -8.826
  780    HB1  ALA 102           1HB      ALA 102  -9.742   8.890  -8.173
  781    HB2  ALA 102           2HB      ALA 102  -8.721  10.125  -8.940
  782    HB3  ALA 102           3HB      ALA 102  -9.046   8.606  -9.792
  783    H    SER 103           H        SER 103  -6.178   7.452  -6.284
  784    HA   SER 103           HA       SER 103  -6.832   9.007  -4.025
  785    HB2  SER 103           2HB      SER 103  -4.393   8.137  -3.403
  786    HB3  SER 103           3HB      SER 103  -5.774   7.042  -3.488
  787    HG   SER 103           HG       SER 103  -3.845   6.289  -4.560
  788    H    THR 104           H        THR 104  -4.068   9.306  -6.337
  789    HA   THR 104           HA       THR 104  -3.362  11.964  -5.435
  790    HB   THR 104           HB       THR 104  -2.174  11.808  -7.807
  791    HG1  THR 104           1HG      THR 104  -1.849   9.581  -8.330
  792   HG21  THR 104          1HG2      THR 104  -1.440   9.970  -5.473
  793   HG22  THR 104          2HG2      THR 104  -0.334  10.527  -6.761
  794   HG23  THR 104          3HG2      THR 104  -1.011  11.687  -5.626
  795    HA   PRO 105           HA       PRO 105  -6.615  13.792  -8.063
  796    HB2  PRO 105           2HB      PRO 105  -5.941  16.460  -7.729
  797    HB3  PRO 105           3HB      PRO 105  -6.915  15.524  -6.559
  798    HG2  PRO 105           2HG      PRO 105  -3.974  16.209  -6.467
  799    HG3  PRO 105           3HG      PRO 105  -5.140  16.197  -5.118
  800    HD2  PRO 105           2HD      PRO 105  -3.355  14.134  -5.638
  801    HD3  PRO 105           3HD      PRO 105  -4.946  13.867  -4.858
  802    H    GLN 106           H        GLN 106  -3.218  14.898  -8.016
  803    HA   GLN 106           HA       GLN 106  -2.873  14.280 -10.842
  804    HB2  GLN 106           2HB      GLN 106  -2.231  16.988  -9.602
  805    HB3  GLN 106           3HB      GLN 106  -1.526  16.416 -11.116
  806    HG2  GLN 106           2HG      GLN 106  -3.778  16.291 -12.141
  807    HG3  GLN 106           3HG      GLN 106  -4.491  16.896 -10.643
  808   HE21  GLN 106          2HE2      GLN 106  -2.924  17.807 -13.610
  809   HE22  GLN 106          1HE2      GLN 106  -2.860  19.532 -13.246
  810    H    GLY 107           H        GLY 107  -0.462  14.260 -11.267
  811    HA2  GLY 107           2HA      GLY 107   1.054  12.991  -9.163
  812    HA3  GLY 107           3HA      GLY 107   1.625  13.420 -10.775
  813    H    PHE 108           H        PHE 108   3.515  13.790  -9.169
  814    HA   PHE 108           HA       PHE 108   3.813  16.679  -8.710
  815    HB2  PHE 108           2HB      PHE 108   2.972  15.644  -6.577
  816    HB3  PHE 108           3HB      PHE 108   4.369  14.571  -6.583
  817    HD1  PHE 108           HD1      PHE 108   3.613  18.270  -6.848
  818    HD2  PHE 108           HD2      PHE 108   6.135  15.191  -5.183
  819    HE1  PHE 108           HE1      PHE 108   4.919  19.990  -5.622
  820    HE2  PHE 108           HE2      PHE 108   7.423  16.916  -3.953
  821    HZ   PHE 108           HZ       PHE 108   6.821  19.314  -4.173
  822    H    ASN 109           H        ASN 109   6.320  16.885  -7.880
  823    HA   ASN 109           HA       ASN 109   7.999  15.097  -9.577
  824    HB2  ASN 109           2HB      ASN 109   7.622  17.093 -10.939
  825    HB3  ASN 109           3HB      ASN 109   7.953  18.140  -9.543
  826   HD21  ASN 109          2HD2      ASN 109   9.507  15.464 -11.411
  827   HD22  ASN 109          1HD2      ASN 109  11.153  16.132 -11.267
  828    H    THR 110           H        THR 110   9.700  14.341  -8.446
  829    HA   THR 110           HA       THR 110  10.300  15.229  -5.771
  830    HB   THR 110           HB       THR 110  12.165  13.472  -6.141
  831    HG1  THR 110           1HG      THR 110  11.787  12.166  -7.988
  832   HG21  THR 110          1HG2      THR 110   9.275  12.620  -6.655
  833   HG22  THR 110          2HG2      THR 110  10.580  11.570  -6.073
  834   HG23  THR 110          3HG2      THR 110  10.003  12.901  -5.063
  835    H    LEU 111           H        LEU 111  11.974  15.396  -8.934
  836    HA   LEU 111           HA       LEU 111  13.462  17.783  -8.190
  837    HB2  LEU 111           2HB      LEU 111  14.834  15.932  -7.247
  838    HB3  LEU 111           3HB      LEU 111  14.853  15.144  -8.830
  839    HG   LEU 111           HG       LEU 111  16.126  17.079  -9.764
  840   HD11  LEU 111          1HD1      LEU 111  16.227  18.052  -6.872
  841   HD12  LEU 111          2HD1      LEU 111  17.134  18.736  -8.237
  842   HD13  LEU 111          3HD1      LEU 111  15.377  18.869  -8.199
  843   HD21  LEU 111          3HD2      LEU 111  17.361  15.807  -7.287
  844   HD22  LEU 111          1HD2      LEU 111  17.322  15.113  -8.922
  845   HD23  LEU 111          2HD2      LEU 111  18.258  16.584  -8.611
  846    H    LYS 112           H        LYS 112  14.072  18.889 -10.085
  847    HA   LYS 112           HA       LYS 112  12.730  18.369 -12.506
  848    HB2  LYS 112           2HB      LYS 112  13.768  20.539 -11.557
  849    HB3  LYS 112           3HB      LYS 112  15.304  19.961 -12.217
  850    HG2  LYS 112           2HG      LYS 112  14.234  19.898 -14.495
  851    HG3  LYS 112           3HG      LYS 112  12.745  20.567 -13.785
  852    HD2  LYS 112           2HD      LYS 112  14.059  22.530 -12.958
  853    HD3  LYS 112           3HD      LYS 112  15.498  21.881 -13.742
  854    HE2  LYS 112           2HE      LYS 112  12.965  22.925 -15.063
  855    HE3  LYS 112           3HE      LYS 112  14.587  23.634 -15.110
  856    HZ1  LYS 112           3HZ      LYS 112  15.309  21.705 -16.392
  857    HZ2  LYS 112           1HZ      LYS 112  13.759  21.111 -16.373
  858    HZ3  LYS 112           2HZ      LYS 112  14.057  22.446 -17.164
  859    H    ASP 113           H        ASP 113  13.296  17.253 -14.393
  860    HA   ASP 113           HA       ASP 113  15.080  15.073 -14.181
  861    HB2  ASP 113           2HB      ASP 113  13.150  15.044 -15.662
  862    HB3  ASP 113           3HB      ASP 113  13.805  16.382 -16.609
  863    H    LYS 114           H        LYS 114  15.596  18.293 -15.549
  864    HA   LYS 114           HA       LYS 114  18.504  17.802 -15.515
  865    HB2  LYS 114           2HB      LYS 114  17.656  17.425 -17.870
  866    HB3  LYS 114           3HB      LYS 114  17.022  19.075 -17.853
  867    HG2  LYS 114           2HG      LYS 114  19.497  19.777 -17.294
  868    HG3  LYS 114           3HG      LYS 114  19.916  18.132 -17.781
  869    HD2  LYS 114           2HD      LYS 114  20.241  19.535 -19.702
  870    HD3  LYS 114           3HD      LYS 114  18.747  18.615 -20.010
  871    HE2  LYS 114           2HE      LYS 114  17.409  20.557 -19.193
  872    HE3  LYS 114           3HE      LYS 114  18.899  21.450 -18.867
  873    HZ1  LYS 114           3HZ      LYS 114  19.343  21.445 -21.235
  874    HZ2  LYS 114           1HZ      LYS 114  17.943  20.594 -21.520
  875    HZ3  LYS 114           2HZ      LYS 114  17.864  22.110 -20.907
  876    H    LEU 115           H        LEU 115  19.388  19.514 -14.385
  877    HA   LEU 115           HA       LEU 115  17.791  21.586 -13.312
  878    HB2  LEU 115           2HB      LEU 115  19.808  20.740 -12.229
  879    HB3  LEU 115           3HB      LEU 115  20.805  21.330 -13.567
  880    HG   LEU 115           HG       LEU 115  20.186  23.678 -12.998
  881   HD11  LEU 115          1HD1      LEU 115  18.791  22.441 -10.577
  882   HD12  LEU 115          2HD1      LEU 115  19.061  24.171 -10.858
  883   HD13  LEU 115          3HD1      LEU 115  17.976  23.290 -11.915
  884   HD21  LEU 115          3HD2      LEU 115  21.310  22.057 -10.674
  885   HD22  LEU 115          1HD2      LEU 115  22.226  22.693 -12.062
  886   HD23  LEU 115          2HD2      LEU 115  21.492  23.810 -10.907
  887    H    GLU 116           H        GLU 116  17.162  23.480 -14.098
  888    HA   GLU 116           HA       GLU 116  18.798  25.058 -15.911
  889    HB2  GLU 116           2HB      GLU 116  15.878  24.459 -16.510
  890    HB3  GLU 116           3HB      GLU 116  16.909  25.587 -17.392
  891    HG2  GLU 116           2HG      GLU 116  18.288  23.709 -18.229
  892    HG3  GLU 116           3HG      GLU 116  17.304  22.575 -17.297
  893    H    GLU 117           H        GLU 117  17.719  27.350 -15.904
  894    HA   GLU 117           HA       GLU 117  16.268  27.825 -13.327
  895    HB2  GLU 117           2HB      GLU 117  18.478  29.443 -14.646
  896    HB3  GLU 117           3HB      GLU 117  17.565  29.939 -13.212
  897    HG2  GLU 117           2HG      GLU 117  18.376  27.911 -12.009
  898    HG3  GLU 117           3HG      GLU 117  19.358  27.487 -13.409
  899    H    TRP 118           H        TRP 118  16.055  28.209 -16.725
  900    HA   TRP 118           HA       TRP 118  14.439  30.580 -16.755
  901    HB2  TRP 118           2HB      TRP 118  13.953  30.044 -19.011
  902    HB3  TRP 118           3HB      TRP 118  15.638  29.636 -18.726
  903    HD1  TRP 118           HD1      TRP 118  14.551  26.668 -17.431
  904    HE1  TRP 118           HE1      TRP 118  14.218  24.796 -19.148
  905    HE3  TRP 118           HE3      TRP 118  14.030  29.537 -21.637
  906    HZ2  TRP 118           HZ2      TRP 118  13.687  24.586 -21.969
  907    HZ3  TRP 118           HZ3      TRP 118  13.576  28.485 -23.816
  908    HH2  TRP 118           HH2      TRP 118  13.402  26.014 -24.013
  909    H    ILE 119           H        ILE 119  12.132  30.562 -17.531
  910    HA   ILE 119           HA       ILE 119  10.438  29.249 -15.663
  911    HB   ILE 119           HB       ILE 119   8.588  30.259 -16.872
  912   HG12  ILE 119          2HG1      ILE 119  10.575  31.050 -19.038
  913   HG13  ILE 119          3HG1      ILE 119   9.315  29.810 -19.177
  914   HG21  ILE 119          1HG2      ILE 119  10.997  32.145 -16.653
  915   HG22  ILE 119          2HG2      ILE 119   9.304  32.640 -16.673
  916   HG23  ILE 119          3HG2      ILE 119   9.890  31.676 -15.341
  917   HD11  ILE 119          3HD1      ILE 119   7.558  31.508 -18.830
  918   HD12  ILE 119          1HD1      ILE 119   8.794  32.777 -18.740
  919   HD13  ILE 119          2HD1      ILE 119   8.578  31.886 -20.234
  920    H    GLU 120           H        GLU 120  11.486  28.235 -18.837
  921    HA   GLU 120           HA       GLU 120  11.443  26.231 -19.879
  922    HB2  GLU 120           2HB      GLU 120  11.893  25.446 -17.585
  923    HB3  GLU 120           3HB      GLU 120  10.155  25.233 -17.343
  924    HG2  GLU 120           2HG      GLU 120  10.115  23.459 -19.050
  925    HG3  GLU 120           3HG      GLU 120  11.858  23.691 -19.303
  926    H    MET 121           H        MET 121   8.345  27.100 -18.382
  927    HA   MET 121           HA       MET 121   7.031  26.802 -20.988
  928    HB2  MET 121           2HB      MET 121   6.757  24.589 -19.812
  929    HB3  MET 121           3HB      MET 121   5.999  25.445 -18.456
  930    HG2  MET 121           2HG      MET 121   4.192  26.215 -19.960
  931    HG3  MET 121           3HG      MET 121   4.982  25.413 -21.322
  932    HE1  MET 121           3HE      MET 121   4.301  24.212 -17.560
  933    HE2  MET 121           1HE      MET 121   2.803  25.024 -18.082
  934    HE3  MET 121           2HE      MET 121   2.818  23.270 -17.812
  935    H    SER 122           H        SER 122   5.278  28.306 -21.092
  936    HA   SER 122           HA       SER 122   5.587  30.665 -19.668
  937    HB2  SER 122           2HB      SER 122   3.062  29.799 -21.099
  938    HB3  SER 122           3HB      SER 122   3.726  31.440 -20.944
  939    HG   SER 122           HG       SER 122   4.184  30.492 -22.999
  940    H    ASN 123           H        ASN 123   3.769  27.907 -18.619
  941    HA   ASN 123           HA       ASN 123   2.786  29.439 -16.274
  942    HB2  ASN 123           2HB      ASN 123   0.955  29.220 -18.011
  943    HB3  ASN 123           3HB      ASN 123   1.093  27.461 -17.848
  944   HD21  ASN 123          2HD2      ASN 123  -0.977  27.075 -16.951
  945   HD22  ASN 123          1HD2      ASN 123  -1.433  27.719 -15.385
  946    H    ARG 124           H        ARG 124   5.128  27.618 -16.620
  947    HA   ARG 124           HA       ARG 124   4.590  25.165 -15.255
  948    HB2  ARG 124           2HB      ARG 124   6.816  25.893 -16.297
  949    HB3  ARG 124           3HB      ARG 124   7.049  26.939 -14.886
  950    HG2  ARG 124           2HG      ARG 124   6.871  24.886 -13.417
  951    HG3  ARG 124           3HG      ARG 124   6.723  23.902 -14.873
  952    HD2  ARG 124           2HD      ARG 124   9.002  23.773 -14.088
  953    HD3  ARG 124           3HD      ARG 124   8.982  24.705 -15.586
  954    HE   ARG 124           HE       ARG 124   8.815  26.256 -13.091
  955   HH11  ARG 124          1HH1      ARG 124  11.120  24.762 -15.393
  956   HH12  ARG 124          2HH1      ARG 124  12.278  26.052 -15.213
  957   HH21  ARG 124          1HH2      ARG 124  10.384  27.988 -12.975
  958   HH22  ARG 124          2HH2      ARG 124  11.878  27.829 -13.860
  959    H    LYS 125           H        LYS 125   4.314  24.693 -13.067
  960    HA   LYS 125           HA       LYS 125   3.353  26.598 -11.227
  961    HB2  LYS 125           2HB      LYS 125   3.085  24.108 -11.086
  962    HB3  LYS 125           3HB      LYS 125   4.804  23.959 -10.711
  963    HG2  LYS 125           2HG      LYS 125   3.552  23.734  -8.676
  964    HG3  LYS 125           3HG      LYS 125   4.438  25.253  -8.606
  965    HD2  LYS 125           2HD      LYS 125   2.383  26.509  -9.168
  966    HD3  LYS 125           3HD      LYS 125   1.483  24.980  -9.330
  967    HE2  LYS 125           2HE      LYS 125   1.980  24.457  -6.946
  968    HE3  LYS 125           3HE      LYS 125   2.862  25.991  -6.795
  969    HZ1  LYS 125           3HZ      LYS 125   0.793  27.147  -7.266
  970    HZ2  LYS 125           1HZ      LYS 125  -0.020  25.720  -7.410
  971    HZ3  LYS 125           2HZ      LYS 125   0.615  26.167  -5.966
  972    H    ASP 126           H        ASP 126   4.363  27.984  -9.790
  973    HA   ASP 126           HA       ASP 126   7.226  28.387  -9.848
  974    HB2  ASP 126           2HB      ASP 126   5.650  30.235  -9.715
  975    HB3  ASP 126           3HB      ASP 126   5.047  29.663  -8.160
  976    H    LEU 127           H        LEU 127   7.070  25.865  -9.214
  977    HA   LEU 127           HA       LEU 127   6.747  25.179  -6.464
  978    HB2  LEU 127           2HB      LEU 127   6.658  23.563  -8.334
  979    HB3  LEU 127           3HB      LEU 127   8.370  23.854  -8.672
  980    HG   LEU 127           HG       LEU 127   8.976  22.910  -6.452
  981   HD11  LEU 127          1HD1      LEU 127   5.999  22.257  -6.204
  982   HD12  LEU 127          2HD1      LEU 127   7.289  21.708  -5.112
  983   HD13  LEU 127          3HD1      LEU 127   6.892  23.413  -5.187
  984   HD21  LEU 127          3HD2      LEU 127   7.183  21.099  -8.134
  985   HD22  LEU 127          1HD2      LEU 127   8.908  21.432  -8.414
  986   HD23  LEU 127          2HD2      LEU 127   8.407  20.554  -6.968
  987    H    ILE 128           H        ILE 128   8.125  25.203  -4.781
  988    HA   ILE 128           HA       ILE 128  10.980  25.874  -5.104
  989    HB   ILE 128           HB       ILE 128  10.691  27.470  -3.121
  990   HG12  ILE 128          2HG1      ILE 128   8.580  28.690  -2.925
  991   HG13  ILE 128          3HG1      ILE 128   7.770  27.526  -3.970
  992   HG21  ILE 128          1HG2      ILE 128   9.439  28.247  -5.791
  993   HG22  ILE 128          2HG2      ILE 128  10.051  29.371  -4.590
  994   HG23  ILE 128          3HG2      ILE 128  11.164  28.260  -5.402
  995   HD11  ILE 128          3HD1      ILE 128   8.155  25.761  -2.255
  996   HD12  ILE 128          1HD1      ILE 128   8.997  26.945  -1.227
  997   HD13  ILE 128          2HD1      ILE 128   7.268  27.120  -1.592
  998    H    LYS 129           H        LYS 129  12.069  25.619  -2.869
  999    HA   LYS 129           HA       LYS 129  11.466  22.989  -1.823
 1000    HB2  LYS 129           2HB      LYS 129  13.770  23.956  -2.124
 1001    HB3  LYS 129           3HB      LYS 129  13.420  25.116  -0.848
 1002    HG2  LYS 129           2HG      LYS 129  14.768  23.285   0.008
 1003    HG3  LYS 129           3HG      LYS 129  13.197  23.312   0.794
 1004    HD2  LYS 129           2HD      LYS 129  13.881  21.025   0.340
 1005    HD3  LYS 129           3HD      LYS 129  12.432  21.418  -0.583
 1006    HE2  LYS 129           2HE      LYS 129  13.800  21.791  -2.611
 1007    HE3  LYS 129           3HE      LYS 129  15.282  21.475  -1.689
 1008    HZ1  LYS 129           3HZ      LYS 129  14.496  19.225  -1.320
 1009    HZ2  LYS 129           1HZ      LYS 129  13.115  19.524  -2.170
 1010    HZ3  LYS 129           2HZ      LYS 129  14.575  19.545  -2.925
 1011    H    LYS 130           H        LYS 130   9.218  23.538  -1.307
 1012    HA   LYS 130           HA       LYS 130   8.427  25.136   0.866
 1013    HB2  LYS 130           2HB      LYS 130   6.910  23.985  -0.773
 1014    HB3  LYS 130           3HB      LYS 130   7.344  22.433  -0.044
 1015    HG2  LYS 130           2HG      LYS 130   5.182  23.129   0.776
 1016    HG3  LYS 130           3HG      LYS 130   6.341  23.156   2.106
 1017    HD2  LYS 130           2HD      LYS 130   6.524  25.604   1.945
 1018    HD3  LYS 130           3HD      LYS 130   5.450  25.611   0.522
 1019    HE2  LYS 130           2HE      LYS 130   3.633  24.641   1.907
 1020    HE3  LYS 130           3HE      LYS 130   4.710  24.632   3.317
 1021    HZ1  LYS 130           3HZ      LYS 130   4.822  27.028   3.171
 1022    HZ2  LYS 130           1HZ      LYS 130   3.822  27.046   1.860
 1023    HZ3  LYS 130           2HZ      LYS 130   3.259  26.543   3.323
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1   5.829 -26.864  -2.449
    2    H2   MET   1           H2       MET   1   6.798 -25.573  -2.221
    3    H3   MET   1           H3       MET   1   7.382 -26.981  -2.979
    4    HA   MET   1           HA       MET   1   6.311 -24.718  -4.094
    5    HB2  MET   1           2HB      MET   1   7.239 -27.392  -5.190
    6    HB3  MET   1           3HB      MET   1   6.624 -26.096  -6.231
    7    HG2  MET   1           2HG      MET   1   8.364 -24.572  -5.337
    8    HG3  MET   1           3HG      MET   1   9.005 -25.908  -4.364
    9    HE1  MET   1           3HE      MET   1   7.723 -25.761  -8.157
   10    HE2  MET   1           1HE      MET   1   8.687 -24.286  -7.922
   11    HE3  MET   1           2HE      MET   1   9.275 -25.572  -8.999
   12    H    ALA   2           H        ALA   2   4.201 -24.556  -3.200
   13    HA   ALA   2           HA       ALA   2   2.063 -26.308  -3.962
   14    HB1  ALA   2           1HB      ALA   2   2.042 -23.330  -3.296
   15    HB2  ALA   2           2HB      ALA   2   0.629 -24.409  -3.308
   16    HB3  ALA   2           3HB      ALA   2   1.924 -24.662  -2.120
   17    H    ALA   3           H        ALA   3   3.856 -24.011  -5.803
   18    HA   ALA   3           HA       ALA   3   2.227 -24.530  -8.222
   19    HB1  ALA   3           1HB      ALA   3   3.024 -21.757  -7.223
   20    HB2  ALA   3           2HB      ALA   3   2.305 -22.121  -8.811
   21    HB3  ALA   3           3HB      ALA   3   1.366 -22.392  -7.331
   22    H    LYS   4           H        LYS   4   3.487 -23.635 -10.142
   23    HA   LYS   4           HA       LYS   4   6.009 -24.957 -10.255
   24    HB2  LYS   4           2HB      LYS   4   6.095 -24.192 -12.524
   25    HB3  LYS   4           3HB      LYS   4   4.418 -24.626 -12.142
   26    HG2  LYS   4           2HG      LYS   4   4.061 -22.106 -11.664
   27    HG3  LYS   4           3HG      LYS   4   5.624 -21.852 -12.460
   28    HD2  LYS   4           2HD      LYS   4   3.150 -23.129 -13.695
   29    HD3  LYS   4           3HD      LYS   4   3.744 -21.482 -14.004
   30    HE2  LYS   4           2HE      LYS   4   5.841 -22.422 -14.947
   31    HE3  LYS   4           3HE      LYS   4   5.229 -24.065 -14.656
   32    HZ1  LYS   4           3HZ      LYS   4   3.430 -23.598 -16.184
   33    HZ2  LYS   4           1HZ      LYS   4   3.998 -22.074 -16.454
   34    HZ3  LYS   4           2HZ      LYS   4   4.882 -23.380 -16.926
   35    H    PHE   5           H        PHE   5   5.346 -21.708  -9.285
   36    HA   PHE   5           HA       PHE   5   7.793 -20.505 -10.153
   37    HB2  PHE   5           2HB      PHE   5   5.883 -19.728  -7.926
   38    HB3  PHE   5           3HB      PHE   5   7.051 -18.629  -8.673
   39    HD1  PHE   5           HD2      PHE   5   6.791 -18.124 -11.199
   40    HD2  PHE   5           HD1      PHE   5   3.732 -19.981  -8.802
   41    HE1  PHE   5           HE2      PHE   5   5.099 -17.624 -12.953
   42    HE2  PHE   5           HE1      PHE   5   2.054 -19.510 -10.581
   43    HZ   PHE   5           HZ       PHE   5   2.742 -18.339 -12.662
   44    H    GLU   6           H        GLU   6   9.666 -20.223  -9.208
   45    HA   GLU   6           HA       GLU   6  10.132 -20.738  -6.358
   46    HB2  GLU   6           2HB      GLU   6  10.562 -22.893  -7.477
   47    HB3  GLU   6           3HB      GLU   6  11.674 -22.088  -8.597
   48    HG2  GLU   6           2HG      GLU   6  12.860 -23.333  -6.854
   49    HG3  GLU   6           3HG      GLU   6  13.232 -21.611  -6.766
   50    H    VAL   7           H        VAL   7  12.060 -19.639  -5.692
   51    HA   VAL   7           HA       VAL   7  12.467 -17.073  -6.742
   52    HB   VAL   7           HB       VAL   7  14.427 -16.969  -5.269
   53   HG11  VAL   7          1HG1      VAL   7  12.108 -18.560  -4.066
   54   HG12  VAL   7          2HG1      VAL   7  13.283 -17.598  -3.153
   55   HG13  VAL   7          3HG1      VAL   7  12.168 -16.810  -4.293
   56   HG21  VAL   7          3HG2      VAL   7  14.125 -19.960  -4.868
   57   HG22  VAL   7          1HG2      VAL   7  15.473 -19.135  -5.681
   58   HG23  VAL   7          2HG2      VAL   7  15.189 -18.872  -3.951
   59    H    GLY   8           H        GLY   8  13.516 -16.081  -8.161
   60    HA2  GLY   8           2HA      GLY   8  15.244 -15.610  -9.627
   61    HA3  GLY   8           3HA      GLY   8  15.821 -17.286  -9.517
   62    H    SER   9           H        SER   9  12.780 -18.076 -10.081
   63    HA   SER   9           HA       SER   9  13.058 -18.475 -12.890
   64    HB2  SER   9           2HB      SER   9  10.461 -18.445 -11.321
   65    HB3  SER   9           3HB      SER   9  10.833 -19.333 -12.817
   66    HG   SER   9           HG       SER   9  10.949 -20.669 -10.916
   67    H    VAL  10           H        VAL  10  11.424 -17.715 -14.547
   68    HA   VAL  10           HA       VAL  10  10.589 -14.892 -14.188
   69    HB   VAL  10           HB       VAL  10  12.295 -15.901 -16.505
   70   HG11  VAL  10          1HG1      VAL  10  11.217 -13.109 -15.882
   71   HG12  VAL  10          2HG1      VAL  10  12.298 -13.524 -17.231
   72   HG13  VAL  10          3HG1      VAL  10  10.651 -14.172 -17.186
   73   HG21  VAL  10          3HG2      VAL  10  13.028 -13.910 -14.332
   74   HG22  VAL  10          1HG2      VAL  10  13.707 -15.545 -14.525
   75   HG23  VAL  10          2HG2      VAL  10  14.009 -14.309 -15.758
   76    H    TYR  11           H        TYR  11   8.585 -14.682 -14.893
   77    HA   TYR  11           HA       TYR  11   7.469 -16.386 -17.050
   78    HB2  TYR  11           2HB      TYR  11   6.453 -16.244 -14.198
   79    HB3  TYR  11           3HB      TYR  11   5.467 -16.799 -15.554
   80    HD1  TYR  11           HD2      TYR  11   6.265 -18.815 -16.918
   81    HD2  TYR  11           HD1      TYR  11   7.948 -17.767 -13.096
   82    HE1  TYR  11           HE2      TYR  11   7.167 -21.124 -16.691
   83    HE2  TYR  11           HE1      TYR  11   8.721 -20.108 -12.784
   84    HH   TYR  11           HH       TYR  11   8.932 -22.181 -13.735
   85    H    THR  12           H        THR  12   4.922 -15.565 -17.113
   86    HA   THR  12           HA       THR  12   5.056 -12.581 -17.182
   87    HB   THR  12           HB       THR  12   3.648 -14.375 -19.175
   88    HG1  THR  12           1HG      THR  12   5.456 -13.910 -20.531
   89   HG21  THR  12          1HG2      THR  12   4.558 -11.468 -19.360
   90   HG22  THR  12          2HG2      THR  12   3.742 -12.383 -20.645
   91   HG23  THR  12          3HG2      THR  12   2.882 -12.013 -19.142
   92    H    GLY  13           H        GLY  13   3.150 -11.459 -16.800
   93    HA2  GLY  13           2HA      GLY  13   0.783 -12.813 -15.738
   94    HA3  GLY  13           3HA      GLY  13   1.799 -11.987 -14.538
   95    H    LYS  14           H        LYS  14  -0.504 -10.838 -14.512
   96    HA   LYS  14           HA       LYS  14  -0.339  -8.469 -16.336
   97    HB2  LYS  14           2HB      LYS  14  -2.712 -10.217 -15.668
   98    HB3  LYS  14           3HB      LYS  14  -2.943  -8.494 -16.045
   99    HG2  LYS  14           2HG      LYS  14  -1.720  -8.793 -18.171
  100    HG3  LYS  14           3HG      LYS  14  -1.521 -10.521 -17.817
  101    HD2  LYS  14           2HD      LYS  14  -4.195  -9.101 -18.162
  102    HD3  LYS  14           3HD      LYS  14  -3.361 -10.020 -19.436
  103    HE2  LYS  14           2HE      LYS  14  -3.455 -12.058 -18.007
  104    HE3  LYS  14           3HE      LYS  14  -4.343 -11.136 -16.773
  105    HZ1  LYS  14           3HZ      LYS  14  -6.098 -10.797 -18.379
  106    HZ2  LYS  14           1HZ      LYS  14  -5.273 -11.658 -19.523
  107    HZ3  LYS  14           2HZ      LYS  14  -5.826 -12.411 -18.164
  108    H    VAL  15           H        VAL  15  -0.552  -6.536 -15.446
  109    HA   VAL  15           HA       VAL  15  -0.129  -6.379 -12.589
  110    HB   VAL  15           HB       VAL  15  -0.700  -4.089 -14.498
  111   HG11  VAL  15          1HG1      VAL  15   0.997  -4.330 -11.964
  112   HG12  VAL  15          2HG1      VAL  15   0.794  -2.859 -12.939
  113   HG13  VAL  15          3HG1      VAL  15  -0.593  -3.544 -12.075
  114   HG21  VAL  15          3HG2      VAL  15   1.986  -5.430 -14.053
  115   HG22  VAL  15          1HG2      VAL  15   1.049  -5.424 -15.562
  116   HG23  VAL  15          2HG2      VAL  15   1.701  -3.913 -14.939
  117    H    THR  16           H        THR  16  -1.583  -6.258 -11.052
  118    HA   THR  16           HA       THR  16  -4.439  -5.776 -11.757
  119    HB   THR  16           HB       THR  16  -4.660  -7.015  -9.446
  120    HG1  THR  16           1HG      THR  16  -2.930  -8.487  -9.152
  121   HG21  THR  16          1HG2      THR  16  -3.693  -8.454 -11.957
  122   HG22  THR  16          2HG2      THR  16  -4.609  -9.188 -10.615
  123   HG23  THR  16          3HG2      THR  16  -5.364  -7.946 -11.628
  124    H    GLY  17           H        GLY  17  -1.842  -4.262 -10.009
  125    HA2  GLY  17           2HA      GLY  17  -3.508  -1.963  -9.686
  126    HA3  GLY  17           3HA      GLY  17  -3.268  -2.753  -8.115
  127    H    LEU  18           H        LEU  18  -2.321  -0.195  -8.627
  128    HA   LEU  18           HA       LEU  18   0.624  -0.581  -8.379
  129    HB2  LEU  18           2HB      LEU  18  -0.821   1.692  -9.769
  130    HB3  LEU  18           3HB      LEU  18   0.905   1.675  -9.375
  131    HG   LEU  18           HG       LEU  18  -0.493  -0.178 -11.353
  132   HD11  LEU  18          1HD1      LEU  18   1.515   2.077 -11.754
  133   HD12  LEU  18          2HD1      LEU  18   0.876   1.028 -13.031
  134   HD13  LEU  18          3HD1      LEU  18  -0.211   2.142 -12.169
  135   HD21  LEU  18          3HD2      LEU  18   2.457   0.027 -10.670
  136   HD22  LEU  18          1HD2      LEU  18   1.381  -1.330 -10.274
  137   HD23  LEU  18          2HD2      LEU  18   1.744  -0.964 -11.964
  138    H    GLN  19           H        GLN  19   1.577   0.938  -6.921
  139    HA   GLN  19           HA       GLN  19  -0.143   2.438  -5.070
  140    HB2  GLN  19           2HB      GLN  19   1.570   0.174  -4.039
  141    HB3  GLN  19           3HB      GLN  19   0.461   1.201  -3.130
  142    HG2  GLN  19           2HG      GLN  19  -1.457   0.033  -3.908
  143    HG3  GLN  19           3HG      GLN  19  -0.570  -0.765  -5.218
  144   HE21  GLN  19          2HE2      GLN  19   1.261  -2.228  -4.549
  145   HE22  GLN  19          1HE2      GLN  19   0.995  -3.218  -3.119
  146    H    ALA  20           H        ALA  20   1.303   3.718  -3.627
  147    HA   ALA  20           HA       ALA  20   3.761   4.596  -4.631
  148    HB1  ALA  20           1HB      ALA  20   2.802   4.595  -1.735
  149    HB2  ALA  20           2HB      ALA  20   4.070   5.636  -2.418
  150    HB3  ALA  20           3HB      ALA  20   2.391   5.816  -2.969
  151    H    TYR  21           H        TYR  21   3.170   1.662  -2.875
  152    HA   TYR  21           HA       TYR  21   6.047   1.355  -2.141
  153    HB2  TYR  21           2HB      TYR  21   4.064   1.220  -0.482
  154    HB3  TYR  21           3HB      TYR  21   3.725  -0.347  -1.230
  155    HD1  TYR  21           HD2      TYR  21   6.303   1.633   0.611
  156    HD2  TYR  21           HD1      TYR  21   5.014  -2.299  -0.615
  157    HE1  TYR  21           HE2      TYR  21   7.986   0.611   2.130
  158    HE2  TYR  21           HE1      TYR  21   6.701  -3.329   0.892
  159    HH   TYR  21           HH       TYR  21   8.395  -2.933   2.437
  160    H    GLY  22           H        GLY  22   3.822   0.265  -4.592
  161    HA2  GLY  22           2HA      GLY  22   5.556  -1.305  -5.962
  162    HA3  GLY  22           3HA      GLY  22   4.963  -2.408  -4.710
  163    H    ALA  23           H        ALA  23   4.511  -3.281  -7.073
  164    HA   ALA  23           HA       ALA  23   1.770  -2.500  -8.043
  165    HB1  ALA  23           1HB      ALA  23   4.171  -3.674  -9.512
  166    HB2  ALA  23           2HB      ALA  23   2.575  -3.367 -10.219
  167    HB3  ALA  23           3HB      ALA  23   3.575  -2.008  -9.660
  168    H    PHE  24           H        PHE  24   0.241  -4.067  -7.798
  169    HA   PHE  24           HA       PHE  24   1.033  -6.803  -7.104
  170    HB2  PHE  24           2HB      PHE  24  -1.685  -5.554  -7.710
  171    HB3  PHE  24           3HB      PHE  24  -1.415  -7.223  -7.198
  172    HD1  PHE  24           HD2      PHE  24   0.315  -7.247  -4.981
  173    HD2  PHE  24           HD1      PHE  24  -2.598  -4.243  -6.038
  174    HE1  PHE  24           HE2      PHE  24   0.119  -6.590  -2.592
  175    HE2  PHE  24           HE1      PHE  24  -2.810  -3.614  -3.647
  176    HZ   PHE  24           HZ       PHE  24  -1.453  -4.777  -1.922
  177    H    VAL  25           H        VAL  25   0.978  -8.579  -8.485
  178    HA   VAL  25           HA       VAL  25   0.088  -8.172 -11.299
  179    HB   VAL  25           HB       VAL  25   2.749  -9.437 -10.537
  180   HG11  VAL  25          1HG1      VAL  25   1.556  -8.631 -13.229
  181   HG12  VAL  25          2HG1      VAL  25   3.166  -9.326 -12.984
  182   HG13  VAL  25          3HG1      VAL  25   1.727 -10.295 -12.628
  183   HG21  VAL  25          3HG2      VAL  25   2.294  -6.693 -11.761
  184   HG22  VAL  25          1HG2      VAL  25   2.934  -7.025 -10.136
  185   HG23  VAL  25          2HG2      VAL  25   3.861  -7.507 -11.560
  186    H    ALA  26           H        ALA  26  -1.348  -9.618 -11.681
  187    HA   ALA  26           HA       ALA  26  -1.843 -12.057 -10.262
  188    HB1  ALA  26           1HB      ALA  26  -2.622 -11.193 -13.074
  189    HB2  ALA  26           2HB      ALA  26  -3.327 -12.552 -12.169
  190    HB3  ALA  26           3HB      ALA  26  -3.557 -10.892 -11.593
  191    H    LEU  27           H        LEU  27  -1.335 -14.088 -10.675
  192    HA   LEU  27           HA       LEU  27   0.286 -14.856 -13.058
  193    HB2  LEU  27           2HB      LEU  27   0.745 -15.595 -10.158
  194    HB3  LEU  27           3HB      LEU  27   1.439 -16.510 -11.502
  195    HG   LEU  27           HG       LEU  27   2.009 -13.547 -11.013
  196   HD11  LEU  27          1HD1      LEU  27   3.632 -16.012 -10.240
  197   HD12  LEU  27          2HD1      LEU  27   4.165 -14.325 -10.072
  198   HD13  LEU  27          3HD1      LEU  27   2.798 -14.920  -9.118
  199   HD21  LEU  27          3HD2      LEU  27   3.433 -15.580 -12.768
  200   HD22  LEU  27          1HD2      LEU  27   2.395 -14.256 -13.336
  201   HD23  LEU  27          2HD2      LEU  27   3.915 -13.890 -12.507
  202    H    ASP  28           H        ASP  28  -1.443 -15.901 -10.173
  203    HA   ASP  28           HA       ASP  28  -3.667 -17.118 -11.608
  204    HB2  ASP  28           2HB      ASP  28  -2.628 -19.154 -11.553
  205    HB3  ASP  28           3HB      ASP  28  -1.595 -18.735 -10.188
  206    H    GLU  29           H        GLU  29  -5.464 -17.318 -10.013
  207    HA   GLU  29           HA       GLU  29  -5.519 -14.988  -8.372
  208    HB2  GLU  29           2HB      GLU  29  -7.803 -15.555  -7.959
  209    HB3  GLU  29           3HB      GLU  29  -7.422 -15.878  -9.659
  210    HG2  GLU  29           2HG      GLU  29  -7.191 -18.314  -9.112
  211    HG3  GLU  29           3HG      GLU  29  -7.649 -17.947  -7.439
  212    H    GLU  30           H        GLU  30  -4.316 -18.028  -7.423
  213    HA   GLU  30           HA       GLU  30  -4.390 -17.088  -4.577
  214    HB2  GLU  30           2HB      GLU  30  -4.275 -19.907  -5.703
  215    HB3  GLU  30           3HB      GLU  30  -4.113 -19.482  -3.988
  216    HG2  GLU  30           2HG      GLU  30  -6.425 -18.457  -4.094
  217    HG3  GLU  30           3HG      GLU  30  -6.558 -19.088  -5.744
  218    H    THR  31           H        THR  31  -2.478 -16.796  -7.069
  219    HA   THR  31           HA       THR  31   0.075 -17.501  -5.664
  220    HB   THR  31           HB       THR  31  -0.476 -17.985  -8.600
  221    HG1  THR  31           1HG      THR  31  -0.734 -20.193  -8.029
  222   HG21  THR  31          1HG2      THR  31   1.619 -19.160  -6.722
  223   HG22  THR  31          2HG2      THR  31   1.421 -19.564  -8.439
  224   HG23  THR  31          3HG2      THR  31   1.924 -17.936  -7.972
  225    H    GLN  32           H        GLN  32  -1.718 -15.065  -7.161
  226    HA   GLN  32           HA       GLN  32   0.167 -13.506  -8.497
  227    HB2  GLN  32           2HB      GLN  32  -1.280 -11.737  -8.215
  228    HB3  GLN  32           3HB      GLN  32  -2.324 -13.153  -8.131
  229    HG2  GLN  32           2HG      GLN  32  -3.153 -11.714  -6.455
  230    HG3  GLN  32           3HG      GLN  32  -2.187 -12.914  -5.578
  231   HE21  GLN  32          2HE2      GLN  32  -1.338  -9.840  -7.337
  232   HE22  GLN  32          1HE2      GLN  32  -0.489  -9.141  -5.985
  233    H    GLY  33           H        GLY  33   1.247 -11.498  -7.861
  234    HA2  GLY  33           2HA      GLY  33   2.520 -11.727  -5.189
  235    HA3  GLY  33           3HA      GLY  33   3.521 -11.814  -6.647
  236    H    LEU  34           H        LEU  34   4.437  -9.992  -5.315
  237    HA   LEU  34           HA       LEU  34   3.220  -7.350  -6.019
  238    HB2  LEU  34           2HB      LEU  34   2.596  -7.778  -3.764
  239    HB3  LEU  34           3HB      LEU  34   4.218  -8.361  -3.343
  240    HG   LEU  34           HG       LEU  34   5.132  -6.080  -3.626
  241   HD11  LEU  34          1HD1      LEU  34   2.232  -5.215  -4.051
  242   HD12  LEU  34          2HD1      LEU  34   3.627  -4.133  -3.841
  243   HD13  LEU  34          3HD1      LEU  34   3.521  -5.160  -5.270
  244   HD21  LEU  34          3HD2      LEU  34   2.718  -6.235  -1.772
  245   HD22  LEU  34          1HD2      LEU  34   4.363  -6.805  -1.417
  246   HD23  LEU  34          2HD2      LEU  34   4.057  -5.073  -1.633
  247    H    VAL  35           H        VAL  35   4.646  -6.412  -7.332
  248    HA   VAL  35           HA       VAL  35   7.554  -6.778  -7.040
  249    HB   VAL  35           HB       VAL  35   6.054  -4.710  -8.706
  250   HG11  VAL  35          1HG1      VAL  35   8.826  -5.963  -8.939
  251   HG12  VAL  35          2HG1      VAL  35   8.137  -4.757 -10.045
  252   HG13  VAL  35          3HG1      VAL  35   8.476  -4.327  -8.365
  253   HG21  VAL  35          3HG2      VAL  35   6.892  -7.456  -9.656
  254   HG22  VAL  35          1HG2      VAL  35   5.217  -6.886  -9.433
  255   HG23  VAL  35          2HG2      VAL  35   6.256  -6.140 -10.649
  256    H    HIS  36           H        HIS  36   8.523  -5.646  -5.273
  257    HA   HIS  36           HA       HIS  36   7.198  -3.350  -4.069
  258    HB2  HIS  36           2HB      HIS  36   8.593  -4.823  -2.745
  259    HB3  HIS  36           3HB      HIS  36   9.998  -4.520  -3.778
  260    HD1  HIS  36           HD1      HIS  36   7.698  -1.855  -2.096
  261    HD2  HIS  36           HD2      HIS  36  11.682  -3.282  -2.162
  262    HE1  HIS  36           HE1      HIS  36   9.024  -0.321  -0.648
  263    H    ILE  37           H        ILE  37   7.780  -1.144  -4.328
  264    HA   ILE  37           HA       ILE  37   8.414  -0.322  -6.969
  265    HB   ILE  37           HB       ILE  37   7.123   1.011  -5.307
  266   HG12  ILE  37          2HG1      ILE  37   9.481   2.494  -6.462
  267   HG13  ILE  37          3HG1      ILE  37   8.086   1.907  -7.391
  268   HG21  ILE  37          1HG2      ILE  37   9.857   1.606  -4.073
  269   HG22  ILE  37          2HG2      ILE  37   8.342   2.415  -3.650
  270   HG23  ILE  37          3HG2      ILE  37   8.542   0.698  -3.295
  271   HD11  ILE  37          3HD1      ILE  37   6.575   3.342  -6.047
  272   HD12  ILE  37          1HD1      ILE  37   7.967   3.943  -5.120
  273   HD13  ILE  37          2HD1      ILE  37   7.837   4.303  -6.846
  274    H    SER  38           H        SER  38  10.759  -0.642  -4.313
  275    HA   SER  38           HA       SER  38  12.948   0.359  -5.875
  276    HB2  SER  38           2HB      SER  38  13.004  -1.604  -3.557
  277    HB3  SER  38           3HB      SER  38  14.305  -0.512  -4.083
  278    HG   SER  38           HG       SER  38  13.103   0.316  -2.293
  279    H    GLU  39           H        GLU  39  11.174  -2.350  -6.465
  280    HA   GLU  39           HA       GLU  39  13.392  -3.736  -7.887
  281    HB2  GLU  39           2HB      GLU  39  10.788  -4.976  -7.003
  282    HB3  GLU  39           3HB      GLU  39  12.243  -5.787  -7.588
  283    HG2  GLU  39           2HG      GLU  39  11.944  -4.334  -4.925
  284    HG3  GLU  39           3HG      GLU  39  11.914  -6.076  -5.176
  285    H    VAL  40           H        VAL  40  10.772  -1.673  -8.386
  286    HA   VAL  40           HA       VAL  40   9.935  -2.746 -10.993
  287    HB   VAL  40           HB       VAL  40   9.566  -0.078  -9.589
  288   HG11  VAL  40          1HG1      VAL  40   8.304  -1.022 -12.196
  289   HG12  VAL  40          2HG1      VAL  40   7.877   0.461 -11.311
  290   HG13  VAL  40          3HG1      VAL  40   9.486   0.290 -12.025
  291   HG21  VAL  40          3HG2      VAL  40   7.644  -2.375 -10.126
  292   HG22  VAL  40          1HG2      VAL  40   8.345  -1.939  -8.558
  293   HG23  VAL  40          2HG2      VAL  40   7.219  -0.831  -9.355
  294    H    THR  41           H        THR  41  12.275  -0.408  -9.825
  295    HA   THR  41           HA       THR  41  14.007  -0.822 -12.144
  296    HB   THR  41           HB       THR  41  12.813   1.873 -11.441
  297    HG1  THR  41           1HG      THR  41  12.221   1.751 -13.654
  298   HG21  THR  41          1HG2      THR  41  14.951   1.269 -13.524
  299   HG22  THR  41          2HG2      THR  41  14.138   2.832 -13.280
  300   HG23  THR  41          3HG2      THR  41  15.196   2.191 -12.020
  301    H    HIS  42           H        HIS  42  16.212   0.062 -11.495
  302    HA   HIS  42           HA       HIS  42  16.827  -0.899  -8.903
  303    HB2  HIS  42           2HB      HIS  42  18.468   0.639 -10.972
  304    HB3  HIS  42           3HB      HIS  42  19.131   0.062  -9.435
  305    HD1  HIS  42           HD1      HIS  42  17.967  -1.285 -12.818
  306    HD2  HIS  42           HD2      HIS  42  19.507  -2.626  -9.123
  307    HE1  HIS  42           HE1      HIS  42  18.535  -3.691 -13.136
  308    H    GLY  43           H        GLY  43  15.819   2.336  -9.644
  309    HA2  GLY  43           2HA      GLY  43  15.309   2.916  -6.996
  310    HA3  GLY  43           3HA      GLY  43  16.948   3.538  -7.268
  311    H    PHE  44           H        PHE  44  16.517   4.248 -10.034
  312    HA   PHE  44           HA       PHE  44  15.341   6.873  -9.735
  313    HB2  PHE  44           2HB      PHE  44  16.106   7.156 -12.070
  314    HB3  PHE  44           3HB      PHE  44  17.393   6.609 -11.002
  315    HD1  PHE  44           HD1      PHE  44  18.318   4.309 -11.186
  316    HD2  PHE  44           HD2      PHE  44  15.375   5.831 -13.953
  317    HE1  PHE  44           HE1      PHE  44  18.871   2.485 -12.780
  318    HE2  PHE  44           HE2      PHE  44  15.949   4.019 -15.554
  319    HZ   PHE  44           HZ       PHE  44  17.682   2.335 -14.968
  320    H    VAL  45           H        VAL  45  13.336   4.809  -9.365
  321    HA   VAL  45           HA       VAL  45  11.442   4.937 -11.493
  322    HB   VAL  45           HB       VAL  45  11.045   4.824  -8.470
  323   HG11  VAL  45          1HG1      VAL  45   9.104   4.154 -10.739
  324   HG12  VAL  45          2HG1      VAL  45   8.807   3.897  -9.004
  325   HG13  VAL  45          3HG1      VAL  45   8.976   5.542  -9.631
  326   HG21  VAL  45          3HG2      VAL  45  11.051   2.594 -10.546
  327   HG22  VAL  45          1HG2      VAL  45  12.314   2.887  -9.322
  328   HG23  VAL  45          2HG2      VAL  45  10.687   2.407  -8.820
  329    H    LYS  46           H        LYS  46  10.921   6.818 -12.496
  330    HA   LYS  46           HA       LYS  46  10.812   9.416 -11.296
  331    HB2  LYS  46           2HB      LYS  46   9.287   8.229 -13.648
  332    HB3  LYS  46           3HB      LYS  46   9.299   9.945 -13.229
  333    HG2  LYS  46           2HG      LYS  46  11.712   8.280 -14.040
  334    HG3  LYS  46           3HG      LYS  46  10.840   9.408 -15.083
  335    HD2  LYS  46           2HD      LYS  46  12.471  10.093 -12.611
  336    HD3  LYS  46           3HD      LYS  46  12.923  10.411 -14.289
  337    HE2  LYS  46           2HE      LYS  46  10.487  11.624 -12.916
  338    HE3  LYS  46           3HE      LYS  46  12.067  12.422 -13.012
  339    HZ1  LYS  46           3HZ      LYS  46  11.866  12.380 -15.402
  340    HZ2  LYS  46           1HZ      LYS  46  10.402  11.635 -15.319
  341    HZ3  LYS  46           2HZ      LYS  46  10.570  13.167 -14.741
  342    H    ASP  47           H        ASP  47   8.201   7.130 -12.054
  343    HA   ASP  47           HA       ASP  47   7.046   7.327  -9.410
  344    HB2  ASP  47           2HB      ASP  47   5.948   9.272 -10.628
  345    HB3  ASP  47           3HB      ASP  47   5.288   8.087 -11.768
  346    H    ILE  48           H        ILE  48   5.892   5.304  -9.112
  347    HA   ILE  48           HA       ILE  48   6.474   3.124 -10.876
  348    HB   ILE  48           HB       ILE  48   5.936   3.022  -8.411
  349   HG12  ILE  48          2HG1      ILE  48   4.327   1.210 -10.192
  350   HG13  ILE  48          3HG1      ILE  48   6.063   1.085  -9.854
  351   HG21  ILE  48          1HG2      ILE  48   3.054   3.358  -9.375
  352   HG22  ILE  48          2HG2      ILE  48   3.544   2.918  -7.741
  353   HG23  ILE  48          3HG2      ILE  48   3.952   4.508  -8.362
  354   HD11  ILE  48          3HD1      ILE  48   5.580   0.726  -7.447
  355   HD12  ILE  48          1HD1      ILE  48   3.838   0.831  -7.785
  356   HD13  ILE  48          2HD1      ILE  48   4.783  -0.495  -8.459
  357    H    ASN  49           H        ASN  49   3.754   5.345 -10.931
  358    HA   ASN  49           HA       ASN  49   2.258   3.797 -12.875
  359    HB2  ASN  49           2HB      ASN  49   2.112   6.716 -12.041
  360    HB3  ASN  49           3HB      ASN  49   0.937   5.912 -13.089
  361   HD21  ASN  49          2HD2      ASN  49   2.148   6.203  -9.769
  362   HD22  ASN  49          1HD2      ASN  49   0.794   5.364  -9.024
  363    H    GLU  50           H        GLU  50   5.103   5.714 -13.252
  364    HA   GLU  50           HA       GLU  50   4.603   5.930 -16.182
  365    HB2  GLU  50           2HB      GLU  50   6.957   6.833 -14.488
  366    HB3  GLU  50           3HB      GLU  50   6.768   7.086 -16.228
  367    HG2  GLU  50           2HG      GLU  50   4.445   8.183 -15.330
  368    HG3  GLU  50           3HG      GLU  50   5.480   8.491 -13.936
  369    H    HIS  51           H        HIS  51   6.575   4.172 -13.778
  370    HA   HIS  51           HA       HIS  51   8.110   2.793 -15.872
  371    HB2  HIS  51           2HB      HIS  51   8.033   2.713 -12.849
  372    HB3  HIS  51           3HB      HIS  51   9.051   1.589 -13.765
  373    HD1  HIS  51           HD1      HIS  51  11.399   2.451 -14.027
  374    HD2  HIS  51           HD2      HIS  51   8.612   5.550 -13.788
  375    HE1  HIS  51           HE1      HIS  51  12.729   4.580 -14.221
  376    H    LEU  52           H        LEU  52   5.110   2.225 -14.424
  377    HA   LEU  52           HA       LEU  52   4.818  -0.346 -15.827
  378    HB2  LEU  52           2HB      LEU  52   4.519   0.109 -12.858
  379    HB3  LEU  52           3HB      LEU  52   3.448  -1.035 -13.671
  380    HG   LEU  52           HG       LEU  52   6.488  -1.247 -13.698
  381   HD11  LEU  52          1HD1      LEU  52   4.395  -2.758 -12.076
  382   HD12  LEU  52          2HD1      LEU  52   6.138  -3.104 -12.100
  383   HD13  LEU  52          3HD1      LEU  52   5.550  -1.570 -11.432
  384   HD21  LEU  52          3HD2      LEU  52   4.323  -3.223 -14.544
  385   HD22  LEU  52          1HD2      LEU  52   5.392  -2.335 -15.647
  386   HD23  LEU  52          2HD2      LEU  52   6.071  -3.527 -14.543
  387    H    SER  53           H        SER  53   2.424  -0.943 -15.780
  388    HA   SER  53           HA       SER  53   0.545   1.331 -15.418
  389    HB2  SER  53           2HB      SER  53   0.841  -0.374 -17.928
  390    HB3  SER  53           3HB      SER  53  -0.481   0.770 -17.609
  391    HG   SER  53           HG       SER  53   1.237   1.671 -18.887
  392    H    VAL  54           H        VAL  54  -1.280   0.562 -14.340
  393    HA   VAL  54           HA       VAL  54  -1.779  -2.260 -13.881
  394    HB   VAL  54           HB       VAL  54  -2.496  -0.449 -12.358
  395   HG11  VAL  54          1HG1      VAL  54  -4.534   0.257 -14.515
  396   HG12  VAL  54          2HG1      VAL  54  -4.521   0.888 -12.858
  397   HG13  VAL  54          3HG1      VAL  54  -3.200   1.293 -13.967
  398   HG21  VAL  54          3HG2      VAL  54  -4.748  -2.152 -13.414
  399   HG22  VAL  54          1HG2      VAL  54  -3.553  -2.577 -12.168
  400   HG23  VAL  54          2HG2      VAL  54  -4.734  -1.287 -11.867
  401    H    GLY  55           H        GLY  55  -3.282  -3.621 -14.690
  402    HA2  GLY  55           2HA      GLY  55  -4.572  -4.605 -16.285
  403    HA3  GLY  55           3HA      GLY  55  -5.014  -2.984 -16.865
  404    H    ASP  56           H        ASP  56  -1.663  -4.142 -16.699
  405    HA   ASP  56           HA       ASP  56  -1.595  -4.508 -19.670
  406    HB2  ASP  56           2HB      ASP  56  -0.578  -2.388 -18.934
  407    HB3  ASP  56           3HB      ASP  56   0.547  -3.277 -17.892
  408    H    GLU  57           H        GLU  57   0.213  -5.963 -20.324
  409    HA   GLU  57           HA       GLU  57   0.527  -8.207 -18.373
  410    HB2  GLU  57           2HB      GLU  57  -0.709  -8.648 -20.469
  411    HB3  GLU  57           3HB      GLU  57   0.708  -8.119 -21.400
  412    HG2  GLU  57           2HG      GLU  57   2.037  -9.959 -20.426
  413    HG3  GLU  57           3HG      GLU  57   0.636 -10.489 -19.481
  414    H    VAL  58           H        VAL  58   2.539  -8.823 -17.758
  415    HA   VAL  58           HA       VAL  58   4.948  -7.500 -18.902
  416    HB   VAL  58           HB       VAL  58   5.622  -6.810 -16.598
  417   HG11  VAL  58          1HG1      VAL  58   3.030  -5.504 -17.565
  418   HG12  VAL  58          2HG1      VAL  58   4.196  -4.784 -16.444
  419   HG13  VAL  58          3HG1      VAL  58   4.665  -5.109 -18.121
  420   HG21  VAL  58          3HG2      VAL  58   2.757  -7.390 -15.793
  421   HG22  VAL  58          1HG2      VAL  58   4.216  -8.227 -15.222
  422   HG23  VAL  58          2HG2      VAL  58   3.968  -6.521 -14.823
  423    H    GLN  59           H        GLN  59   6.776  -8.647 -18.702
  424    HA   GLN  59           HA       GLN  59   6.668 -11.351 -17.584
  425    HB2  GLN  59           2HB      GLN  59   7.910 -10.701 -19.687
  426    HB3  GLN  59           3HB      GLN  59   9.020  -9.761 -18.669
  427    HG2  GLN  59           2HG      GLN  59   9.609 -11.842 -17.429
  428    HG3  GLN  59           3HG      GLN  59   8.514 -12.765 -18.470
  429   HE21  GLN  59          2HE2      GLN  59   9.479 -13.776 -20.185
  430   HE22  GLN  59          1HE2      GLN  59  10.988 -13.256 -20.924
  431    H    VAL  60           H        VAL  60   7.456 -11.852 -15.543
  432    HA   VAL  60           HA       VAL  60   8.751  -9.730 -13.856
  433    HB   VAL  60           HB       VAL  60   7.505 -10.920 -11.957
  434   HG11  VAL  60          1HG1      VAL  60   5.849  -9.335 -13.960
  435   HG12  VAL  60          2HG1      VAL  60   5.442  -9.588 -12.249
  436   HG13  VAL  60          3HG1      VAL  60   6.888  -8.668 -12.674
  437   HG21  VAL  60          3HG2      VAL  60   5.707 -11.924 -14.182
  438   HG22  VAL  60          1HG2      VAL  60   6.711 -12.910 -13.091
  439   HG23  VAL  60          2HG2      VAL  60   5.360 -11.966 -12.443
  440    H    LYS  61           H        LYS  61  10.374 -10.420 -12.512
  441    HA   LYS  61           HA       LYS  61  11.187 -13.287 -12.729
  442    HB2  LYS  61           2HB      LYS  61  12.878 -11.564 -13.243
  443    HB3  LYS  61           3HB      LYS  61  12.655 -10.866 -11.627
  444    HG2  LYS  61           2HG      LYS  61  13.483 -12.923 -10.576
  445    HG3  LYS  61           3HG      LYS  61  13.591 -13.723 -12.157
  446    HD2  LYS  61           2HD      LYS  61  15.252 -12.012 -12.879
  447    HD3  LYS  61           3HD      LYS  61  15.170 -11.290 -11.259
  448    HE2  LYS  61           2HE      LYS  61  17.115 -12.605 -11.199
  449    HE3  LYS  61           3HE      LYS  61  15.890 -13.582 -10.360
  450    HZ1  LYS  61           3HZ      LYS  61  15.614 -14.859 -12.395
  451    HZ2  LYS  61           1HZ      LYS  61  16.750 -13.935 -13.171
  452    HZ3  LYS  61           2HZ      LYS  61  17.171 -14.902 -11.908
  453    H    VAL  62           H        VAL  62  10.748 -14.622 -11.059
  454    HA   VAL  62           HA       VAL  62   9.443 -13.798  -8.644
  455    HB   VAL  62           HB       VAL  62  11.028 -16.345  -9.198
  456   HG11  VAL  62          1HG1      VAL  62   8.788 -15.713  -7.224
  457   HG12  VAL  62          2HG1      VAL  62   9.542 -17.303  -7.449
  458   HG13  VAL  62          3HG1      VAL  62  10.489 -15.955  -6.799
  459   HG21  VAL  62          3HG2      VAL  62   8.060 -15.794  -9.641
  460   HG22  VAL  62          1HG2      VAL  62   9.276 -16.051 -10.916
  461   HG23  VAL  62          2HG2      VAL  62   8.873 -17.370  -9.805
  462    H    LEU  63           H        LEU  63  10.325 -12.646  -7.053
  463    HA   LEU  63           HA       LEU  63  13.283 -12.567  -6.742
  464    HB2  LEU  63           2HB      LEU  63  11.997 -10.489  -7.085
  465    HB3  LEU  63           3HB      LEU  63  11.066 -10.827  -5.616
  466    HG   LEU  63           HG       LEU  63  13.140 -10.669  -4.263
  467   HD11  LEU  63          1HD1      LEU  63  14.459  -9.765  -6.868
  468   HD12  LEU  63          2HD1      LEU  63  15.198  -9.710  -5.252
  469   HD13  LEU  63          3HD1      LEU  63  14.823 -11.272  -5.990
  470   HD21  LEU  63          3HD2      LEU  63  12.583  -8.270  -6.058
  471   HD22  LEU  63          1HD2      LEU  63  11.702  -8.698  -4.576
  472   HD23  LEU  63          2HD2      LEU  63  13.406  -8.210  -4.486
  473    H    ALA  64           H        ALA  64  10.316 -13.368  -4.931
  474    HA   ALA  64           HA       ALA  64  11.822 -15.176  -3.186
  475    HB1  ALA  64           1HB      ALA  64  10.332 -12.815  -2.000
  476    HB2  ALA  64           2HB      ALA  64  10.973 -14.190  -1.095
  477    HB3  ALA  64           3HB      ALA  64  12.086 -13.084  -1.927
  478    H    VAL  65           H        VAL  65  10.284 -16.509  -1.915
  479    HA   VAL  65           HA       VAL  65   7.423 -16.350  -2.747
  480    HB   VAL  65           HB       VAL  65   9.169 -18.851  -2.667
  481   HG11  VAL  65          1HG1      VAL  65   6.212 -18.534  -3.378
  482   HG12  VAL  65          2HG1      VAL  65   7.153 -20.037  -3.502
  483   HG13  VAL  65          3HG1      VAL  65   6.847 -19.315  -1.914
  484   HG21  VAL  65          3HG2      VAL  65   7.834 -17.502  -5.049
  485   HG22  VAL  65          1HG2      VAL  65   9.581 -17.578  -4.723
  486   HG23  VAL  65          2HG2      VAL  65   8.689 -19.064  -5.075
  487    H    ASP  66           H        ASP  66   6.042 -16.710  -1.083
  488    HA   ASP  66           HA       ASP  66   7.067 -17.787   1.501
  489    HB2  ASP  66           2HB      ASP  66   6.994 -15.308   1.626
  490    HB3  ASP  66           3HB      ASP  66   5.269 -15.351   1.233
  491    H    GLU  67           H        GLU  67   6.196 -19.718   0.790
  492    HA   GLU  67           HA       GLU  67   3.566 -20.053  -0.303
  493    HB2  GLU  67           2HB      GLU  67   5.572 -21.534  -0.568
  494    HB3  GLU  67           3HB      GLU  67   5.373 -22.031   1.124
  495    HG2  GLU  67           2HG      GLU  67   3.139 -22.960   0.576
  496    HG3  GLU  67           3HG      GLU  67   3.347 -22.477  -1.117
  497    H    GLU  68           H        GLU  68   4.735 -19.936   3.060
  498    HA   GLU  68           HA       GLU  68   2.336 -21.026   4.220
  499    HB2  GLU  68           2HB      GLU  68   4.448 -19.147   5.346
  500    HB3  GLU  68           3HB      GLU  68   3.153 -19.907   6.294
  501    HG2  GLU  68           2HG      GLU  68   4.043 -22.160   5.621
  502    HG3  GLU  68           3HG      GLU  68   5.367 -21.339   4.776
  503    H    LYS  69           H        LYS  69   3.400 -17.650   3.487
  504    HA   LYS  69           HA       LYS  69   0.805 -16.529   4.192
  505    HB2  LYS  69           2HB      LYS  69   3.082 -15.374   4.117
  506    HB3  LYS  69           3HB      LYS  69   2.934 -15.397   2.354
  507    HG2  LYS  69           2HG      LYS  69   2.311 -13.221   3.227
  508    HG3  LYS  69           3HG      LYS  69   0.922 -14.015   2.478
  509    HD2  LYS  69           2HD      LYS  69   0.300 -12.810   4.531
  510    HD3  LYS  69           3HD      LYS  69  -0.037 -14.540   4.628
  511    HE2  LYS  69           2HE      LYS  69   0.846 -13.832   6.752
  512    HE3  LYS  69           3HE      LYS  69   2.054 -14.858   5.954
  513    HZ1  LYS  69           3HZ      LYS  69   3.234 -12.863   5.314
  514    HZ2  LYS  69           1HZ      LYS  69   2.108 -11.905   6.054
  515    HZ3  LYS  69           2HZ      LYS  69   3.058 -12.919   6.941
  516    H    GLY  70           H        GLY  70   1.978 -18.223   1.375
  517    HA2  GLY  70           2HA      GLY  70   1.000 -18.653  -0.665
  518    HA3  GLY  70           3HA      GLY  70  -0.508 -17.924  -0.070
  519    H    LYS  71           H        LYS  71   2.783 -16.509  -0.389
  520    HA   LYS  71           HA       LYS  71   1.765 -14.525  -2.379
  521    HB2  LYS  71           2HB      LYS  71   3.137 -14.040   0.278
  522    HB3  LYS  71           3HB      LYS  71   3.272 -12.873  -1.044
  523    HG2  LYS  71           2HG      LYS  71   0.593 -13.817   0.032
  524    HG3  LYS  71           3HG      LYS  71   1.462 -12.425   0.702
  525    HD2  LYS  71           2HD      LYS  71   1.411 -11.311  -1.515
  526    HD3  LYS  71           3HD      LYS  71   0.524 -12.699  -2.192
  527    HE2  LYS  71           2HE      LYS  71  -1.351 -12.318  -0.717
  528    HE3  LYS  71           3HE      LYS  71  -0.457 -11.073   0.184
  529    HZ1  LYS  71           3HZ      LYS  71  -0.464  -9.721  -1.809
  530    HZ2  LYS  71           1HZ      LYS  71  -1.282 -10.872  -2.650
  531    HZ3  LYS  71           2HZ      LYS  71  -2.004 -10.106  -1.373
  532    H    ILE  72           H        ILE  72   3.467 -13.416  -3.489
  533    HA   ILE  72           HA       ILE  72   6.139 -14.707  -3.572
  534    HB   ILE  72           HB       ILE  72   4.277 -14.231  -5.962
  535   HG12  ILE  72          2HG1      ILE  72   5.296 -16.752  -4.645
  536   HG13  ILE  72          3HG1      ILE  72   3.614 -16.223  -4.848
  537   HG21  ILE  72          1HG2      ILE  72   7.139 -15.275  -5.851
  538   HG22  ILE  72          2HG2      ILE  72   6.143 -15.153  -7.318
  539   HG23  ILE  72          3HG2      ILE  72   6.641 -13.693  -6.481
  540   HD11  ILE  72          3HD1      ILE  72   3.795 -16.571  -7.295
  541   HD12  ILE  72          1HD1      ILE  72   5.469 -17.130  -7.094
  542   HD13  ILE  72          2HD1      ILE  72   4.148 -18.064  -6.396
  543    H    SER  73           H        SER  73   7.674 -13.141  -3.547
  544    HA   SER  73           HA       SER  73   6.895 -10.343  -4.142
  545    HB2  SER  73           2HB      SER  73   9.603 -11.415  -3.309
  546    HB3  SER  73           3HB      SER  73   9.051  -9.733  -3.288
  547    HG   SER  73           HG       SER  73   8.936 -10.721  -1.199
  548    H    LEU  74           H        LEU  74   7.826  -9.235  -5.913
  549    HA   LEU  74           HA       LEU  74   8.970 -10.991  -8.055
  550    HB2  LEU  74           2HB      LEU  74   6.730  -8.975  -8.183
  551    HB3  LEU  74           3HB      LEU  74   7.442  -9.767  -9.604
  552    HG   LEU  74           HG       LEU  74   5.958 -11.214  -7.359
  553   HD11  LEU  74          1HD1      LEU  74   5.028 -10.471 -10.165
  554   HD12  LEU  74          2HD1      LEU  74   4.128 -11.467  -9.007
  555   HD13  LEU  74          3HD1      LEU  74   4.439  -9.757  -8.650
  556   HD21  LEU  74          3HD2      LEU  74   6.901 -12.214 -10.068
  557   HD22  LEU  74          1HD2      LEU  74   7.593 -12.645  -8.487
  558   HD23  LEU  74          2HD2      LEU  74   5.938 -13.126  -8.886
  559    H    SER  75           H        SER  75   9.980  -9.797  -9.752
  560    HA   SER  75           HA       SER  75  10.839  -7.005  -9.129
  561    HB2  SER  75           2HB      SER  75  12.688  -8.427  -8.545
  562    HB3  SER  75           3HB      SER  75  12.505  -9.370 -10.035
  563    HG   SER  75           HG       SER  75  14.210  -7.808 -10.148
  564    H    ILE  76           H        ILE  76  10.859  -5.704 -10.795
  565    HA   ILE  76           HA       ILE  76  10.348  -6.661 -13.598
  566    HB   ILE  76           HB       ILE  76   9.181  -4.400 -11.979
  567   HG12  ILE  76          2HG1      ILE  76   7.928  -6.448 -12.060
  568   HG13  ILE  76          3HG1      ILE  76   7.077  -5.065 -12.762
  569   HG21  ILE  76          1HG2      ILE  76   9.246  -4.484 -15.022
  570   HG22  ILE  76          2HG2      ILE  76   8.292  -3.349 -14.032
  571   HG23  ILE  76          3HG2      ILE  76  10.054  -3.298 -13.992
  572   HD11  ILE  76          3HD1      ILE  76   7.577  -5.907 -15.044
  573   HD12  ILE  76          1HD1      ILE  76   8.432  -7.287 -14.322
  574   HD13  ILE  76          2HD1      ILE  76   6.686  -7.090 -14.099
  575    H    ARG  77           H        ARG  77  12.351  -4.585 -11.483
  576    HA   ARG  77           HA       ARG  77  13.827  -3.447 -13.614
  577    HB2  ARG  77           2HB      ARG  77  15.646  -3.193 -12.080
  578    HB3  ARG  77           3HB      ARG  77  14.116  -2.850 -11.251
  579    HG2  ARG  77           2HG      ARG  77  14.191  -5.080 -10.178
  580    HG3  ARG  77           3HG      ARG  77  15.736  -5.416 -10.991
  581    HD2  ARG  77           2HD      ARG  77  16.792  -3.534  -9.819
  582    HD3  ARG  77           3HD      ARG  77  15.248  -3.094  -9.072
  583    HE   ARG  77           HE       ARG  77  15.372  -4.874  -7.622
  584   HH11  ARG  77          1HH1      ARG  77  18.261  -4.965  -9.735
  585   HH12  ARG  77          2HH1      ARG  77  19.014  -6.206  -8.786
  586   HH21  ARG  77          1HH2      ARG  77  16.295  -6.445  -6.509
  587   HH22  ARG  77          2HH2      ARG  77  17.894  -7.084  -6.894
  588    H    ALA  78           H        ALA  78  13.863  -6.754 -12.459
  589    HA   ALA  78           HA       ALA  78  16.094  -7.685 -13.969
  590    HB1  ALA  78           1HB      ALA  78  13.514  -9.092 -13.158
  591    HB2  ALA  78           2HB      ALA  78  15.025  -9.883 -13.661
  592    HB3  ALA  78           3HB      ALA  78  14.977  -8.942 -12.152
  593    H    THR  79           H        THR  79  12.882  -6.743 -15.056
  594    HA   THR  79           HA       THR  79  13.294  -8.087 -17.696
  595    HB   THR  79           HB       THR  79  10.836  -8.432 -17.678
  596    HG1  THR  79           1HG      THR  79   9.769  -8.150 -15.666
  597   HG21  THR  79          1HG2      THR  79  12.173  -9.616 -15.197
  598   HG22  THR  79          2HG2      THR  79  10.702 -10.224 -15.976
  599   HG23  THR  79          3HG2      THR  79  12.250 -10.296 -16.839
  600    H    GLN  80           H        GLN  80  13.306  -5.127 -16.336
  601    HA   GLN  80           HA       GLN  80  11.475  -3.511 -17.725
  602    HB2  GLN  80           2HB      GLN  80  14.056  -3.125 -16.283
  603    HB3  GLN  80           3HB      GLN  80  13.625  -1.849 -17.420
  604    HG2  GLN  80           2HG      GLN  80  11.933  -2.776 -15.082
  605    HG3  GLN  80           3HG      GLN  80  12.907  -1.310 -15.149
  606   HE21  GLN  80          2HE2      GLN  80  10.291  -1.067 -14.455
  607   HE22  GLN  80          1HE2      GLN  80   9.349  -0.341 -15.771
  608    H    ALA  81           H        ALA  81  11.788  -1.953 -19.314
  609    HA   ALA  81           HA       ALA  81  14.036  -2.304 -21.241
  610    HB1  ALA  81           1HB      ALA  81  11.084  -2.020 -21.976
  611    HB2  ALA  81           2HB      ALA  81  12.449  -1.993 -23.115
  612    HB3  ALA  81           3HB      ALA  81  12.082  -3.474 -22.203
  613    H    ALA  82           H        ALA  82  11.148  -0.237 -20.611
  614    HA   ALA  82           HA       ALA  82  12.735   2.062 -19.825
  615    HB1  ALA  82           1HB      ALA  82  11.252   2.108 -22.493
  616    HB2  ALA  82           2HB      ALA  82  11.939   3.525 -21.674
  617    HB3  ALA  82           3HB      ALA  82  13.015   2.247 -22.278
  618    HA   PRO  83           HA       PRO  83   8.613   2.916 -18.172
  619    HB2  PRO  83           2HB      PRO  83   8.825   5.603 -17.615
  620    HB3  PRO  83           3HB      PRO  83   9.599   4.350 -16.613
  621    HG2  PRO  83           2HG      PRO  83  10.780   6.063 -18.851
  622    HG3  PRO  83           3HG      PRO  83  11.501   5.708 -17.257
  623    HD2  PRO  83           2HD      PRO  83  12.184   4.298 -19.542
  624    HD3  PRO  83           3HD      PRO  83  12.166   3.532 -17.932
  625    H    GLU  84           H        GLU  84   6.814   4.625 -18.637
  626    HA   GLU  84           HA       GLU  84   6.943   5.746 -21.407
  627    HB2  GLU  84           2HB      GLU  84   5.594   3.693 -21.359
  628    HB3  GLU  84           3HB      GLU  84   4.633   4.345 -20.019
  629    HG2  GLU  84           2HG      GLU  84   3.421   4.537 -22.147
  630    HG3  GLU  84           3HG      GLU  84   3.768   6.122 -21.455
  631    H    LYS  85           H        LYS  85   6.056   7.787 -21.625
  632    HA   LYS  85           HA       LYS  85   5.852   9.386 -19.206
  633    HB2  LYS  85           2HB      LYS  85   6.800  10.162 -21.379
  634    HB3  LYS  85           3HB      LYS  85   5.184  10.058 -22.093
  635    HG2  LYS  85           2HG      LYS  85   5.937  12.367 -21.456
  636    HG3  LYS  85           3HG      LYS  85   4.370  11.863 -20.805
  637    HD2  LYS  85           2HD      LYS  85   5.819  13.177 -19.211
  638    HD3  LYS  85           3HD      LYS  85   5.231  11.621 -18.608
  639    HE2  LYS  85           2HE      LYS  85   7.511  10.662 -19.385
  640    HE3  LYS  85           3HE      LYS  85   8.036  12.355 -19.516
  641    HZ1  LYS  85           3HZ      LYS  85   7.515  12.620 -17.175
  642    HZ2  LYS  85           1HZ      LYS  85   7.009  11.036 -17.060
  643    HZ3  LYS  85           2HZ      LYS  85   8.575  11.404 -17.377
  644    H    LYS  86           H        LYS  86   4.201   9.421 -17.926
  645    HA   LYS  86           HA       LYS  86   1.417   8.940 -18.949
  646    HB2  LYS  86           2HB      LYS  86   2.813   7.668 -16.578
  647    HB3  LYS  86           3HB      LYS  86   1.088   7.543 -16.904
  648    HG2  LYS  86           2HG      LYS  86   3.001   6.666 -19.048
  649    HG3  LYS  86           3HG      LYS  86   2.851   5.648 -17.623
  650    HD2  LYS  86           2HD      LYS  86   0.576   6.491 -19.446
  651    HD3  LYS  86           3HD      LYS  86   1.397   4.923 -19.489
  652    HE2  LYS  86           2HE      LYS  86  -0.280   6.037 -17.201
  653    HE3  LYS  86           3HE      LYS  86  -0.755   4.747 -18.323
  654    HZ1  LYS  86           3HZ      LYS  86   1.037   3.396 -17.402
  655    HZ2  LYS  86           1HZ      LYS  86   1.469   4.599 -16.370
  656    HZ3  LYS  86           2HZ      LYS  86   0.008   3.873 -16.215
  657    H    GLU  87           H        GLU  87   2.720  11.413 -18.449
  658    HA   GLU  87           HA       GLU  87   2.341  12.536 -15.877
  659    HB2  GLU  87           2HB      GLU  87   3.709  13.432 -17.715
  660    HB3  GLU  87           3HB      GLU  87   2.249  13.801 -18.636
  661    HG2  GLU  87           2HG      GLU  87   2.840  15.028 -15.908
  662    HG3  GLU  87           3HG      GLU  87   3.424  15.705 -17.435
  663    H    SER  88           H        SER  88   0.043  12.119 -18.517
  664    HA   SER  88           HA       SER  88  -2.215  12.600 -16.696
  665    HB2  SER  88           2HB      SER  88  -3.206  14.105 -18.559
  666    HB3  SER  88           3HB      SER  88  -2.059  14.810 -17.407
  667    HG   SER  88           HG       SER  88  -1.547  15.410 -19.470
  668    H    LYS  89           H        LYS  89  -4.301  12.052 -17.824
  669    HA   LYS  89           HA       LYS  89  -4.098   9.420 -18.901
  670    HB2  LYS  89           2HB      LYS  89  -6.418  11.389 -18.839
  671    HB3  LYS  89           3HB      LYS  89  -6.565   9.690 -19.327
  672    HG2  LYS  89           2HG      LYS  89  -5.746   8.982 -17.082
  673    HG3  LYS  89           3HG      LYS  89  -5.662  10.687 -16.589
  674    HD2  LYS  89           2HD      LYS  89  -8.102  10.922 -16.971
  675    HD3  LYS  89           3HD      LYS  89  -8.188   9.212 -17.462
  676    HE2  LYS  89           2HE      LYS  89  -7.354   8.531 -15.234
  677    HE3  LYS  89           3HE      LYS  89  -7.265  10.237 -14.743
  678    HZ1  LYS  89           3HZ      LYS  89  -9.653  10.374 -15.026
  679    HZ2  LYS  89           1HZ      LYS  89  -9.733   8.793 -15.482
  680    HZ3  LYS  89           2HZ      LYS  89  -9.274   9.188 -13.952
  681    HA   PRO  90           HA       PRO  90  -3.827  10.263 -23.286
  682    HB2  PRO  90           2HB      PRO  90  -5.011   7.998 -24.318
  683    HB3  PRO  90           3HB      PRO  90  -3.342   8.031 -23.684
  684    HG2  PRO  90           2HG      PRO  90  -5.928   7.134 -22.324
  685    HG3  PRO  90           3HG      PRO  90  -4.336   6.327 -22.286
  686    HD2  PRO  90           2HD      PRO  90  -5.221   7.971 -20.240
  687    HD3  PRO  90           3HD      PRO  90  -3.494   7.849 -20.672
  688    H    ARG  91           H        ARG  91  -5.230  10.796 -25.031
  689    HA   ARG  91           HA       ARG  91  -7.043  11.894 -25.940
  690    HB2  ARG  91           2HB      ARG  91  -7.636   9.321 -25.898
  691    HB3  ARG  91           3HB      ARG  91  -8.844   9.824 -24.701
  692    HG2  ARG  91           2HG      ARG  91  -9.778  11.441 -26.370
  693    HG3  ARG  91           3HG      ARG  91  -8.574  10.891 -27.548
  694    HD2  ARG  91           2HD      ARG  91 -10.654   9.765 -28.035
  695    HD3  ARG  91           3HD      ARG  91  -9.534   8.568 -27.350
  696    HE   ARG  91           HE       ARG  91 -11.145   9.769 -25.303
  697   HH11  ARG  91          1HH1      ARG  91 -11.320   7.363 -27.902
  698   HH12  ARG  91          2HH1      ARG  91 -12.585   6.445 -27.150
  699   HH21  ARG  91          1HH2      ARG  91 -12.822   8.543 -24.326
  700   HH22  ARG  91          2HH2      ARG  91 -13.443   7.122 -25.102
  701    H    LYS  92           H        LYS  92  -6.234  12.699 -23.194
  702    HA   LYS  92           HA       LYS  92  -8.487  13.818 -21.898
  703    HB2  LYS  92           2HB      LYS  92  -6.907  15.444 -20.988
  704    HB3  LYS  92           3HB      LYS  92  -6.222  13.810 -20.956
  705    HG2  LYS  92           2HG      LYS  92  -4.933  14.360 -23.043
  706    HG3  LYS  92           3HG      LYS  92  -5.568  16.017 -22.961
  707    HD2  LYS  92           2HD      LYS  92  -4.482  16.327 -20.753
  708    HD3  LYS  92           3HD      LYS  92  -3.853  14.660 -20.834
  709    HE2  LYS  92           2HE      LYS  92  -2.663  15.242 -22.947
  710    HE3  LYS  92           3HE      LYS  92  -3.247  16.916 -22.795
  711    HZ1  LYS  92           3HZ      LYS  92  -2.037  17.086 -20.717
  712    HZ2  LYS  92           1HZ      LYS  92  -1.490  15.525 -20.892
  713    HZ3  LYS  92           2HZ      LYS  92  -1.015  16.675 -21.941
  714    HA   PRO  93           HA       PRO  93  -9.767  17.021 -24.756
  715    HB2  PRO  93           2HB      PRO  93 -10.607  19.003 -23.019
  716    HB3  PRO  93           3HB      PRO  93 -11.586  17.567 -23.429
  717    HG2  PRO  93           2HG      PRO  93  -9.790  18.098 -21.014
  718    HG3  PRO  93           3HG      PRO  93 -11.406  17.342 -21.024
  719    HD2  PRO  93           2HD      PRO  93  -9.079  15.855 -20.924
  720    HD3  PRO  93           3HD      PRO  93 -10.536  15.260 -21.762
  721    H    LYS  94           H        LYS  94  -8.893  19.005 -25.590
  722    HA   LYS  94           HA       LYS  94  -6.207  19.672 -24.842
  723    HB2  LYS  94           2HB      LYS  94  -8.268  21.182 -26.501
  724    HB3  LYS  94           3HB      LYS  94  -6.568  21.667 -26.325
  725    HG2  LYS  94           2HG      LYS  94  -5.839  19.517 -27.304
  726    HG3  LYS  94           3HG      LYS  94  -7.531  19.010 -27.462
  727    HD2  LYS  94           2HD      LYS  94  -6.759  19.749 -29.620
  728    HD3  LYS  94           3HD      LYS  94  -7.939  20.927 -29.004
  729    HE2  LYS  94           2HE      LYS  94  -6.108  22.422 -28.305
  730    HE3  LYS  94           3HE      LYS  94  -4.907  21.231 -28.848
  731    HZ1  LYS  94           3HZ      LYS  94  -5.730  21.523 -31.093
  732    HZ2  LYS  94           1HZ      LYS  94  -6.846  22.625 -30.586
  733    HZ3  LYS  94           2HZ      LYS  94  -5.240  22.967 -30.474
  734    H    ALA  95           H        ALA  95  -5.487  20.920 -23.242
  735    HA   ALA  95           HA       ALA  95  -6.887  23.318 -22.298
  736    HB1  ALA  95           1HB      ALA  95  -6.313  20.961 -20.444
  737    HB2  ALA  95           2HB      ALA  95  -6.804  22.589 -19.927
  738    HB3  ALA  95           3HB      ALA  95  -7.924  21.585 -20.871
  739    H    ALA  96           H        ALA  96  -5.415  24.697 -21.176
  740    HA   ALA  96           HA       ALA  96  -2.588  24.340 -21.611
  741    HB1  ALA  96           1HB      ALA  96  -4.106  26.178 -19.706
  742    HB2  ALA  96           2HB      ALA  96  -2.387  26.317 -20.136
  743    HB3  ALA  96           3HB      ALA  96  -3.632  26.568 -21.378
  744    H    GLN  97           H        GLN  97  -1.003  23.648 -20.254
  745    HA   GLN  97           HA       GLN  97  -1.440  23.135 -17.419
  746    HB2  GLN  97           2HB      GLN  97  -0.745  20.798 -17.507
  747    HB3  GLN  97           3HB      GLN  97  -2.287  21.055 -18.330
  748    HG2  GLN  97           2HG      GLN  97  -1.231  20.829 -20.521
  749    HG3  GLN  97           3HG      GLN  97   0.381  20.808 -19.786
  750   HE21  GLN  97          2HE2      GLN  97   1.259  18.797 -19.455
  751   HE22  GLN  97          1HE2      GLN  97   0.351  17.311 -19.256
  752    H    VAL  98           H        VAL  98   0.721  22.135 -16.552
  753    HA   VAL  98           HA       VAL  98   3.065  23.357 -17.952
  754    HB   VAL  98           HB       VAL  98   2.595  23.223 -14.945
  755   HG11  VAL  98          1HG1      VAL  98   4.687  24.694 -16.622
  756   HG12  VAL  98          2HG1      VAL  98   4.526  24.782 -14.853
  757   HG13  VAL  98          3HG1      VAL  98   4.986  23.252 -15.628
  758   HG21  VAL  98          3HG2      VAL  98   2.345  25.629 -16.798
  759   HG22  VAL  98          1HG2      VAL  98   1.011  24.834 -15.932
  760   HG23  VAL  98          2HG2      VAL  98   2.277  25.668 -15.022
  761    H    SER  99           H        SER  99   3.079  21.336 -19.015
  762    HA   SER  99           HA       SER  99   3.461  18.790 -17.869
  763    HB2  SER  99           2HB      SER  99   4.781  19.828 -20.400
  764    HB3  SER  99           3HB      SER  99   4.226  18.177 -20.043
  765    HG   SER  99           HG       SER  99   2.764  19.345 -21.396
  766    H    GLU 100           H        GLU 100   5.352  17.506 -17.561
  767    HA   GLU 100           HA       GLU 100   7.703  18.738 -16.493
  768    HB2  GLU 100           2HB      GLU 100   6.889  16.431 -16.002
  769    HB3  GLU 100           3HB      GLU 100   7.302  15.951 -17.662
  770    HG2  GLU 100           2HG      GLU 100   9.707  16.514 -17.183
  771    HG3  GLU 100           3HG      GLU 100   9.209  17.022 -15.560
  772    H    GLU 101           H        GLU 101   9.500  19.521 -17.494
  773    HA   GLU 101           HA       GLU 101   9.444  19.826 -20.413
  774    HB2  GLU 101           2HB      GLU 101  11.266  20.848 -18.208
  775    HB3  GLU 101           3HB      GLU 101  11.493  21.232 -19.923
  776    HG2  GLU 101           2HG      GLU 101   8.950  21.849 -18.380
  777    HG3  GLU 101           3HG      GLU 101  10.276  23.000 -18.556
  778    H    ALA 102           H        ALA 102  10.832  17.562 -18.304
  779    HA   ALA 102           HA       ALA 102  13.307  17.055 -19.704
  780    HB1  ALA 102           1HB      ALA 102  11.818  15.415 -17.605
  781    HB2  ALA 102           2HB      ALA 102  13.508  15.184 -18.103
  782    HB3  ALA 102           3HB      ALA 102  13.027  16.678 -17.274
  783    H    SER 103           H        SER 103  11.249  16.973 -21.616
  784    HA   SER 103           HA       SER 103  10.140  14.429 -22.154
  785    HB2  SER 103           2HB      SER 103  10.992  16.488 -24.218
  786    HB3  SER 103           3HB      SER 103   9.654  15.321 -24.320
  787    HG   SER 103           HG       SER 103   8.944  17.456 -23.741
  788    H    THR 104           H        THR 104  13.183  15.829 -23.492
  789    HA   THR 104           HA       THR 104  13.817  13.711 -25.197
  790    HB   THR 104           HB       THR 104  15.779  15.495 -23.721
  791    HG1  THR 104           1HG      THR 104  15.321  16.936 -25.481
  792   HG21  THR 104          1HG2      THR 104  15.857  14.291 -26.526
  793   HG22  THR 104          2HG2      THR 104  17.079  15.376 -25.823
  794   HG23  THR 104          3HG2      THR 104  16.836  13.754 -25.145
  795    HA   PRO 105           HA       PRO 105  16.460  11.350 -22.146
  796    HB2  PRO 105           2HB      PRO 105  16.122  11.561 -19.431
  797    HB3  PRO 105           3HB      PRO 105  17.324  12.479 -20.376
  798    HG2  PRO 105           2HG      PRO 105  14.574  13.420 -19.492
  799    HG3  PRO 105           3HG      PRO 105  16.134  14.288 -19.395
  800    HD2  PRO 105           2HD      PRO 105  14.413  14.749 -21.463
  801    HD3  PRO 105           3HD      PRO 105  16.170  14.696 -21.750
  802    H    GLN 106           H        GLN 106  13.146  11.797 -22.148
  803    HA   GLN 106           HA       GLN 106  12.558   9.007 -21.243
  804    HB2  GLN 106           2HB      GLN 106  10.889  11.522 -20.890
  805    HB3  GLN 106           3HB      GLN 106  10.394   9.878 -20.442
  806    HG2  GLN 106           2HG      GLN 106  12.112   9.757 -18.717
  807    HG3  GLN 106           3HG      GLN 106  12.790  11.320 -19.210
  808   HE21  GLN 106          2HE2      GLN 106  11.224  13.244 -19.103
  809   HE22  GLN 106          1HE2      GLN 106  10.105  13.265 -17.732
  810    H    GLY 107           H        GLY 107  13.086  10.546 -23.966
  811    HA2  GLY 107           2HA      GLY 107  11.296   9.282 -25.725
  812    HA3  GLY 107           3HA      GLY 107  10.559  10.837 -25.285
  813    H    PHE 108           H        PHE 108  13.735   9.488 -26.195
  814    HA   PHE 108           HA       PHE 108  15.018  11.916 -26.824
  815    HB2  PHE 108           2HB      PHE 108  15.587   9.079 -27.782
  816    HB3  PHE 108           3HB      PHE 108  16.696  10.444 -27.955
  817    HD1  PHE 108           HD2      PHE 108  17.789  11.460 -25.990
  818    HD2  PHE 108           HD1      PHE 108  15.341   7.921 -25.664
  819    HE1  PHE 108           HE2      PHE 108  18.782  10.975 -23.763
  820    HE2  PHE 108           HE1      PHE 108  16.316   7.454 -23.428
  821    HZ   PHE 108           HZ       PHE 108  18.042   8.973 -22.477
  822    H    ASN 109           H        ASN 109  12.616  10.469 -28.782
  823    HA   ASN 109           HA       ASN 109  13.404  11.178 -31.388
  824    HB2  ASN 109           2HB      ASN 109  11.361   9.905 -30.845
  825    HB3  ASN 109           3HB      ASN 109  10.644  11.351 -30.106
  826   HD21  ASN 109          2HD2      ASN 109  11.957  10.098 -33.224
  827   HD22  ASN 109          1HD2      ASN 109  10.916  11.087 -34.222
  828    H    THR 110           H        THR 110  12.493  13.379 -28.778
  829    HA   THR 110           HA       THR 110  12.003  15.733 -30.270
  830    HB   THR 110           HB       THR 110  12.957  16.826 -28.163
  831    HG1  THR 110           1HG      THR 110  13.360  15.319 -26.466
  832   HG21  THR 110          1HG2      THR 110  10.862  14.636 -27.758
  833   HG22  THR 110          2HG2      THR 110  11.125  16.037 -26.697
  834   HG23  THR 110          3HG2      THR 110  10.542  16.280 -28.355
  835    H    LEU 111           H        LEU 111  15.073  14.129 -29.532
  836    HA   LEU 111           HA       LEU 111  16.718  16.375 -30.419
  837    HB2  LEU 111           2HB      LEU 111  17.231  14.816 -28.518
  838    HB3  LEU 111           3HB      LEU 111  17.494  13.529 -29.707
  839    HG   LEU 111           HG       LEU 111  19.376  14.811 -30.688
  840   HD11  LEU 111          1HD1      LEU 111  18.907  16.792 -28.409
  841   HD12  LEU 111          2HD1      LEU 111  20.281  16.804 -29.539
  842   HD13  LEU 111          3HD1      LEU 111  18.654  17.125 -30.137
  843   HD21  LEU 111          3HD2      LEU 111  19.556  14.452 -27.667
  844   HD22  LEU 111          1HD2      LEU 111  19.817  13.193 -28.894
  845   HD23  LEU 111          2HD2      LEU 111  20.941  14.563 -28.781
  846    H    LYS 112           H        LYS 112  15.156  16.063 -32.454
  847    HA   LYS 112           HA       LYS 112  15.981  14.281 -34.520
  848    HB2  LYS 112           2HB      LYS 112  14.894  17.122 -34.730
  849    HB3  LYS 112           3HB      LYS 112  14.987  15.949 -36.061
  850    HG2  LYS 112           2HG      LYS 112  13.483  14.416 -34.767
  851    HG3  LYS 112           3HG      LYS 112  13.327  15.672 -33.519
  852    HD2  LYS 112           2HD      LYS 112  12.349  17.219 -35.198
  853    HD3  LYS 112           3HD      LYS 112  12.487  15.949 -36.439
  854    HE2  LYS 112           2HE      LYS 112  11.021  14.476 -35.093
  855    HE3  LYS 112           3HE      LYS 112  10.889  15.735 -33.850
  856    HZ1  LYS 112           3HZ      LYS 112   9.823  17.146 -35.482
  857    HZ2  LYS 112           1HZ      LYS 112   9.943  15.977 -36.638
  858    HZ3  LYS 112           2HZ      LYS 112   8.993  15.737 -35.320
  859    H    ASP 113           H        ASP 113  17.462  14.463 -36.173
  860    HA   ASP 113           HA       ASP 113  19.278  16.751 -36.424
  861    HB2  ASP 113           2HB      ASP 113  20.371  15.474 -34.640
  862    HB3  ASP 113           3HB      ASP 113  20.241  13.989 -35.600
  863    H    LYS 114           H        LYS 114  20.410  16.631 -38.460
  864    HA   LYS 114           HA       LYS 114  19.992  14.347 -40.263
  865    HB2  LYS 114           2HB      LYS 114  17.908  15.723 -40.454
  866    HB3  LYS 114           3HB      LYS 114  18.909  17.118 -40.912
  867    HG2  LYS 114           2HG      LYS 114  19.626  16.006 -42.950
  868    HG3  LYS 114           3HG      LYS 114  18.847  14.492 -42.450
  869    HD2  LYS 114           2HD      LYS 114  17.484  15.567 -44.139
  870    HD3  LYS 114           3HD      LYS 114  16.629  15.606 -42.583
  871    HE2  LYS 114           2HE      LYS 114  17.323  17.949 -42.242
  872    HE3  LYS 114           3HE      LYS 114  18.234  17.916 -43.765
  873    HZ1  LYS 114           3HZ      LYS 114  16.158  17.565 -44.925
  874    HZ2  LYS 114           1HZ      LYS 114  15.310  17.597 -43.513
  875    HZ3  LYS 114           2HZ      LYS 114  16.085  18.951 -44.038
  876    H    LEU 115           H        LEU 115  21.508  14.351 -41.933
  877    HA   LEU 115           HA       LEU 115  23.153  16.743 -42.467
  878    HB2  LEU 115           2HB      LEU 115  24.343  15.441 -40.747
  879    HB3  LEU 115           3HB      LEU 115  24.268  14.002 -41.780
  880    HG   LEU 115           HG       LEU 115  25.712  15.111 -43.452
  881   HD11  LEU 115          1HD1      LEU 115  25.900  17.401 -41.443
  882   HD12  LEU 115          2HD1      LEU 115  26.861  17.241 -42.932
  883   HD13  LEU 115          3HD1      LEU 115  25.114  17.488 -43.032
  884   HD21  LEU 115          3HD2      LEU 115  26.848  15.199 -40.626
  885   HD22  LEU 115          1HD2      LEU 115  26.765  13.773 -41.682
  886   HD23  LEU 115          2HD2      LEU 115  27.805  15.142 -42.129
  887    H    GLU 116           H        GLU 116  24.080  16.615 -44.615
  888    HA   GLU 116           HA       GLU 116  22.333  15.386 -46.529
  889    HB2  GLU 116           2HB      GLU 116  23.731  16.449 -48.171
  890    HB3  GLU 116           3HB      GLU 116  23.443  17.565 -46.825
  891    HG2  GLU 116           2HG      GLU 116  25.710  17.020 -45.914
  892    HG3  GLU 116           3HG      GLU 116  25.982  15.945 -47.295
  893    H    GLU 117           H        GLU 117  24.972  14.026 -44.926
  894    HA   GLU 117           HA       GLU 117  24.800  11.591 -46.576
  895    HB2  GLU 117           2HB      GLU 117  26.614  12.949 -47.566
  896    HB3  GLU 117           3HB      GLU 117  27.384  13.071 -45.976
  897    HG2  GLU 117           2HG      GLU 117  28.479  11.414 -47.453
  898    HG3  GLU 117           3HG      GLU 117  27.861  10.697 -45.965
  899    H    TRP 118           H        TRP 118  25.783   9.773 -45.317
  900    HA   TRP 118           HA       TRP 118  25.527  10.230 -42.356
  901    HB2  TRP 118           2HB      TRP 118  24.329   7.945 -43.958
  902    HB3  TRP 118           3HB      TRP 118  24.093   8.299 -42.241
  903    HD1  TRP 118           HD1      TRP 118  22.939   9.168 -45.639
  904    HE1  TRP 118           HE1      TRP 118  20.775  10.634 -45.545
  905    HE3  TRP 118           HE3      TRP 118  22.906  10.199 -40.628
  906    HZ2  TRP 118           HZ2      TRP 118  19.241  11.955 -43.511
  907    HZ3  TRP 118           HZ3      TRP 118  21.124  11.508 -39.626
  908    HH2  TRP 118           HH2      TRP 118  19.233  12.369 -41.002
  909    H    ILE 119           H        ILE 119  27.759   9.396 -44.548
  910    HA   ILE 119           HA       ILE 119  29.040   7.087 -43.430
  911    HB   ILE 119           HB       ILE 119  29.613   8.278 -45.589
  912   HG12  ILE 119          2HG1      ILE 119  31.932   7.846 -43.713
  913   HG13  ILE 119          3HG1      ILE 119  31.027   6.580 -44.571
  914   HG21  ILE 119          1HG2      ILE 119  30.998  10.274 -43.733
  915   HG22  ILE 119          2HG2      ILE 119  31.169  10.223 -45.498
  916   HG23  ILE 119          3HG2      ILE 119  29.617  10.626 -44.780
  917   HD11  ILE 119          3HD1      ILE 119  31.734   7.539 -46.746
  918   HD12  ILE 119          1HD1      ILE 119  32.655   8.798 -45.895
  919   HD13  ILE 119          2HD1      ILE 119  33.136   7.108 -45.743
  920    H    GLU 120           H        GLU 120  30.576   6.762 -41.881
  921    HA   GLU 120           HA       GLU 120  30.158   8.049 -39.401
  922    HB2  GLU 120           2HB      GLU 120  31.037   5.740 -39.849
  923    HB3  GLU 120           3HB      GLU 120  32.583   6.469 -40.329
  924    HG2  GLU 120           2HG      GLU 120  32.905   7.375 -38.095
  925    HG3  GLU 120           3HG      GLU 120  31.302   6.823 -37.581
  926    H    MET 121           H        MET 121  32.441   8.861 -41.959
  927    HA   MET 121           HA       MET 121  34.034  10.707 -40.419
  928    HB2  MET 121           2HB      MET 121  33.513  10.566 -43.415
  929    HB3  MET 121           3HB      MET 121  34.790  11.514 -42.629
  930    HG2  MET 121           2HG      MET 121  35.796   9.428 -41.758
  931    HG3  MET 121           3HG      MET 121  34.540   8.487 -42.582
  932    HE1  MET 121           3HE      MET 121  37.643   7.900 -42.911
  933    HE2  MET 121           1HE      MET 121  36.367   6.983 -43.744
  934    HE3  MET 121           2HE      MET 121  37.746   7.623 -44.665
  935    H    SER 122           H        SER 122  30.779  11.008 -41.229
  936    HA   SER 122           HA       SER 122  29.315  12.726 -41.618
  937    HB2  SER 122           2HB      SER 122  31.267  14.399 -40.002
  938    HB3  SER 122           3HB      SER 122  29.532  14.690 -40.227
  939    HG   SER 122           HG       SER 122  29.992  13.648 -38.216
  940    H    ASN 123           H        ASN 123  31.236  12.217 -43.584
  941    HA   ASN 123           HA       ASN 123  32.274  12.977 -45.477
  942    HB2  ASN 123           2HB      ASN 123  29.815  13.345 -45.991
  943    HB3  ASN 123           3HB      ASN 123  30.058  15.049 -45.567
  944   HD21  ASN 123          2HD2      ASN 123  30.173  16.246 -47.472
  945   HD22  ASN 123          1HD2      ASN 123  31.082  15.769 -48.886
  946    H    ARG 124           H        ARG 124  33.154  14.307 -42.883
  947    HA   ARG 124           HA       ARG 124  34.016  16.953 -43.541
  948    HB2  ARG 124           2HB      ARG 124  35.088  14.788 -41.712
  949    HB3  ARG 124           3HB      ARG 124  35.847  16.388 -41.817
  950    HG2  ARG 124           2HG      ARG 124  34.048  17.485 -40.863
  951    HG3  ARG 124           3HG      ARG 124  32.881  16.246 -41.349
  952    HD2  ARG 124           2HD      ARG 124  33.352  16.424 -38.856
  953    HD3  ARG 124           3HD      ARG 124  33.453  14.813 -39.565
  954    HE   ARG 124           HE       ARG 124  35.708  16.501 -38.635
  955   HH11  ARG 124          1HH1      ARG 124  34.636  13.380 -39.948
  956   HH12  ARG 124          2HH1      ARG 124  36.069  12.528 -39.445
  957   HH21  ARG 124          1HH2      ARG 124  37.559  15.348 -37.934
  958   HH22  ARG 124          2HH2      ARG 124  37.739  13.663 -38.303
  959    H    LYS 125           H        LYS 125  35.415  13.840 -44.465
  960    HA   LYS 125           HA       LYS 125  37.868  14.871 -45.556
  961    HB2  LYS 125           2HB      LYS 125  37.300  12.478 -44.958
  962    HB3  LYS 125           3HB      LYS 125  36.270  12.423 -46.406
  963    HG2  LYS 125           2HG      LYS 125  38.212  12.814 -47.846
  964    HG3  LYS 125           3HG      LYS 125  39.261  13.026 -46.426
  965    HD2  LYS 125           2HD      LYS 125  38.838  10.676 -45.761
  966    HD3  LYS 125           3HD      LYS 125  37.773  10.466 -47.174
  967    HE2  LYS 125           2HE      LYS 125  39.670  10.994 -48.677
  968    HE3  LYS 125           3HE      LYS 125  40.731  11.202 -47.268
  969    HZ1  LYS 125           3HZ      LYS 125  40.369   8.884 -46.730
  970    HZ2  LYS 125           1HZ      LYS 125  39.382   8.691 -48.039
  971    HZ3  LYS 125           2HZ      LYS 125  40.979   9.029 -48.254
  972    H    ASP 126           H        ASP 126  34.645  14.936 -46.741
  973    HA   ASP 126           HA       ASP 126  33.783  14.901 -48.923
  974    HB2  ASP 126           2HB      ASP 126  33.459  17.100 -47.810
  975    HB3  ASP 126           3HB      ASP 126  34.899  17.717 -48.628
  976    H    LEU 127           H        LEU 127  36.242  17.181 -49.937
  977    HA   LEU 127           HA       LEU 127  37.578  15.145 -51.604
  978    HB2  LEU 127           2HB      LEU 127  35.644  16.099 -52.881
  979    HB3  LEU 127           3HB      LEU 127  36.395  17.698 -52.750
  980    HG   LEU 127           HG       LEU 127  38.343  16.898 -54.060
  981   HD11  LEU 127          1HD1      LEU 127  36.796  14.288 -54.355
  982   HD12  LEU 127          2HD1      LEU 127  38.297  14.712 -55.211
  983   HD13  LEU 127          3HD1      LEU 127  38.312  14.490 -53.457
  984   HD21  LEU 127          3HD2      LEU 127  35.664  16.324 -55.377
  985   HD22  LEU 127          1HD2      LEU 127  36.444  17.911 -55.234
  986   HD23  LEU 127          2HD2      LEU 127  37.188  16.642 -56.236
  987    H    ILE 128           H        ILE 128  38.552  16.133 -49.317
  988    HA   ILE 128           HA       ILE 128  40.223  18.414 -49.465
  989    HB   ILE 128           HB       ILE 128  39.722  17.072 -47.413
  990   HG12  ILE 128          2HG1      ILE 128  41.895  17.134 -46.343
  991   HG13  ILE 128          3HG1      ILE 128  42.678  17.371 -47.915
  992   HG21  ILE 128          1HG2      ILE 128  41.717  15.063 -48.565
  993   HG22  ILE 128          2HG2      ILE 128  41.049  15.028 -46.921
  994   HG23  ILE 128          3HG2      ILE 128  39.984  14.780 -48.317
  995   HD11  ILE 128          3HD1      ILE 128  41.463  19.532 -48.179
  996   HD12  ILE 128          1HD1      ILE 128  40.677  19.277 -46.605
  997   HD13  ILE 128          2HD1      ILE 128  42.435  19.515 -46.703
  998    H    LYS 129           H        LYS 129  42.260  18.865 -50.022
  999    HA   LYS 129           HA       LYS 129  43.834  16.905 -51.585
 1000    HB2  LYS 129           2HB      LYS 129  43.073  19.701 -52.512
 1001    HB3  LYS 129           3HB      LYS 129  44.334  18.699 -53.254
 1002    HG2  LYS 129           2HG      LYS 129  42.608  16.969 -53.794
 1003    HG3  LYS 129           3HG      LYS 129  41.359  18.043 -53.131
 1004    HD2  LYS 129           2HD      LYS 129  41.958  19.773 -54.813
 1005    HD3  LYS 129           3HD      LYS 129  43.180  18.671 -55.495
 1006    HE2  LYS 129           2HE      LYS 129  41.402  17.011 -55.981
 1007    HE3  LYS 129           3HE      LYS 129  40.186  18.118 -55.308
 1008    HZ1  LYS 129           3HZ      LYS 129  40.743  19.685 -57.050
 1009    HZ2  LYS 129           1HZ      LYS 129  41.873  18.659 -57.674
 1010    HZ3  LYS 129           2HZ      LYS 129  40.278  18.248 -57.704
 1011    H    LYS 130           H        LYS 130  46.118  17.632 -51.735
 1012    HA   LYS 130           HA       LYS 130  47.205  18.849 -49.410
 1013    HB2  LYS 130           2HB      LYS 130  48.381  18.662 -52.203
 1014    HB3  LYS 130           3HB      LYS 130  49.277  19.060 -50.729
 1015    HG2  LYS 130           2HG      LYS 130  47.917  16.401 -51.335
 1016    HG3  LYS 130           3HG      LYS 130  49.657  16.726 -51.426
 1017    HD2  LYS 130           2HD      LYS 130  49.591  17.300 -48.961
 1018    HD3  LYS 130           3HD      LYS 130  47.913  16.727 -48.928
 1019    HE2  LYS 130           2HE      LYS 130  50.307  15.050 -49.784
 1020    HE3  LYS 130           3HE      LYS 130  49.614  15.044 -48.150
 1021    HZ1  LYS 130           3HZ      LYS 130  47.552  14.245 -49.091
 1022    HZ2  LYS 130           1HZ      LYS 130  48.190  14.250 -50.608
 1023    HZ3  LYS 130           2HZ      LYS 130  48.783  13.216 -49.469
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1   3.314 -30.802  -1.990
    2    H2   MET   1           H2       MET   1   3.079 -31.742  -3.317
    3    H3   MET   1           H3       MET   1   1.850 -31.541  -2.094
    4    HA   MET   1           HA       MET   1   2.234 -30.171  -4.450
    5    HB2  MET   1           2HB      MET   1   0.076 -30.865  -3.374
    6    HB3  MET   1           3HB      MET   1   0.365 -29.644  -2.111
    7    HG2  MET   1           2HG      MET   1   0.328 -27.867  -3.765
    8    HG3  MET   1           3HG      MET   1   0.167 -29.056  -5.079
    9    HE1  MET   1           3HE      MET   1  -1.682 -28.675  -1.543
   10    HE2  MET   1           1HE      MET   1  -1.613 -27.033  -2.228
   11    HE3  MET   1           2HE      MET   1  -3.179 -27.863  -2.060
   12    H    ALA   2           H        ALA   2   3.181 -28.354  -4.936
   13    HA   ALA   2           HA       ALA   2   3.532 -26.138  -2.978
   14    HB1  ALA   2           1HB      ALA   2   5.839 -27.427  -4.501
   15    HB2  ALA   2           2HB      ALA   2   5.920 -25.914  -3.566
   16    HB3  ALA   2           3HB      ALA   2   5.612 -27.457  -2.736
   17    H    ALA   3           H        ALA   3   3.941 -24.139  -4.040
   18    HA   ALA   3           HA       ALA   3   2.755 -23.717  -6.600
   19    HB1  ALA   3           1HB      ALA   3   4.777 -22.021  -5.074
   20    HB2  ALA   3           2HB      ALA   3   3.756 -21.467  -6.423
   21    HB3  ALA   3           3HB      ALA   3   3.009 -21.953  -4.883
   22    H    LYS   4           H        LYS   4   3.598 -23.382  -8.649
   23    HA   LYS   4           HA       LYS   4   6.019 -24.729  -9.409
   24    HB2  LYS   4           2HB      LYS   4   5.632 -23.826 -11.595
   25    HB3  LYS   4           3HB      LYS   4   4.084 -24.358 -10.898
   26    HG2  LYS   4           2HG      LYS   4   3.617 -21.965 -10.283
   27    HG3  LYS   4           3HG      LYS   4   5.093 -21.499 -11.160
   28    HD2  LYS   4           2HD      LYS   4   2.716 -22.929 -12.408
   29    HD3  LYS   4           3HD      LYS   4   2.976 -21.170 -12.471
   30    HE2  LYS   4           2HE      LYS   4   5.120 -21.533 -13.655
   31    HE3  LYS   4           3HE      LYS   4   4.848 -23.291 -13.601
   32    HZ1  LYS   4           3HZ      LYS   4   2.883 -22.963 -14.942
   33    HZ2  LYS   4           1HZ      LYS   4   3.135 -21.333 -14.992
   34    HZ3  LYS   4           2HZ      LYS   4   4.207 -22.356 -15.717
   35    H    PHE   5           H        PHE   5   5.487 -21.467  -8.337
   36    HA   PHE   5           HA       PHE   5   7.909 -20.359  -9.491
   37    HB2  PHE   5           2HB      PHE   5   6.075 -19.388  -7.288
   38    HB3  PHE   5           3HB      PHE   5   7.244 -18.337  -8.120
   39    HD1  PHE   5           HD2      PHE   5   7.002 -18.329 -10.793
   40    HD2  PHE   5           HD1      PHE   5   3.884 -19.337  -7.964
   41    HE1  PHE   5           HE2      PHE   5   5.265 -17.929 -12.541
   42    HE2  PHE   5           HE1      PHE   5   2.162 -18.978  -9.736
   43    HZ   PHE   5           HZ       PHE   5   2.862 -18.310 -12.032
   44    H    GLU   6           H        GLU   6   9.761 -20.015  -8.644
   45    HA   GLU   6           HA       GLU   6  10.424 -20.592  -5.811
   46    HB2  GLU   6           2HB      GLU   6  11.803 -21.789  -8.230
   47    HB3  GLU   6           3HB      GLU   6  12.525 -21.724  -6.606
   48    HG2  GLU   6           2HG      GLU   6  10.555 -23.059  -5.751
   49    HG3  GLU   6           3HG      GLU   6  10.004 -23.204  -7.436
   50    H    VAL   7           H        VAL   7  12.255 -19.265  -5.158
   51    HA   VAL   7           HA       VAL   7  12.733 -16.820  -6.509
   52    HB   VAL   7           HB       VAL   7  14.711 -16.610  -5.005
   53   HG11  VAL   7          1HG1      VAL   7  12.225 -17.813  -3.699
   54   HG12  VAL   7          2HG1      VAL   7  13.432 -16.792  -2.884
   55   HG13  VAL   7          3HG1      VAL   7  12.424 -16.113  -4.184
   56   HG21  VAL   7          3HG2      VAL   7  14.170 -19.441  -4.123
   57   HG22  VAL   7          1HG2      VAL   7  15.595 -18.864  -5.019
   58   HG23  VAL   7          2HG2      VAL   7  15.287 -18.279  -3.367
   59    H    GLY   8           H        GLY   8  13.597 -16.140  -8.113
   60    HA2  GLY   8           2HA      GLY   8  15.412 -15.890  -9.626
   61    HA3  GLY   8           3HA      GLY   8  15.860 -17.591  -9.355
   62    H    SER   9           H        SER   9  12.786 -18.299  -9.721
   63    HA   SER   9           HA       SER   9  12.769 -18.646 -12.545
   64    HB2  SER   9           2HB      SER   9  10.376 -19.126 -12.305
   65    HB3  SER   9           3HB      SER   9  11.385 -20.027 -11.150
   66    HG   SER   9           HG       SER   9   9.471 -19.173 -10.182
   67    H    VAL  10           H        VAL  10  11.537 -17.695 -14.191
   68    HA   VAL  10           HA       VAL  10  10.430 -14.934 -13.767
   69    HB   VAL  10           HB       VAL  10  12.810 -14.624 -14.326
   70   HG11  VAL  10          1HG1      VAL  10  12.207 -16.189 -16.882
   71   HG12  VAL  10          2HG1      VAL  10  13.700 -15.279 -16.553
   72   HG13  VAL  10          3HG1      VAL  10  13.299 -16.714 -15.579
   73   HG21  VAL  10          3HG2      VAL  10  10.937 -13.887 -16.554
   74   HG22  VAL  10          1HG2      VAL  10  11.286 -12.972 -15.068
   75   HG23  VAL  10          2HG2      VAL  10  12.559 -13.206 -16.288
   76    H    TYR  11           H        TYR  11   8.679 -14.644 -14.558
   77    HA   TYR  11           HA       TYR  11   7.607 -16.353 -16.757
   78    HB2  TYR  11           2HB      TYR  11   6.591 -16.073 -13.951
   79    HB3  TYR  11           3HB      TYR  11   5.508 -16.589 -15.263
   80    HD1  TYR  11           HD1      TYR  11   6.179 -18.692 -16.614
   81    HD2  TYR  11           HD2      TYR  11   7.945 -17.668 -12.807
   82    HE1  TYR  11           HE1      TYR  11   6.834 -21.079 -16.284
   83    HE2  TYR  11           HE2      TYR  11   8.438 -20.080 -12.388
   84    HH   TYR  11           HH       TYR  11   7.729 -22.626 -14.802
   85    H    THR  12           H        THR  12   5.078 -15.482 -16.842
   86    HA   THR  12           HA       THR  12   5.206 -12.491 -16.975
   87    HB   THR  12           HB       THR  12   3.707 -14.292 -18.891
   88    HG1  THR  12           1HG      THR  12   5.477 -13.902 -20.334
   89   HG21  THR  12          1HG2      THR  12   4.696 -11.415 -19.147
   90   HG22  THR  12          2HG2      THR  12   3.810 -12.322 -20.395
   91   HG23  THR  12          3HG2      THR  12   3.011 -11.911 -18.859
   92    H    GLY  13           H        GLY  13   3.312 -11.417 -16.502
   93    HA2  GLY  13           2HA      GLY  13   0.930 -12.828 -15.517
   94    HA3  GLY  13           3HA      GLY  13   1.880 -11.973 -14.279
   95    H    LYS  14           H        LYS  14  -0.455 -10.915 -14.353
   96    HA   LYS  14           HA       LYS  14  -0.251  -8.479 -16.080
   97    HB2  LYS  14           2HB      LYS  14  -2.649 -10.238 -15.503
   98    HB3  LYS  14           3HB      LYS  14  -2.841  -8.520 -15.926
   99    HG2  LYS  14           2HG      LYS  14  -1.585  -8.867 -18.001
  100    HG3  LYS  14           3HG      LYS  14  -1.317 -10.573 -17.573
  101    HD2  LYS  14           2HD      LYS  14  -3.808 -10.919 -17.614
  102    HD3  LYS  14           3HD      LYS  14  -3.993  -9.245 -18.188
  103    HE2  LYS  14           2HE      LYS  14  -2.556  -9.773 -20.142
  104    HE3  LYS  14           3HE      LYS  14  -2.418 -11.453 -19.574
  105    HZ1  LYS  14           3HZ      LYS  14  -4.792 -11.670 -19.844
  106    HZ2  LYS  14           1HZ      LYS  14  -4.920 -10.110 -20.371
  107    HZ3  LYS  14           2HZ      LYS  14  -4.095 -11.222 -21.271
  108    H    VAL  15           H        VAL  15  -0.566  -6.602 -15.204
  109    HA   VAL  15           HA       VAL  15  -0.114  -6.425 -12.336
  110    HB   VAL  15           HB       VAL  15  -0.776  -4.171 -14.261
  111   HG11  VAL  15          1HG1      VAL  15   0.945  -4.316 -11.739
  112   HG12  VAL  15          2HG1      VAL  15   0.682  -2.863 -12.733
  113   HG13  VAL  15          3HG1      VAL  15  -0.677  -3.592 -11.847
  114   HG21  VAL  15          3HG2      VAL  15   1.955  -5.400 -13.823
  115   HG22  VAL  15          1HG2      VAL  15   0.998  -5.448 -15.322
  116   HG23  VAL  15          2HG2      VAL  15   1.609  -3.895 -14.708
  117    H    THR  16           H        THR  16  -1.514  -6.316 -10.798
  118    HA   THR  16           HA       THR  16  -4.419  -5.887 -11.424
  119    HB   THR  16           HB       THR  16  -4.585  -7.321  -9.227
  120    HG1  THR  16           1HG      THR  16  -2.833  -8.798  -9.068
  121   HG21  THR  16          1HG2      THR  16  -3.651  -8.542 -11.865
  122   HG22  THR  16          2HG2      THR  16  -4.539  -9.397 -10.581
  123   HG23  THR  16          3HG2      THR  16  -5.322  -8.073 -11.473
  124    H    GLY  17           H        GLY  17  -1.827  -4.429  -9.728
  125    HA2  GLY  17           2HA      GLY  17  -3.609  -2.244  -9.135
  126    HA3  GLY  17           3HA      GLY  17  -3.102  -3.079  -7.648
  127    H    LEU  18           H        LEU  18  -2.443  -0.425  -8.298
  128    HA   LEU  18           HA       LEU  18   0.532  -0.603  -8.265
  129    HB2  LEU  18           2HB      LEU  18  -1.182   1.426  -9.691
  130    HB3  LEU  18           3HB      LEU  18   0.535   1.687  -9.303
  131    HG   LEU  18           HG       LEU  18  -0.584  -0.446 -11.186
  132   HD11  LEU  18          1HD1      LEU  18   1.121   2.035 -11.691
  133   HD12  LEU  18          2HD1      LEU  18   0.633   0.844 -12.918
  134   HD13  LEU  18          3HD1      LEU  18  -0.596   1.851 -12.119
  135   HD21  LEU  18          3HD2      LEU  18   2.301   0.181 -10.497
  136   HD22  LEU  18          1HD2      LEU  18   1.404  -1.281 -10.024
  137   HD23  LEU  18          2HD2      LEU  18   1.738  -0.962 -11.740
  138    H    GLN  19           H        GLN  19   1.438   0.919  -6.847
  139    HA   GLN  19           HA       GLN  19  -0.231   2.555  -5.062
  140    HB2  GLN  19           2HB      GLN  19   1.334   0.186  -4.010
  141    HB3  GLN  19           3HB      GLN  19   0.483   1.412  -3.041
  142    HG2  GLN  19           2HG      GLN  19  -1.678   0.627  -4.064
  143    HG3  GLN  19           3HG      GLN  19  -0.802  -0.718  -4.832
  144   HE21  GLN  19          2HE2      GLN  19   0.438  -2.194  -3.322
  145   HE22  GLN  19          1HE2      GLN  19  -0.246  -2.487  -1.735
  146    H    ALA  20           H        ALA  20   1.173   3.830  -3.641
  147    HA   ALA  20           HA       ALA  20   3.561   4.727  -4.817
  148    HB1  ALA  20           1HB      ALA  20   2.586   5.097  -1.953
  149    HB2  ALA  20           2HB      ALA  20   3.780   6.117  -2.790
  150    HB3  ALA  20           3HB      ALA  20   2.093   6.078  -3.354
  151    H    TYR  21           H        TYR  21   3.273   1.854  -3.061
  152    HA   TYR  21           HA       TYR  21   6.242   1.747  -2.669
  153    HB2  TYR  21           2HB      TYR  21   5.990   0.593  -0.654
  154    HB3  TYR  21           3HB      TYR  21   4.895   1.991  -0.561
  155    HD1  TYR  21           HD2      TYR  21   2.415   1.668  -0.658
  156    HD2  TYR  21           HD1      TYR  21   5.151  -1.676  -0.638
  157    HE1  TYR  21           HE2      TYR  21   0.532   0.133  -0.088
  158    HE2  TYR  21           HE1      TYR  21   3.279  -3.215  -0.044
  159    HH   TYR  21           HH       TYR  21   1.006  -3.395   0.350
  160    H    GLY  22           H        GLY  22   3.805   0.431  -4.612
  161    HA2  GLY  22           2HA      GLY  22   5.576  -1.376  -5.736
  162    HA3  GLY  22           3HA      GLY  22   4.709  -2.287  -4.478
  163    H    ALA  23           H        ALA  23   4.444  -3.297  -6.801
  164    HA   ALA  23           HA       ALA  23   1.776  -2.513  -7.983
  165    HB1  ALA  23           1HB      ALA  23   4.279  -3.520  -9.402
  166    HB2  ALA  23           2HB      ALA  23   2.680  -3.286 -10.146
  167    HB3  ALA  23           3HB      ALA  23   3.593  -1.885  -9.540
  168    H    PHE  24           H        PHE  24   0.350  -4.123  -7.565
  169    HA   PHE  24           HA       PHE  24   1.295  -6.821  -6.990
  170    HB2  PHE  24           2HB      PHE  24  -1.432  -5.557  -7.374
  171    HB3  PHE  24           3HB      PHE  24  -1.238  -7.311  -7.153
  172    HD1  PHE  24           HD1      PHE  24   0.379  -7.925  -5.069
  173    HD2  PHE  24           HD2      PHE  24  -1.980  -4.328  -5.508
  174    HE1  PHE  24           HE1      PHE  24   0.330  -7.652  -2.588
  175    HE2  PHE  24           HE2      PHE  24  -2.030  -4.062  -3.030
  176    HZ   PHE  24           HZ       PHE  24  -0.867  -5.713  -1.569
  177    H    VAL  25           H        VAL  25   1.439  -8.505  -8.407
  178    HA   VAL  25           HA       VAL  25   0.275  -8.223 -11.143
  179    HB   VAL  25           HB       VAL  25   3.049  -9.341 -10.558
  180   HG11  VAL  25          1HG1      VAL  25   1.565  -8.678 -13.144
  181   HG12  VAL  25          2HG1      VAL  25   3.225  -9.305 -13.035
  182   HG13  VAL  25          3HG1      VAL  25   1.858 -10.314 -12.507
  183   HG21  VAL  25          3HG2      VAL  25   2.358  -6.664 -11.804
  184   HG22  VAL  25          1HG2      VAL  25   3.124  -6.919 -10.218
  185   HG23  VAL  25          2HG2      VAL  25   3.978  -7.393 -11.704
  186    H    ALA  26           H        ALA  26  -1.271  -9.640 -11.159
  187    HA   ALA  26           HA       ALA  26  -1.157 -12.192  -9.767
  188    HB1  ALA  26           1HB      ALA  26  -2.973 -11.189 -11.991
  189    HB2  ALA  26           2HB      ALA  26  -3.221 -12.661 -11.022
  190    HB3  ALA  26           3HB      ALA  26  -3.295 -11.063 -10.245
  191    H    LEU  27           H        LEU  27  -0.889 -14.178 -10.616
  192    HA   LEU  27           HA       LEU  27   0.999 -14.305 -12.956
  193    HB2  LEU  27           2HB      LEU  27   0.909 -15.747 -10.313
  194    HB3  LEU  27           3HB      LEU  27   1.971 -16.235 -11.654
  195    HG   LEU  27           HG       LEU  27   2.099 -13.447 -10.432
  196   HD11  LEU  27          1HD1      LEU  27   3.712 -15.920  -9.652
  197   HD12  LEU  27          2HD1      LEU  27   4.005 -14.264  -9.070
  198   HD13  LEU  27          3HD1      LEU  27   2.501 -15.107  -8.632
  199   HD21  LEU  27          3HD2      LEU  27   4.118 -15.071 -12.013
  200   HD22  LEU  27          1HD2      LEU  27   3.152 -13.708 -12.627
  201   HD23  LEU  27          2HD2      LEU  27   4.367 -13.436 -11.357
  202    H    ASP  28           H        ASP  28  -1.692 -15.610 -11.269
  203    HA   ASP  28           HA       ASP  28  -2.633 -17.409 -13.375
  204    HB2  ASP  28           2HB      ASP  28  -1.356 -19.110 -12.613
  205    HB3  ASP  28           3HB      ASP  28  -1.122 -18.380 -11.009
  206    H    GLU  29           H        GLU  29  -4.783 -18.264 -12.646
  207    HA   GLU  29           HA       GLU  29  -6.445 -16.127 -11.787
  208    HB2  GLU  29           2HB      GLU  29  -6.905 -19.113 -11.976
  209    HB3  GLU  29           3HB      GLU  29  -8.189 -17.909 -11.717
  210    HG2  GLU  29           2HG      GLU  29  -6.342 -18.021 -14.118
  211    HG3  GLU  29           3HG      GLU  29  -8.003 -18.657 -14.109
  212    H    GLU  30           H        GLU  30  -4.722 -18.329  -9.768
  213    HA   GLU  30           HA       GLU  30  -6.169 -17.273  -7.363
  214    HB2  GLU  30           2HB      GLU  30  -5.183 -20.093  -7.863
  215    HB3  GLU  30           3HB      GLU  30  -5.864 -19.481  -6.338
  216    HG2  GLU  30           2HG      GLU  30  -7.371 -19.785  -8.987
  217    HG3  GLU  30           3HG      GLU  30  -7.444 -20.832  -7.550
  218    H    THR  31           H        THR  31  -3.418 -16.763  -8.892
  219    HA   THR  31           HA       THR  31  -1.739 -16.769  -6.410
  220    HB   THR  31           HB       THR  31  -0.650 -17.676  -9.085
  221    HG1  THR  31           1HG      THR  31  -0.814 -19.817  -8.311
  222   HG21  THR  31          1HG2      THR  31   0.265 -18.118  -6.203
  223   HG22  THR  31          2HG2      THR  31   1.106 -18.702  -7.659
  224   HG23  THR  31          3HG2      THR  31   0.974 -16.955  -7.349
  225    H    GLN  32           H        GLN  32  -0.527 -15.052  -6.159
  226    HA   GLN  32           HA       GLN  32  -0.054 -13.067  -8.314
  227    HB2  GLN  32           2HB      GLN  32  -2.270 -12.525  -7.557
  228    HB3  GLN  32           3HB      GLN  32  -1.765 -12.643  -5.855
  229    HG2  GLN  32           2HG      GLN  32  -0.534 -10.633  -5.960
  230    HG3  GLN  32           3HG      GLN  32  -0.595 -10.542  -7.735
  231   HE21  GLN  32          2HE2      GLN  32  -1.824  -9.115  -5.005
  232   HE22  GLN  32          1HE2      GLN  32  -3.362  -8.564  -5.639
  233    H    GLY  33           H        GLY  33   1.539 -11.558  -7.724
  234    HA2  GLY  33           2HA      GLY  33   2.778 -11.796  -5.033
  235    HA3  GLY  33           3HA      GLY  33   3.804 -11.897  -6.483
  236    H    LEU  34           H        LEU  34   4.603  -9.987  -5.052
  237    HA   LEU  34           HA       LEU  34   3.334  -7.418  -5.936
  238    HB2  LEU  34           2HB      LEU  34   2.669  -7.830  -3.684
  239    HB3  LEU  34           3HB      LEU  34   4.326  -8.261  -3.200
  240    HG   LEU  34           HG       LEU  34   5.055  -5.942  -3.563
  241   HD11  LEU  34          1HD1      LEU  34   2.118  -5.312  -4.113
  242   HD12  LEU  34          2HD1      LEU  34   3.418  -4.113  -3.917
  243   HD13  LEU  34          3HD1      LEU  34   3.438  -5.226  -5.303
  244   HD21  LEU  34          3HD2      LEU  34   2.590  -6.170  -1.789
  245   HD22  LEU  34          1HD2      LEU  34   4.259  -6.594  -1.339
  246   HD23  LEU  34          2HD2      LEU  34   3.829  -4.899  -1.668
  247    H    VAL  35           H        VAL  35   4.727  -6.431  -7.199
  248    HA   VAL  35           HA       VAL  35   7.656  -6.630  -6.914
  249    HB   VAL  35           HB       VAL  35   5.890  -4.751  -8.540
  250   HG11  VAL  35          1HG1      VAL  35   8.855  -5.441  -8.764
  251   HG12  VAL  35          2HG1      VAL  35   7.950  -4.384  -9.872
  252   HG13  VAL  35          3HG1      VAL  35   8.192  -3.899  -8.178
  253   HG21  VAL  35          3HG2      VAL  35   7.232  -7.304  -9.448
  254   HG22  VAL  35          1HG2      VAL  35   5.483  -7.031  -9.263
  255   HG23  VAL  35          2HG2      VAL  35   6.400  -6.124 -10.488
  256    H    HIS  36           H        HIS  36   8.653  -5.445  -5.193
  257    HA   HIS  36           HA       HIS  36   7.223  -3.215  -3.967
  258    HB2  HIS  36           2HB      HIS  36   9.017  -4.806  -2.863
  259    HB3  HIS  36           3HB      HIS  36  10.193  -3.729  -3.652
  260    HD1  HIS  36           HD1      HIS  36  10.766  -1.572  -2.287
  261    HD2  HIS  36           HD2      HIS  36   7.154  -3.439  -1.095
  262    HE1  HIS  36           HE1      HIS  36   9.992  -0.361  -0.290
  263    H    ILE  37           H        ILE  37   7.616  -1.011  -4.331
  264    HA   ILE  37           HA       ILE  37   8.338  -0.188  -6.976
  265    HB   ILE  37           HB       ILE  37   6.958   1.129  -5.261
  266   HG12  ILE  37          2HG1      ILE  37   9.136   2.628  -6.677
  267   HG13  ILE  37          3HG1      ILE  37   7.694   1.925  -7.446
  268   HG21  ILE  37          1HG2      ILE  37   9.742   1.942  -4.285
  269   HG22  ILE  37          2HG2      ILE  37   8.211   2.708  -3.800
  270   HG23  ILE  37          3HG2      ILE  37   8.543   1.021  -3.345
  271   HD11  ILE  37          3HD1      ILE  37   6.242   3.389  -6.063
  272   HD12  ILE  37          1HD1      ILE  37   7.684   4.094  -5.295
  273   HD13  ILE  37          2HD1      ILE  37   7.385   4.352  -7.029
  274    H    SER  38           H        SER  38  10.512  -0.582  -4.327
  275    HA   SER  38           HA       SER  38  12.817   0.664  -5.413
  276    HB2  SER  38           2HB      SER  38  12.899  -1.942  -3.900
  277    HB3  SER  38           3HB      SER  38  13.976  -0.531  -3.777
  278    HG   SER  38           HG       SER  38  12.513  -0.692  -1.987
  279    H    GLU  39           H        GLU  39  11.217  -2.199  -6.478
  280    HA   GLU  39           HA       GLU  39  13.613  -3.148  -8.009
  281    HB2  GLU  39           2HB      GLU  39  11.238  -4.733  -7.037
  282    HB3  GLU  39           3HB      GLU  39  12.713  -5.353  -7.815
  283    HG2  GLU  39           2HG      GLU  39  12.686  -4.014  -5.076
  284    HG3  GLU  39           3HG      GLU  39  12.508  -5.763  -5.346
  285    H    VAL  40           H        VAL  40  11.022  -1.332  -8.573
  286    HA   VAL  40           HA       VAL  40   9.834  -2.618 -10.939
  287    HB   VAL  40           HB       VAL  40   9.843   0.138  -9.704
  288   HG11  VAL  40          1HG1      VAL  40   8.206  -0.753 -12.123
  289   HG12  VAL  40          2HG1      VAL  40   8.009   0.783 -11.245
  290   HG13  VAL  40          3HG1      VAL  40   9.510   0.458 -12.142
  291   HG21  VAL  40          3HG2      VAL  40   7.714  -2.010  -9.923
  292   HG22  VAL  40          1HG2      VAL  40   8.617  -1.540  -8.465
  293   HG23  VAL  40          2HG2      VAL  40   7.475  -0.399  -9.209
  294    H    THR  41           H        THR  41  12.728  -0.763 -10.455
  295    HA   THR  41           HA       THR  41  13.458  -1.109 -13.301
  296    HB   THR  41           HB       THR  41  13.061   1.571 -11.944
  297    HG1  THR  41           1HG      THR  41  11.683   1.882 -13.792
  298   HG21  THR  41          1HG2      THR  41  14.211   1.040 -14.722
  299   HG22  THR  41          2HG2      THR  41  13.804   2.639 -14.055
  300   HG23  THR  41          3HG2      THR  41  15.116   1.681 -13.330
  301    H    HIS  42           H        HIS  42  15.706  -1.123 -13.503
  302    HA   HIS  42           HA       HIS  42  17.367  -1.248 -11.094
  303    HB2  HIS  42           2HB      HIS  42  19.198  -1.581 -12.930
  304    HB3  HIS  42           3HB      HIS  42  17.946  -2.828 -12.727
  305    HD1  HIS  42           HD1      HIS  42  16.771  -3.546 -14.898
  306    HD2  HIS  42           HD2      HIS  42  18.677   0.232 -15.209
  307    HE1  HIS  42           HE1      HIS  42  16.614  -2.886 -17.265
  308    H    GLY  43           H        GLY  43  16.315   1.018 -10.807
  309    HA2  GLY  43           2HA      GLY  43  18.279   3.023 -10.595
  310    HA3  GLY  43           3HA      GLY  43  17.402   3.325 -12.113
  311    H    PHE  44           H        PHE  44  17.018   5.303 -10.494
  312    HA   PHE  44           HA       PHE  44  14.979   5.127  -8.512
  313    HB2  PHE  44           2HB      PHE  44  15.650   7.427 -10.404
  314    HB3  PHE  44           3HB      PHE  44  14.708   7.553  -8.900
  315    HD1  PHE  44           HD2      PHE  44  15.894   6.834  -6.704
  316    HD2  PHE  44           HD1      PHE  44  17.947   7.802 -10.384
  317    HE1  PHE  44           HE2      PHE  44  17.991   7.269  -5.423
  318    HE2  PHE  44           HE1      PHE  44  20.040   8.234  -9.101
  319    HZ   PHE  44           HZ       PHE  44  20.064   7.967  -6.619
  320    H    VAL  45           H        VAL  45  12.792   5.740  -8.584
  321    HA   VAL  45           HA       VAL  45  11.363   5.305 -11.198
  322    HB   VAL  45           HB       VAL  45  10.683   4.370  -8.386
  323   HG11  VAL  45          1HG1      VAL  45   9.064   4.057 -10.959
  324   HG12  VAL  45          2HG1      VAL  45   8.674   3.311  -9.391
  325   HG13  VAL  45          3HG1      VAL  45   8.620   5.080  -9.572
  326   HG21  VAL  45          3HG2      VAL  45  11.271   2.809 -10.930
  327   HG22  VAL  45          1HG2      VAL  45  12.326   2.941  -9.503
  328   HG23  VAL  45          2HG2      VAL  45  10.762   2.104  -9.377
  329    H    LYS  46           H        LYS  46  10.366   7.044 -11.861
  330    HA   LYS  46           HA       LYS  46  10.331   9.509 -10.409
  331    HB2  LYS  46           2HB      LYS  46   8.586   8.680 -12.749
  332    HB3  LYS  46           3HB      LYS  46   8.944  10.341 -12.221
  333    HG2  LYS  46           2HG      LYS  46  11.276  10.105 -12.858
  334    HG3  LYS  46           3HG      LYS  46  11.050   8.376 -13.210
  335    HD2  LYS  46           2HD      LYS  46   9.225   9.253 -14.907
  336    HD3  LYS  46           3HD      LYS  46  10.118  10.787 -14.777
  337    HE2  LYS  46           2HE      LYS  46  11.090   9.684 -16.630
  338    HE3  LYS  46           3HE      LYS  46  12.229   9.423 -15.288
  339    HZ1  LYS  46           3HZ      LYS  46  11.280   7.234 -14.994
  340    HZ2  LYS  46           1HZ      LYS  46  10.225   7.477 -16.238
  341    HZ3  LYS  46           2HZ      LYS  46  11.846   7.406 -16.535
  342    H    ASP  47           H        ASP  47   7.778   7.339 -11.305
  343    HA   ASP  47           HA       ASP  47   6.500   7.287  -8.691
  344    HB2  ASP  47           2HB      ASP  47   5.352   9.249  -9.734
  345    HB3  ASP  47           3HB      ASP  47   4.896   8.204 -11.100
  346    H    ILE  48           H        ILE  48   5.272   5.147  -8.691
  347    HA   ILE  48           HA       ILE  48   6.192   3.212 -10.653
  348    HB   ILE  48           HB       ILE  48   5.331   2.905  -8.208
  349   HG12  ILE  48          2HG1      ILE  48   4.442   0.982 -10.324
  350   HG13  ILE  48          3HG1      ILE  48   6.119   1.212  -9.778
  351   HG21  ILE  48          1HG2      ILE  48   2.677   2.773  -9.723
  352   HG22  ILE  48          2HG2      ILE  48   2.932   2.270  -8.037
  353   HG23  ILE  48          3HG2      ILE  48   3.106   3.981  -8.488
  354   HD11  ILE  48          3HD1      ILE  48   5.455   0.592  -7.471
  355   HD12  ILE  48          1HD1      ILE  48   3.777   0.360  -8.017
  356   HD13  ILE  48          2HD1      ILE  48   5.065  -0.708  -8.620
  357    H    ASN  49           H        ASN  49   3.352   5.230 -10.751
  358    HA   ASN  49           HA       ASN  49   2.184   3.826 -12.996
  359    HB2  ASN  49           2HB      ASN  49   1.813   6.643 -11.941
  360    HB3  ASN  49           3HB      ASN  49   0.793   5.892 -13.190
  361   HD21  ASN  49          2HD2      ASN  49   1.618   5.947  -9.745
  362   HD22  ASN  49          1HD2      ASN  49   0.229   5.013  -9.216
  363    H    GLU  50           H        GLU  50   4.889   5.971 -12.812
  364    HA   GLU  50           HA       GLU  50   4.754   6.644 -15.697
  365    HB2  GLU  50           2HB      GLU  50   6.723   7.235 -13.474
  366    HB3  GLU  50           3HB      GLU  50   6.993   7.687 -15.172
  367    HG2  GLU  50           2HG      GLU  50   4.618   8.618 -13.504
  368    HG3  GLU  50           3HG      GLU  50   6.132   9.528 -13.718
  369    H    HIS  51           H        HIS  51   5.702   3.953 -13.895
  370    HA   HIS  51           HA       HIS  51   7.778   3.118 -15.906
  371    HB2  HIS  51           2HB      HIS  51   7.783   2.806 -12.853
  372    HB3  HIS  51           3HB      HIS  51   8.756   1.832 -13.980
  373    HD1  HIS  51           HD1      HIS  51  11.125   2.701 -14.015
  374    HD2  HIS  51           HD2      HIS  51   8.308   5.801 -13.483
  375    HE1  HIS  51           HE1      HIS  51  12.433   4.774 -13.827
  376    H    LEU  52           H        LEU  52   4.833   2.368 -14.437
  377    HA   LEU  52           HA       LEU  52   4.678  -0.304 -15.722
  378    HB2  LEU  52           2HB      LEU  52   4.423   0.289 -12.786
  379    HB3  LEU  52           3HB      LEU  52   3.407  -0.970 -13.524
  380    HG   LEU  52           HG       LEU  52   6.462  -0.943 -13.632
  381   HD11  LEU  52          1HD1      LEU  52   4.550  -2.562 -11.887
  382   HD12  LEU  52          2HD1      LEU  52   6.315  -2.769 -11.959
  383   HD13  LEU  52          3HD1      LEU  52   5.623  -1.261 -11.318
  384   HD21  LEU  52          3HD2      LEU  52   4.435  -3.114 -14.322
  385   HD22  LEU  52          1HD2      LEU  52   5.388  -2.175 -15.495
  386   HD23  LEU  52          2HD2      LEU  52   6.205  -3.283 -14.372
  387    H    SER  53           H        SER  53   2.249  -1.051 -15.413
  388    HA   SER  53           HA       SER  53   0.296   1.172 -15.210
  389    HB2  SER  53           2HB      SER  53   0.683  -0.511 -17.720
  390    HB3  SER  53           3HB      SER  53  -0.654   0.627 -17.429
  391    HG   SER  53           HG       SER  53   1.091   1.588 -18.607
  392    H    VAL  54           H        VAL  54  -1.459   0.398 -14.118
  393    HA   VAL  54           HA       VAL  54  -1.958  -2.456 -13.639
  394    HB   VAL  54           HB       VAL  54  -2.606  -0.506 -12.152
  395   HG11  VAL  54          1HG1      VAL  54  -4.850  -0.163 -14.198
  396   HG12  VAL  54          2HG1      VAL  54  -4.782   0.607 -12.595
  397   HG13  VAL  54          3HG1      VAL  54  -3.583   1.033 -13.839
  398   HG21  VAL  54          3HG2      VAL  54  -4.726  -2.488 -12.908
  399   HG22  VAL  54          1HG2      VAL  54  -3.415  -2.683 -11.722
  400   HG23  VAL  54          2HG2      VAL  54  -4.708  -1.495 -11.432
  401    H    GLY  55           H        GLY  55  -3.347  -3.837 -14.405
  402    HA2  GLY  55           2HA      GLY  55  -4.699  -4.848 -15.950
  403    HA3  GLY  55           3HA      GLY  55  -5.150  -3.234 -16.547
  404    H    ASP  56           H        ASP  56  -1.779  -4.230 -16.456
  405    HA   ASP  56           HA       ASP  56  -1.777  -4.696 -19.421
  406    HB2  ASP  56           2HB      ASP  56  -0.914  -2.445 -18.676
  407    HB3  ASP  56           3HB      ASP  56   0.351  -3.314 -17.775
  408    H    GLU  57           H        GLU  57   0.117  -6.018 -20.076
  409    HA   GLU  57           HA       GLU  57   0.578  -8.246 -18.139
  410    HB2  GLU  57           2HB      GLU  57  -0.514  -8.676 -20.322
  411    HB3  GLU  57           3HB      GLU  57   0.933  -8.044 -21.142
  412    HG2  GLU  57           2HG      GLU  57   2.295  -9.852 -20.149
  413    HG3  GLU  57           3HG      GLU  57   0.857 -10.465 -19.299
  414    H    VAL  58           H        VAL  58   2.606  -8.783 -17.493
  415    HA   VAL  58           HA       VAL  58   5.020  -7.395 -18.578
  416    HB   VAL  58           HB       VAL  58   5.661  -6.769 -16.240
  417   HG11  VAL  58          1HG1      VAL  58   3.088  -5.438 -17.216
  418   HG12  VAL  58          2HG1      VAL  58   4.243  -4.736 -16.061
  419   HG13  VAL  58          3HG1      VAL  58   4.735  -5.023 -17.746
  420   HG21  VAL  58          3HG2      VAL  58   2.800  -7.357 -15.493
  421   HG22  VAL  58          1HG2      VAL  58   4.254  -8.215 -14.934
  422   HG23  VAL  58          2HG2      VAL  58   3.999  -6.513 -14.486
  423    H    GLN  59           H        GLN  59   6.848  -8.488 -18.391
  424    HA   GLN  59           HA       GLN  59   6.786 -11.232 -17.360
  425    HB2  GLN  59           2HB      GLN  59   8.963  -9.459 -18.512
  426    HB3  GLN  59           3HB      GLN  59   9.226 -11.134 -17.973
  427    HG2  GLN  59           2HG      GLN  59   7.676 -11.984 -19.648
  428    HG3  GLN  59           3HG      GLN  59   7.181 -10.334 -20.092
  429   HE21  GLN  59          2HE2      GLN  59   9.521 -12.874 -20.619
  430   HE22  GLN  59          1HE2      GLN  59  10.512 -11.998 -21.767
  431    H    VAL  60           H        VAL  60   7.714 -11.837 -15.402
  432    HA   VAL  60           HA       VAL  60   8.754  -9.754 -13.489
  433    HB   VAL  60           HB       VAL  60   7.288 -11.138 -11.805
  434   HG11  VAL  60          1HG1      VAL  60   6.007  -9.133 -13.713
  435   HG12  VAL  60          2HG1      VAL  60   5.403  -9.557 -12.094
  436   HG13  VAL  60          3HG1      VAL  60   6.967  -8.728 -12.269
  437   HG21  VAL  60          3HG2      VAL  60   5.647 -11.633 -14.282
  438   HG22  VAL  60          1HG2      VAL  60   6.444 -12.854 -13.261
  439   HG23  VAL  60          2HG2      VAL  60   5.121 -11.865 -12.600
  440    H    LYS  61           H        LYS  61  10.489 -10.394 -12.409
  441    HA   LYS  61           HA       LYS  61  11.203 -13.286 -12.419
  442    HB2  LYS  61           2HB      LYS  61  12.889 -11.531 -13.070
  443    HB3  LYS  61           3HB      LYS  61  12.780 -10.885 -11.416
  444    HG2  LYS  61           2HG      LYS  61  13.511 -13.044 -10.499
  445    HG3  LYS  61           3HG      LYS  61  13.560 -13.740 -12.135
  446    HD2  LYS  61           2HD      LYS  61  15.357 -12.170 -12.767
  447    HD3  LYS  61           3HD      LYS  61  15.291 -11.428 -11.150
  448    HE2  LYS  61           2HE      LYS  61  15.910 -13.577 -10.124
  449    HE3  LYS  61           3HE      LYS  61  15.941 -14.346 -11.730
  450    HZ1  LYS  61           3HZ      LYS  61  17.745 -12.876 -12.326
  451    HZ2  LYS  61           1HZ      LYS  61  17.717 -12.165 -10.838
  452    HZ3  LYS  61           2HZ      LYS  61  18.144 -13.751 -10.986
  453    H    VAL  62           H        VAL  62  10.871 -14.513 -10.688
  454    HA   VAL  62           HA       VAL  62   9.655 -13.515  -8.227
  455    HB   VAL  62           HB       VAL  62  10.825 -16.216  -8.995
  456   HG11  VAL  62          1HG1      VAL  62   8.911 -15.463  -6.734
  457   HG12  VAL  62          2HG1      VAL  62   9.413 -17.116  -7.159
  458   HG13  VAL  62          3HG1      VAL  62  10.608 -15.957  -6.532
  459   HG21  VAL  62          3HG2      VAL  62   7.950 -15.201  -9.065
  460   HG22  VAL  62          1HG2      VAL  62   8.975 -15.556 -10.476
  461   HG23  VAL  62          2HG2      VAL  62   8.464 -16.872  -9.395
  462    H    LEU  63           H        LEU  63  10.654 -12.695  -6.554
  463    HA   LEU  63           HA       LEU  63  13.579 -13.223  -6.133
  464    HB2  LEU  63           2HB      LEU  63  11.904 -10.846  -6.147
  465    HB3  LEU  63           3HB      LEU  63  12.994 -10.885  -4.742
  466    HG   LEU  63           HG       LEU  63  13.966  -9.608  -6.626
  467   HD11  LEU  63          1HD1      LEU  63  15.419 -12.258  -6.177
  468   HD12  LEU  63          2HD1      LEU  63  16.154 -10.768  -6.812
  469   HD13  LEU  63          3HD1      LEU  63  15.545 -10.817  -5.141
  470   HD21  LEU  63          3HD2      LEU  63  13.789 -12.134  -8.241
  471   HD22  LEU  63          1HD2      LEU  63  12.894 -10.618  -8.495
  472   HD23  LEU  63          2HD2      LEU  63  14.662 -10.653  -8.699
  473    H    ALA  64           H        ALA  64  10.421 -13.338  -4.569
  474    HA   ALA  64           HA       ALA  64  11.704 -15.055  -2.529
  475    HB1  ALA  64           1HB      ALA  64   9.965 -12.676  -1.762
  476    HB2  ALA  64           2HB      ALA  64  10.525 -13.955  -0.663
  477    HB3  ALA  64           3HB      ALA  64  11.700 -12.849  -1.412
  478    H    VAL  65           H        VAL  65  10.243 -16.511  -1.619
  479    HA   VAL  65           HA       VAL  65   7.354 -16.385  -2.386
  480    HB   VAL  65           HB       VAL  65   9.122 -18.862  -2.571
  481   HG11  VAL  65          1HG1      VAL  65   6.165 -18.463  -3.235
  482   HG12  VAL  65          2HG1      VAL  65   7.093 -19.959  -3.497
  483   HG13  VAL  65          3HG1      VAL  65   6.801 -19.371  -1.843
  484   HG21  VAL  65          3HG2      VAL  65   7.806 -17.327  -4.824
  485   HG22  VAL  65          1HG2      VAL  65   9.551 -17.441  -4.494
  486   HG23  VAL  65          2HG2      VAL  65   8.639 -18.893  -4.969
  487    H    ASP  66           H        ASP  66   6.098 -16.809  -0.621
  488    HA   ASP  66           HA       ASP  66   7.181 -18.436   1.612
  489    HB2  ASP  66           2HB      ASP  66   7.495 -16.031   2.224
  490    HB3  ASP  66           3HB      ASP  66   5.740 -15.793   2.053
  491    H    GLU  67           H        GLU  67   5.907 -20.143   1.214
  492    HA   GLU  67           HA       GLU  67   3.183 -19.855   0.209
  493    HB2  GLU  67           2HB      GLU  67   4.737 -22.280   1.169
  494    HB3  GLU  67           3HB      GLU  67   3.187 -22.310   0.296
  495    HG2  GLU  67           2HG      GLU  67   4.309 -21.174  -1.645
  496    HG3  GLU  67           3HG      GLU  67   5.847 -21.276  -0.755
  497    H    GLU  68           H        GLU  68   4.491 -19.862   3.421
  498    HA   GLU  68           HA       GLU  68   2.073 -20.917   4.675
  499    HB2  GLU  68           2HB      GLU  68   4.243 -19.192   5.891
  500    HB3  GLU  68           3HB      GLU  68   3.049 -20.193   6.749
  501    HG2  GLU  68           2HG      GLU  68   5.345 -21.201   5.005
  502    HG3  GLU  68           3HG      GLU  68   5.231 -21.242   6.780
  503    H    LYS  69           H        LYS  69   3.562 -17.677   4.198
  504    HA   LYS  69           HA       LYS  69   1.202 -16.162   4.904
  505    HB2  LYS  69           2HB      LYS  69   3.583 -15.534   3.148
  506    HB3  LYS  69           3HB      LYS  69   2.353 -14.356   3.663
  507    HG2  LYS  69           2HG      LYS  69   4.217 -15.894   5.508
  508    HG3  LYS  69           3HG      LYS  69   4.447 -14.207   4.992
  509    HD2  LYS  69           2HD      LYS  69   2.229 -13.659   6.064
  510    HD3  LYS  69           3HD      LYS  69   2.194 -15.317   6.711
  511    HE2  LYS  69           2HE      LYS  69   4.394 -13.289   7.254
  512    HE3  LYS  69           3HE      LYS  69   3.018 -13.593   8.341
  513    HZ1  LYS  69           3HZ      LYS  69   3.787 -15.855   8.577
  514    HZ2  LYS  69           1HZ      LYS  69   5.063 -15.574   7.569
  515    HZ3  LYS  69           2HZ      LYS  69   4.975 -14.802   9.025
  516    H    GLY  70           H        GLY  70   2.097 -17.961   2.038
  517    HA2  GLY  70           2HA      GLY  70   1.039 -18.236   0.001
  518    HA3  GLY  70           3HA      GLY  70  -0.376 -17.389   0.669
  519    H    LYS  71           H        LYS  71   3.019 -16.355   0.183
  520    HA   LYS  71           HA       LYS  71   2.103 -14.062  -1.517
  521    HB2  LYS  71           2HB      LYS  71   3.850 -14.031   0.960
  522    HB3  LYS  71           3HB      LYS  71   3.858 -12.721  -0.244
  523    HG2  LYS  71           2HG      LYS  71   1.384 -12.450   0.121
  524    HG3  LYS  71           3HG      LYS  71   1.487 -13.653   1.428
  525    HD2  LYS  71           2HD      LYS  71   3.074 -12.202   2.652
  526    HD3  LYS  71           3HD      LYS  71   3.004 -11.004   1.338
  527    HE2  LYS  71           2HE      LYS  71   0.571 -10.744   1.716
  528    HE3  LYS  71           3HE      LYS  71   0.656 -11.926   3.044
  529    HZ1  LYS  71           3HZ      LYS  71   2.121 -10.419   4.204
  530    HZ2  LYS  71           1HZ      LYS  71   2.042  -9.324   2.973
  531    HZ3  LYS  71           2HZ      LYS  71   0.693  -9.670   3.858
  532    H    ILE  72           H        ILE  72   3.688 -13.174  -2.808
  533    HA   ILE  72           HA       ILE  72   6.291 -14.574  -3.222
  534    HB   ILE  72           HB       ILE  72   4.189 -14.045  -5.389
  535   HG12  ILE  72          2HG1      ILE  72   5.287 -16.633  -4.324
  536   HG13  ILE  72          3HG1      ILE  72   3.639 -15.996  -4.118
  537   HG21  ILE  72          1HG2      ILE  72   7.014 -15.197  -5.598
  538   HG22  ILE  72          2HG2      ILE  72   5.851 -15.061  -6.937
  539   HG23  ILE  72          3HG2      ILE  72   6.505 -13.594  -6.177
  540   HD11  ILE  72          3HD1      ILE  72   3.247 -16.212  -6.559
  541   HD12  ILE  72          1HD1      ILE  72   4.894 -16.853  -6.767
  542   HD13  ILE  72          2HD1      ILE  72   3.692 -17.779  -5.841
  543    H    SER  73           H        SER  73   7.853 -13.039  -3.400
  544    HA   SER  73           HA       SER  73   7.030 -10.256  -4.062
  545    HB2  SER  73           2HB      SER  73   9.742 -11.251  -3.132
  546    HB3  SER  73           3HB      SER  73   9.189  -9.565  -3.252
  547    HG   SER  73           HG       SER  73   9.066 -10.389  -1.089
  548    H    LEU  74           H        LEU  74   7.825  -9.251  -5.834
  549    HA   LEU  74           HA       LEU  74   9.059 -10.974  -7.957
  550    HB2  LEU  74           2HB      LEU  74   6.756  -9.043  -8.123
  551    HB3  LEU  74           3HB      LEU  74   7.497  -9.844  -9.528
  552    HG   LEU  74           HG       LEU  74   6.021 -11.272  -7.263
  553   HD11  LEU  74          1HD1      LEU  74   5.195 -10.717 -10.148
  554   HD12  LEU  74          2HD1      LEU  74   4.277 -11.690  -8.976
  555   HD13  LEU  74          3HD1      LEU  74   4.499  -9.946  -8.703
  556   HD21  LEU  74          3HD2      LEU  74   7.119 -12.371  -9.860
  557   HD22  LEU  74          1HD2      LEU  74   7.755 -12.680  -8.228
  558   HD23  LEU  74          2HD2      LEU  74   6.134 -13.259  -8.674
  559    H    SER  75           H        SER  75   9.970  -9.592  -9.747
  560    HA   SER  75           HA       SER  75  10.474  -6.742  -9.076
  561    HB2  SER  75           2HB      SER  75  12.638  -8.795  -9.675
  562    HB3  SER  75           3HB      SER  75  12.881  -7.037  -9.552
  563    HG   SER  75           HG       SER  75  13.330  -8.137  -7.568
  564    H    ILE  76           H        ILE  76  10.846  -5.485 -10.789
  565    HA   ILE  76           HA       ILE  76  10.560  -6.611 -13.586
  566    HB   ILE  76           HB       ILE  76   9.564  -4.011 -12.350
  567   HG12  ILE  76          2HG1      ILE  76   8.200  -5.881 -11.741
  568   HG13  ILE  76          3HG1      ILE  76   7.369  -4.646 -12.712
  569   HG21  ILE  76          1HG2      ILE  76   9.278  -4.996 -15.229
  570   HG22  ILE  76          2HG2      ILE  76   8.520  -3.534 -14.554
  571   HG23  ILE  76          3HG2      ILE  76  10.289  -3.635 -14.695
  572   HD11  ILE  76          3HD1      ILE  76   7.535  -6.104 -14.710
  573   HD12  ILE  76          1HD1      ILE  76   8.369  -7.339 -13.737
  574   HD13  ILE  76          2HD1      ILE  76   6.674  -6.924 -13.389
  575    H    ARG  77           H        ARG  77  12.575  -4.638 -11.457
  576    HA   ARG  77           HA       ARG  77  14.250  -3.516 -13.423
  577    HB2  ARG  77           2HB      ARG  77  15.966  -3.513 -11.808
  578    HB3  ARG  77           3HB      ARG  77  14.432  -3.267 -10.942
  579    HG2  ARG  77           2HG      ARG  77  14.466  -5.700 -10.309
  580    HG3  ARG  77           3HG      ARG  77  16.073  -5.834 -11.061
  581    HD2  ARG  77           2HD      ARG  77  15.376  -3.954  -8.771
  582    HD3  ARG  77           3HD      ARG  77  16.152  -5.543  -8.571
  583    HE   ARG  77           HE       ARG  77  17.849  -4.331 -10.284
  584   HH11  ARG  77          1HH2      ARG  77  16.466  -3.268  -7.199
  585   HH12  ARG  77          2HH2      ARG  77  17.806  -2.198  -6.839
  586   HH21  ARG  77          1HH1      ARG  77  19.549  -2.896  -9.807
  587   HH22  ARG  77          2HH1      ARG  77  19.546  -1.989  -8.309
  588    H    ALA  78           H        ALA  78  13.953  -6.865 -12.574
  589    HA   ALA  78           HA       ALA  78  16.204  -7.866 -14.080
  590    HB1  ALA  78           1HB      ALA  78  13.604  -9.177 -13.177
  591    HB2  ALA  78           2HB      ALA  78  15.068 -10.028 -13.723
  592    HB3  ALA  78           3HB      ALA  78  15.102  -9.074 -12.222
  593    H    THR  79           H        THR  79  12.987  -6.855 -15.030
  594    HA   THR  79           HA       THR  79  13.246  -8.242 -17.678
  595    HB   THR  79           HB       THR  79  10.803  -8.448 -17.606
  596    HG1  THR  79           1HG      THR  79   9.746  -7.946 -15.605
  597   HG21  THR  79          1HG2      THR  79  12.069  -9.502 -15.032
  598   HG22  THR  79          2HG2      THR  79  10.559 -10.093 -15.760
  599   HG23  THR  79          3HG2      THR  79  12.103 -10.318 -16.612
  600    H    GLN  80           H        GLN  80  13.118  -5.100 -16.304
  601    HA   GLN  80           HA       GLN  80  11.863  -3.642 -18.386
  602    HB2  GLN  80           2HB      GLN  80  14.263  -3.021 -16.678
  603    HB3  GLN  80           3HB      GLN  80  13.601  -1.879 -17.870
  604    HG2  GLN  80           2HG      GLN  80  12.128  -2.955 -15.456
  605    HG3  GLN  80           3HG      GLN  80  12.932  -1.371 -15.515
  606   HE21  GLN  80          2HE2      GLN  80  10.362  -1.269 -14.739
  607   HE22  GLN  80          1HE2      GLN  80   9.317  -0.695 -16.027
  608    H    ALA  81           H        ALA  81  15.010  -5.278 -18.362
  609    HA   ALA  81           HA       ALA  81  16.024  -4.103 -20.807
  610    HB1  ALA  81           1HB      ALA  81  16.617  -6.773 -19.461
  611    HB2  ALA  81           2HB      ALA  81  17.580  -6.018 -20.755
  612    HB3  ALA  81           3HB      ALA  81  17.473  -5.242 -19.157
  613    H    ALA  82           H        ALA  82  15.182  -4.272 -22.661
  614    HA   ALA  82           HA       ALA  82  13.820  -4.866 -24.381
  615    HB1  ALA  82           1HB      ALA  82  15.641  -7.308 -24.238
  616    HB2  ALA  82           2HB      ALA  82  14.811  -6.708 -25.693
  617    HB3  ALA  82           3HB      ALA  82  16.079  -5.725 -24.923
  618    HA   PRO  83           HA       PRO  83  10.831  -7.620 -22.073
  619    HB2  PRO  83           2HB      PRO  83   8.958  -5.512 -23.117
  620    HB3  PRO  83           3HB      PRO  83   8.983  -6.314 -21.528
  621    HG2  PRO  83           2HG      PRO  83   9.907  -3.753 -21.823
  622    HG3  PRO  83           3HG      PRO  83  10.736  -4.886 -20.729
  623    HD2  PRO  83           2HD      PRO  83  11.482  -4.145 -23.605
  624    HD3  PRO  83           3HD      PRO  83  12.554  -4.350 -22.199
  625    H    GLU  84           H        GLU  84   9.345  -9.032 -23.009
  626    HA   GLU  84           HA       GLU  84   9.247  -9.414 -25.898
  627    HB2  GLU  84           2HB      GLU  84   9.137 -11.096 -23.978
  628    HB3  GLU  84           3HB      GLU  84   7.450 -10.571 -23.771
  629    HG2  GLU  84           2HG      GLU  84   7.489 -12.638 -25.076
  630    HG3  GLU  84           3HG      GLU  84   6.967 -11.273 -26.090
  631    H    LYS  85           H        LYS  85   7.568  -7.286 -23.851
  632    HA   LYS  85           HA       LYS  85   4.939  -7.195 -24.884
  633    HB2  LYS  85           2HB      LYS  85   6.695  -4.909 -23.928
  634    HB3  LYS  85           3HB      LYS  85   4.928  -4.846 -24.129
  635    HG2  LYS  85           2HG      LYS  85   4.641  -6.553 -22.401
  636    HG3  LYS  85           3HG      LYS  85   6.405  -6.713 -22.235
  637    HD2  LYS  85           2HD      LYS  85   5.509  -5.400 -20.410
  638    HD3  LYS  85           3HD      LYS  85   6.562  -4.412 -21.448
  639    HE2  LYS  85           2HE      LYS  85   4.583  -3.142 -20.693
  640    HE3  LYS  85           3HE      LYS  85   4.614  -3.336 -22.462
  641    HZ1  LYS  85           3HZ      LYS  85   3.018  -5.112 -22.228
  642    HZ2  LYS  85           1HZ      LYS  85   2.989  -4.933 -20.589
  643    HZ3  LYS  85           2HZ      LYS  85   2.424  -3.724 -21.560
  644    H    LYS  86           H        LYS  86   3.907  -6.122 -26.527
  645    HA   LYS  86           HA       LYS  86   5.286  -5.538 -28.964
  646    HB2  LYS  86           2HB      LYS  86   2.590  -4.550 -28.003
  647    HB3  LYS  86           3HB      LYS  86   3.187  -4.511 -29.678
  648    HG2  LYS  86           2HG      LYS  86   2.562  -6.964 -28.011
  649    HG3  LYS  86           3HG      LYS  86   1.599  -6.330 -29.365
  650    HD2  LYS  86           2HD      LYS  86   4.397  -7.522 -29.550
  651    HD3  LYS  86           3HD      LYS  86   2.887  -8.326 -30.039
  652    HE2  LYS  86           2HE      LYS  86   2.509  -6.532 -31.723
  653    HE3  LYS  86           3HE      LYS  86   4.063  -5.798 -31.263
  654    HZ1  LYS  86           3HZ      LYS  86   5.153  -7.811 -31.983
  655    HZ2  LYS  86           1HZ      LYS  86   3.712  -8.491 -32.411
  656    HZ3  LYS  86           2HZ      LYS  86   4.272  -7.168 -33.221
  657    H    GLU  87           H        GLU  87   4.475  -3.472 -26.227
  658    HA   GLU  87           HA       GLU  87   6.441  -1.491 -27.264
  659    HB2  GLU  87           2HB      GLU  87   4.310  -0.541 -27.815
  660    HB3  GLU  87           3HB      GLU  87   3.656  -0.944 -26.210
  661    HG2  GLU  87           2HG      GLU  87   4.186   1.478 -26.469
  662    HG3  GLU  87           3HG      GLU  87   5.078   0.692 -25.145
  663    H    SER  88           H        SER  88   7.991  -1.569 -25.864
  664    HA   SER  88           HA       SER  88   7.993  -2.746 -23.264
  665    HB2  SER  88           2HB      SER  88   9.882  -0.624 -24.333
  666    HB3  SER  88           3HB      SER  88  10.230  -1.915 -23.159
  667    HG   SER  88           HG       SER  88  10.984  -2.423 -25.291
  668    H    LYS  89           H        LYS  89   7.525   0.680 -24.289
  669    HA   LYS  89           HA       LYS  89   7.720   1.773 -21.636
  670    HB2  LYS  89           2HB      LYS  89   6.236   2.767 -24.080
  671    HB3  LYS  89           3HB      LYS  89   6.554   3.712 -22.607
  672    HG2  LYS  89           2HG      LYS  89   8.662   2.600 -24.493
  673    HG3  LYS  89           3HG      LYS  89   8.092   4.285 -24.467
  674    HD2  LYS  89           2HD      LYS  89   8.944   4.492 -22.111
  675    HD3  LYS  89           3HD      LYS  89   9.600   2.842 -22.234
  676    HE2  LYS  89           2HE      LYS  89  10.976   3.537 -24.166
  677    HE3  LYS  89           3HE      LYS  89  10.326   5.188 -24.032
  678    HZ1  LYS  89           3HZ      LYS  89  11.332   5.338 -21.858
  679    HZ2  LYS  89           1HZ      LYS  89  11.934   3.808 -21.982
  680    HZ3  LYS  89           2HZ      LYS  89  12.480   4.994 -22.991
  681    HA   PRO  90           HA       PRO  90   3.804   0.643 -19.947
  682    HB2  PRO  90           2HB      PRO  90   3.363   2.729 -18.176
  683    HB3  PRO  90           3HB      PRO  90   4.470   1.370 -17.867
  684    HG2  PRO  90           2HG      PRO  90   5.105   4.183 -18.854
  685    HG3  PRO  90           3HG      PRO  90   6.010   3.175 -17.699
  686    HD2  PRO  90           2HD      PRO  90   6.732   3.383 -20.369
  687    HD3  PRO  90           3HD      PRO  90   7.025   1.905 -19.421
  688    H    ARG  91           H        ARG  91   1.509   1.263 -19.857
  689    HA   ARG  91           HA       ARG  91   0.495   3.036 -21.890
  690    HB2  ARG  91           2HB      ARG  91  -0.675   1.700 -19.477
  691    HB3  ARG  91           3HB      ARG  91  -1.610   2.891 -20.409
  692    HG2  ARG  91           2HG      ARG  91  -2.274   0.647 -21.006
  693    HG3  ARG  91           3HG      ARG  91  -1.506   1.478 -22.378
  694    HD2  ARG  91           2HD      ARG  91   0.251  -0.306 -20.727
  695    HD3  ARG  91           3HD      ARG  91  -0.965  -1.105 -21.751
  696    HE   ARG  91           HE       ARG  91  -0.011   0.297 -23.620
  697   HH11  ARG  91          1HH1      ARG  91   1.994  -1.101 -21.048
  698   HH12  ARG  91          2HH1      ARG  91   3.479  -0.900 -21.965
  699   HH21  ARG  91          1HH2      ARG  91   1.967   0.695 -24.672
  700   HH22  ARG  91          2HH2      ARG  91   3.462   0.095 -23.974
  701    H    LYS  92           H        LYS  92   1.249   3.363 -18.516
  702    HA   LYS  92           HA       LYS  92   1.376   5.048 -16.967
  703    HB2  LYS  92           2HB      LYS  92   1.286   6.929 -19.348
  704    HB3  LYS  92           3HB      LYS  92   1.661   7.385 -17.670
  705    HG2  LYS  92           2HG      LYS  92   3.622   5.756 -17.784
  706    HG3  LYS  92           3HG      LYS  92   3.304   5.618 -19.530
  707    HD2  LYS  92           2HD      LYS  92   3.651   8.019 -19.824
  708    HD3  LYS  92           3HD      LYS  92   3.846   8.235 -18.068
  709    HE2  LYS  92           2HE      LYS  92   5.807   6.598 -18.223
  710    HE3  LYS  92           3HE      LYS  92   5.686   6.768 -19.990
  711    HZ1  LYS  92           3HZ      LYS  92   6.042   9.126 -19.720
  712    HZ2  LYS  92           1HZ      LYS  92   6.152   8.969 -18.080
  713    HZ3  LYS  92           2HZ      LYS  92   7.294   8.284 -19.056
  714    HA   PRO  93           HA       PRO  93  -3.134   5.315 -16.576
  715    HB2  PRO  93           2HB      PRO  93  -2.119   4.981 -13.757
  716    HB3  PRO  93           3HB      PRO  93  -3.592   4.326 -14.512
  717    HG2  PRO  93           2HG      PRO  93  -1.379   2.747 -14.160
  718    HG3  PRO  93           3HG      PRO  93  -2.330   2.613 -15.660
  719    HD2  PRO  93           2HD      PRO  93   0.275   4.142 -15.198
  720    HD3  PRO  93           3HD      PRO  93  -0.213   3.175 -16.610
  721    H    LYS  94           H        LYS  94  -4.194   7.109 -15.977
  722    HA   LYS  94           HA       LYS  94  -4.634   9.345 -15.552
  723    HB2  LYS  94           2HB      LYS  94  -2.529   9.072 -13.382
  724    HB3  LYS  94           3HB      LYS  94  -3.777  10.334 -13.511
  725    HG2  LYS  94           2HG      LYS  94  -5.537   8.582 -13.222
  726    HG3  LYS  94           3HG      LYS  94  -4.258   7.362 -13.011
  727    HD2  LYS  94           2HD      LYS  94  -3.419   8.589 -11.023
  728    HD3  LYS  94           3HD      LYS  94  -4.703   9.803 -11.233
  729    HE2  LYS  94           2HE      LYS  94  -6.413   8.041 -10.951
  730    HE3  LYS  94           3HE      LYS  94  -5.126   6.829 -10.736
  731    HZ1  LYS  94           3HZ      LYS  94  -4.431   8.012  -8.767
  732    HZ2  LYS  94           1HZ      LYS  94  -5.624   9.134  -8.966
  733    HZ3  LYS  94           2HZ      LYS  94  -6.014   7.567  -8.634
  734    H    ALA  95           H        ALA  95  -1.913   8.512 -17.031
  735    HA   ALA  95           HA       ALA  95  -1.535  11.272 -18.081
  736    HB1  ALA  95           1HB      ALA  95   0.719   9.593 -16.896
  737    HB2  ALA  95           2HB      ALA  95   0.915  11.109 -17.807
  738    HB3  ALA  95           3HB      ALA  95   0.099  11.121 -16.226
  739    H    ALA  96           H        ALA  96  -2.922   9.192 -19.163
  740    HA   ALA  96           HA       ALA  96  -1.649   7.108 -20.424
  741    HB1  ALA  96           1HB      ALA  96  -4.033   8.678 -21.491
  742    HB2  ALA  96           2HB      ALA  96  -3.590   7.016 -21.945
  743    HB3  ALA  96           3HB      ALA  96  -4.103   7.376 -20.279
  744    H    GLN  97           H        GLN  97  -0.154   6.868 -21.897
  745    HA   GLN  97           HA       GLN  97   0.689   8.924 -23.732
  746    HB2  GLN  97           2HB      GLN  97   1.117   5.915 -23.818
  747    HB3  GLN  97           3HB      GLN  97   2.013   7.130 -24.759
  748    HG2  GLN  97           2HG      GLN  97   2.485   8.136 -22.313
  749    HG3  GLN  97           3HG      GLN  97   2.204   6.446 -21.833
  750   HE21  GLN  97          2HE2      GLN  97   3.809   4.871 -22.314
  751   HE22  GLN  97          1HE2      GLN  97   5.335   5.295 -23.067
  752    H    VAL  98           H        VAL  98   0.818   8.378 -26.145
  753    HA   VAL  98           HA       VAL  98  -1.755   8.624 -27.364
  754    HB   VAL  98           HB       VAL  98  -0.538   8.171 -29.483
  755   HG11  VAL  98          1HG1      VAL  98   1.014   9.969 -27.556
  756   HG12  VAL  98          2HG1      VAL  98   1.094  10.041 -29.332
  757   HG13  VAL  98          3HG1      VAL  98  -0.421  10.448 -28.493
  758   HG21  VAL  98          3HG2      VAL  98   1.869   7.532 -27.780
  759   HG22  VAL  98          1HG2      VAL  98   0.961   6.405 -28.816
  760   HG23  VAL  98          2HG2      VAL  98   1.855   7.760 -29.545
  761    H    SER  99           H        SER  99  -2.874   7.418 -28.796
  762    HA   SER  99           HA       SER  99  -3.928   5.042 -27.692
  763    HB2  SER  99           2HB      SER  99  -4.060   5.834 -30.616
  764    HB3  SER  99           3HB      SER  99  -5.275   4.962 -29.651
  765    HG   SER  99           HG       SER  99  -5.809   7.200 -29.942
  766    H    GLU 100           H        GLU 100  -4.047   2.953 -28.413
  767    HA   GLU 100           HA       GLU 100  -1.752   1.838 -29.954
  768    HB2  GLU 100           2HB      GLU 100  -2.656   0.900 -27.211
  769    HB3  GLU 100           3HB      GLU 100  -1.430   0.118 -28.236
  770    HG2  GLU 100           2HG      GLU 100  -0.050   2.155 -28.107
  771    HG3  GLU 100           3HG      GLU 100  -1.218   2.903 -26.992
  772    H    GLU 101           H        GLU 101  -2.211  -0.469 -30.540
  773    HA   GLU 101           HA       GLU 101  -4.863  -0.833 -31.604
  774    HB2  GLU 101           2HB      GLU 101  -2.696  -1.711 -32.516
  775    HB3  GLU 101           3HB      GLU 101  -2.662  -2.871 -31.167
  776    HG2  GLU 101           2HG      GLU 101  -4.709  -3.912 -31.937
  777    HG3  GLU 101           3HG      GLU 101  -4.912  -2.698 -33.222
  778    H    ALA 102           H        ALA 102  -3.396  -1.851 -28.579
  779    HA   ALA 102           HA       ALA 102  -5.148  -3.898 -27.781
  780    HB1  ALA 102           1HB      ALA 102  -3.816  -1.759 -26.065
  781    HB2  ALA 102           2HB      ALA 102  -4.469  -3.309 -25.482
  782    HB3  ALA 102           3HB      ALA 102  -3.071  -3.290 -26.582
  783    H    SER 103           H        SER 103  -7.215  -3.938 -27.699
  784    HA   SER 103           HA       SER 103  -8.839  -1.640 -26.667
  785    HB2  SER 103           2HB      SER 103  -9.433  -3.211 -29.195
  786    HB3  SER 103           3HB      SER 103 -10.341  -1.827 -28.542
  787    HG   SER 103           HG       SER 103  -8.917  -1.225 -30.269
  788    H    THR 104           H        THR 104  -7.963  -4.547 -25.956
  789    HA   THR 104           HA       THR 104 -10.197  -6.343 -25.950
  790    HB   THR 104           HB       THR 104  -8.008  -6.217 -23.875
  791    HG1  THR 104           1HG      THR 104  -6.645  -7.236 -25.444
  792   HG21  THR 104          1HG2      THR 104  -9.217  -8.553 -25.427
  793   HG22  THR 104          2HG2      THR 104  -7.955  -8.679 -24.178
  794   HG23  THR 104          3HG2      THR 104  -9.588  -8.126 -23.740
  795    HA   PRO 105           HA       PRO 105 -12.920  -4.912 -22.729
  796    HB2  PRO 105           2HB      PRO 105 -13.085  -7.837 -22.047
  797    HB3  PRO 105           3HB      PRO 105 -14.385  -6.630 -22.208
  798    HG2  PRO 105           2HG      PRO 105 -13.949  -8.293 -24.292
  799    HG3  PRO 105           3HG      PRO 105 -14.317  -6.573 -24.569
  800    HD2  PRO 105           2HD      PRO 105 -11.597  -7.961 -24.624
  801    HD3  PRO 105           3HD      PRO 105 -12.213  -6.674 -25.689
  802    H    GLN 106           H        GLN 106 -10.087  -6.868 -22.074
  803    HA   GLN 106           HA       GLN 106  -9.758  -6.827 -19.316
  804    HB2  GLN 106           2HB      GLN 106  -8.163  -7.680 -21.013
  805    HB3  GLN 106           3HB      GLN 106  -7.734  -6.001 -21.416
  806    HG2  GLN 106           2HG      GLN 106  -6.792  -5.649 -19.186
  807    HG3  GLN 106           3HG      GLN 106  -7.362  -7.248 -18.651
  808   HE21  GLN 106          2HE2      GLN 106  -4.597  -5.641 -19.569
  809   HE22  GLN 106          1HE2      GLN 106  -3.698  -6.989 -20.239
  810    H    GLY 107           H        GLY 107  -9.590  -3.958 -21.459
  811    HA2  GLY 107           2HA      GLY 107  -8.581  -2.117 -19.595
  812    HA3  GLY 107           3HA      GLY 107  -9.681  -1.732 -20.940
  813    H    PHE 108           H        PHE 108 -11.998  -3.165 -20.094
  814    HA   PHE 108           HA       PHE 108 -13.012  -1.565 -17.872
  815    HB2  PHE 108           2HB      PHE 108 -14.513  -2.171 -19.699
  816    HB3  PHE 108           3HB      PHE 108 -14.161  -3.898 -19.461
  817    HD1  PHE 108           HD2      PHE 108 -15.991  -0.954 -18.170
  818    HD2  PHE 108           HD1      PHE 108 -15.175  -5.171 -17.684
  819    HE1  PHE 108           HE2      PHE 108 -17.944  -1.159 -16.632
  820    HE2  PHE 108           HE1      PHE 108 -17.084  -5.356 -16.090
  821    HZ   PHE 108           HZ       PHE 108 -18.487  -3.358 -15.590
  822    H    ASN 109           H        ASN 109 -12.211  -5.038 -18.346
  823    HA   ASN 109           HA       ASN 109 -13.091  -5.920 -15.775
  824    HB2  ASN 109           2HB      ASN 109 -12.701  -7.379 -17.749
  825    HB3  ASN 109           3HB      ASN 109 -10.948  -7.129 -17.574
  826   HD21  ASN 109          2HD2      ASN 109 -13.839  -8.320 -15.765
  827   HD22  ASN 109          1HD2      ASN 109 -12.952  -9.514 -14.838
  828    H    THR 110           H        THR 110 -10.113  -4.351 -16.611
  829    HA   THR 110           HA       THR 110  -8.525  -4.885 -14.340
  830    HB   THR 110           HB       THR 110  -8.933  -2.352 -15.949
  831    HG1  THR 110           1HG      THR 110  -7.056  -3.199 -17.060
  832   HG21  THR 110          1HG2      THR 110  -6.505  -3.168 -14.290
  833   HG22  THR 110          2HG2      THR 110  -6.602  -1.748 -15.359
  834   HG23  THR 110          3HG2      THR 110  -7.624  -1.839 -13.906
  835    H    LEU 111           H        LEU 111 -11.565  -3.049 -14.354
  836    HA   LEU 111           HA       LEU 111 -11.130  -1.512 -12.058
  837    HB2  LEU 111           2HB      LEU 111 -13.311  -1.110 -11.973
  838    HB3  LEU 111           3HB      LEU 111 -13.200  -1.711 -13.643
  839    HG   LEU 111           HG       LEU 111 -14.154  -3.415 -11.286
  840   HD11  LEU 111          1HD1      LEU 111 -15.769  -1.937 -13.416
  841   HD12  LEU 111          2HD1      LEU 111 -16.433  -3.053 -12.199
  842   HD13  LEU 111          3HD1      LEU 111 -15.699  -1.515 -11.688
  843   HD21  LEU 111          3HD2      LEU 111 -14.412  -3.893 -14.265
  844   HD22  LEU 111          1HD2      LEU 111 -13.324  -4.756 -13.153
  845   HD23  LEU 111          2HD2      LEU 111 -15.086  -4.906 -12.967
  846    H    LYS 112           H        LYS 112 -10.941  -1.632 -10.012
  847    HA   LYS 112           HA       LYS 112 -10.240  -4.327  -9.019
  848    HB2  LYS 112           2HB      LYS 112  -9.903  -1.576  -7.780
  849    HB3  LYS 112           3HB      LYS 112  -9.206  -3.096  -7.172
  850    HG2  LYS 112           2HG      LYS 112  -7.959  -3.326  -9.321
  851    HG3  LYS 112           3HG      LYS 112  -8.584  -1.736  -9.817
  852    HD2  LYS 112           2HD      LYS 112  -7.048  -2.059  -7.252
  853    HD3  LYS 112           3HD      LYS 112  -6.185  -1.959  -8.804
  854    HE2  LYS 112           2HE      LYS 112  -6.158   0.234  -7.931
  855    HE3  LYS 112           3HE      LYS 112  -7.395   0.228  -9.210
  856    HZ1  LYS 112           3HZ      LYS 112  -9.073   0.091  -7.500
  857    HZ2  LYS 112           1HZ      LYS 112  -7.924   0.095  -6.313
  858    HZ3  LYS 112           2HZ      LYS 112  -8.132   1.424  -7.267
  859    H    ASP 113           H        ASP 113 -12.943  -2.264  -8.774
  860    HA   ASP 113           HA       ASP 113 -14.186  -4.053  -6.775
  861    HB2  ASP 113           2HB      ASP 113 -13.105  -2.220  -5.441
  862    HB3  ASP 113           3HB      ASP 113 -14.030  -1.059  -6.422
  863    H    LYS 114           H        LYS 114 -16.518  -3.808  -6.778
  864    HA   LYS 114           HA       LYS 114 -17.728  -3.373  -9.304
  865    HB2  LYS 114           2HB      LYS 114 -18.960  -3.213  -6.542
  866    HB3  LYS 114           3HB      LYS 114 -19.846  -3.390  -8.075
  867    HG2  LYS 114           2HG      LYS 114 -17.871  -5.398  -6.949
  868    HG3  LYS 114           3HG      LYS 114 -19.636  -5.503  -6.762
  869    HD2  LYS 114           2HD      LYS 114 -18.129  -5.575  -9.398
  870    HD3  LYS 114           3HD      LYS 114 -18.741  -7.003  -8.532
  871    HE2  LYS 114           2HE      LYS 114 -20.475  -4.743  -9.598
  872    HE3  LYS 114           3HE      LYS 114 -20.185  -6.276 -10.453
  873    HZ1  LYS 114           3HZ      LYS 114 -21.220  -7.423  -8.613
  874    HZ2  LYS 114           1HZ      LYS 114 -21.490  -6.002  -7.821
  875    HZ3  LYS 114           2HZ      LYS 114 -22.261  -6.311  -9.246
  876    H    LEU 115           H        LEU 115 -18.489  -1.643 -10.295
  877    HA   LEU 115           HA       LEU 115 -18.941   0.563 -10.864
  878    HB2  LEU 115           2HB      LEU 115 -20.698  -0.141  -8.980
  879    HB3  LEU 115           3HB      LEU 115 -19.855   1.128  -8.062
  880    HG   LEU 115           HG       LEU 115 -20.245   2.475 -10.383
  881   HD11  LEU 115          1HD1      LEU 115 -22.621   0.567 -10.166
  882   HD12  LEU 115          2HD1      LEU 115 -22.510   1.964 -11.261
  883   HD13  LEU 115          3HD1      LEU 115 -21.417   0.577 -11.475
  884   HD21  LEU 115          3HD2      LEU 115 -22.352   2.139  -8.216
  885   HD22  LEU 115          1HD2      LEU 115 -20.955   3.239  -8.156
  886   HD23  LEU 115          2HD2      LEU 115 -22.239   3.497  -9.360
  887    H    GLU 116           H        GLU 116 -16.232  -0.054  -9.680
  888    HA   GLU 116           HA       GLU 116 -15.262   2.204  -8.269
  889    HB2  GLU 116           2HB      GLU 116 -13.988   0.152  -8.611
  890    HB3  GLU 116           3HB      GLU 116 -13.933   0.456 -10.363
  891    HG2  GLU 116           2HG      GLU 116 -12.556   2.394 -10.064
  892    HG3  GLU 116           3HG      GLU 116 -12.737   2.347  -8.295
  893    H    GLU 117           H        GLU 117 -14.542   4.166  -8.772
  894    HA   GLU 117           HA       GLU 117 -14.804   6.255  -9.754
  895    HB2  GLU 117           2HB      GLU 117 -13.743   4.699 -12.140
  896    HB3  GLU 117           3HB      GLU 117 -13.861   6.472 -12.052
  897    HG2  GLU 117           2HG      GLU 117 -12.352   6.446 -10.077
  898    HG3  GLU 117           3HG      GLU 117 -12.160   4.686 -10.251
  899    H    TRP 118           H        TRP 118 -17.069   4.537  -9.667
  900    HA   TRP 118           HA       TRP 118 -19.303   4.522 -10.257
  901    HB2  TRP 118           2HB      TRP 118 -18.798   7.316 -11.339
  902    HB3  TRP 118           3HB      TRP 118 -20.337   6.648 -10.747
  903    HD1  TRP 118           HD1      TRP 118 -17.302   8.361  -9.755
  904    HE1  TRP 118           HE1      TRP 118 -17.352   9.011  -7.169
  905    HE3  TRP 118           HE3      TRP 118 -21.436   5.695  -8.355
  906    HZ2  TRP 118           HZ2      TRP 118 -18.982   8.375  -4.931
  907    HZ3  TRP 118           HZ3      TRP 118 -22.232   5.698  -6.096
  908    HH2  TRP 118           HH2      TRP 118 -21.069   7.003  -4.303
  909    H    ILE 119           H        ILE 119 -17.263   3.544 -12.260
  910    HA   ILE 119           HA       ILE 119 -18.438   3.900 -14.845
  911    HB   ILE 119           HB       ILE 119 -16.222   2.794 -14.346
  912   HG12  ILE 119          2HG1      ILE 119 -16.357   1.052 -16.062
  913   HG13  ILE 119          3HG1      ILE 119 -18.128   1.219 -16.058
  914   HG21  ILE 119          1HG2      ILE 119 -17.945   0.359 -13.656
  915   HG22  ILE 119          2HG2      ILE 119 -16.181   0.348 -13.884
  916   HG23  ILE 119          3HG2      ILE 119 -16.896   1.239 -12.522
  917   HD11  ILE 119          3HD1      ILE 119 -17.905   3.581 -16.795
  918   HD12  ILE 119          1HD1      ILE 119 -16.134   3.413 -16.798
  919   HD13  ILE 119          2HD1      ILE 119 -17.119   2.476 -17.946
  920    H    GLU 120           H        GLU 120 -20.301   3.454 -15.717
  921    HA   GLU 120           HA       GLU 120 -22.253   1.938 -14.184
  922    HB2  GLU 120           2HB      GLU 120 -22.897   3.887 -15.524
  923    HB3  GLU 120           3HB      GLU 120 -22.335   3.067 -17.000
  924    HG2  GLU 120           2HG      GLU 120 -24.839   3.018 -16.645
  925    HG3  GLU 120           3HG      GLU 120 -24.068   1.430 -16.866
  926    H    MET 121           H        MET 121 -21.398  -0.064 -13.861
  927    HA   MET 121           HA       MET 121 -20.339  -1.796 -15.832
  928    HB2  MET 121           2HB      MET 121 -21.925  -2.499 -13.342
  929    HB3  MET 121           3HB      MET 121 -20.894  -3.609 -14.274
  930    HG2  MET 121           2HG      MET 121 -18.962  -2.072 -13.809
  931    HG3  MET 121           3HG      MET 121 -20.029  -1.149 -12.726
  932    HE1  MET 121           3HE      MET 121 -19.519  -5.076 -13.322
  933    HE2  MET 121           1HE      MET 121 -17.882  -4.380 -13.272
  934    HE3  MET 121           2HE      MET 121 -18.431  -5.458 -11.967
  935    H    SER 122           H        SER 122 -23.749  -0.997 -15.269
  936    HA   SER 122           HA       SER 122 -24.843  -3.162 -16.765
  937    HB2  SER 122           2HB      SER 122 -25.967  -0.360 -16.808
  938    HB3  SER 122           3HB      SER 122 -26.830  -1.916 -16.836
  939    HG   SER 122           HG       SER 122 -26.919  -0.883 -14.767
  940    H    ASN 123           H        ASN 123 -23.053  -0.360 -17.982
  941    HA   ASN 123           HA       ASN 123 -23.810  -0.678 -20.722
  942    HB2  ASN 123           2HB      ASN 123 -22.487   1.246 -19.936
  943    HB3  ASN 123           3HB      ASN 123 -21.127   0.172 -19.534
  944   HD21  ASN 123          2HD2      ASN 123 -19.557   0.066 -21.079
  945   HD22  ASN 123          1HD2      ASN 123 -19.816   0.326 -22.793
  946    H    ARG 124           H        ARG 124 -21.212  -2.327 -18.813
  947    HA   ARG 124           HA       ARG 124 -20.356  -3.998 -20.996
  948    HB2  ARG 124           2HB      ARG 124 -19.092  -3.525 -18.897
  949    HB3  ARG 124           3HB      ARG 124 -20.261  -4.537 -18.017
  950    HG2  ARG 124           2HG      ARG 124 -18.174  -5.746 -18.493
  951    HG3  ARG 124           3HG      ARG 124 -19.589  -6.496 -19.266
  952    HD2  ARG 124           2HD      ARG 124 -17.541  -6.486 -20.723
  953    HD3  ARG 124           3HD      ARG 124 -18.932  -5.640 -21.442
  954    HE   ARG 124           HE       ARG 124 -17.250  -3.817 -19.998
  955   HH11  ARG 124          1HH2      ARG 124 -17.296  -5.682 -22.999
  956   HH12  ARG 124          2HH2      ARG 124 -16.360  -4.501 -23.890
  957   HH21  ARG 124          1HH1      ARG 124 -16.099  -2.255 -21.202
  958   HH22  ARG 124          2HH1      ARG 124 -15.684  -2.565 -22.875
  959    H    LYS 125           H        LYS 125 -22.916  -4.419 -18.544
  960    HA   LYS 125           HA       LYS 125 -23.720  -7.036 -19.473
  961    HB2  LYS 125           2HB      LYS 125 -25.313  -4.882 -18.042
  962    HB3  LYS 125           3HB      LYS 125 -25.798  -6.582 -18.239
  963    HG2  LYS 125           2HG      LYS 125 -23.814  -7.290 -16.942
  964    HG3  LYS 125           3HG      LYS 125 -23.350  -5.585 -16.731
  965    HD2  LYS 125           2HD      LYS 125 -24.414  -6.346 -14.696
  966    HD3  LYS 125           3HD      LYS 125 -25.496  -5.194 -15.513
  967    HE2  LYS 125           2HE      LYS 125 -26.856  -7.023 -16.383
  968    HE3  LYS 125           3HE      LYS 125 -25.731  -8.223 -15.704
  969    HZ1  LYS 125           3HZ      LYS 125 -26.326  -7.444 -13.513
  970    HZ2  LYS 125           1HZ      LYS 125 -27.369  -6.332 -14.142
  971    HZ3  LYS 125           2HZ      LYS 125 -27.674  -7.943 -14.323
  972    H    ASP 126           H        ASP 126 -23.859  -4.166 -21.160
  973    HA   ASP 126           HA       ASP 126 -25.217  -3.233 -22.785
  974    HB2  ASP 126           2HB      ASP 126 -24.252  -5.217 -24.049
  975    HB3  ASP 126           3HB      ASP 126 -25.700  -6.111 -23.530
  976    H    LEU 127           H        LEU 127 -26.266  -3.073 -20.506
  977    HA   LEU 127           HA       LEU 127 -29.214  -3.449 -20.864
  978    HB2  LEU 127           2HB      LEU 127 -28.172  -5.261 -19.498
  979    HB3  LEU 127           3HB      LEU 127 -27.632  -4.023 -18.340
  980    HG   LEU 127           HG       LEU 127 -30.005  -3.409 -17.914
  981   HD11  LEU 127          1HD1      LEU 127 -30.666  -5.846 -19.633
  982   HD12  LEU 127          2HD1      LEU 127 -31.831  -4.911 -18.666
  983   HD13  LEU 127          3HD1      LEU 127 -31.019  -4.154 -20.055
  984   HD21  LEU 127          3HD2      LEU 127 -29.348  -6.363 -17.535
  985   HD22  LEU 127          1HD2      LEU 127 -28.861  -5.030 -16.461
  986   HD23  LEU 127          2HD2      LEU 127 -30.580  -5.459 -16.622
  987    H    ILE 128           H        ILE 128 -28.255  -1.223 -21.654
  988    HA   ILE 128           HA       ILE 128 -28.718   0.890 -19.543
  989    HB   ILE 128           HB       ILE 128 -26.249   0.400 -19.700
  990   HG12  ILE 128          2HG1      ILE 128 -27.012   3.065 -20.814
  991   HG13  ILE 128          3HG1      ILE 128 -27.160   2.563 -19.113
  992   HG21  ILE 128          1HG2      ILE 128 -26.586   1.260 -22.621
  993   HG22  ILE 128          2HG2      ILE 128 -25.033   1.004 -21.792
  994   HG23  ILE 128          3HG2      ILE 128 -26.129  -0.369 -22.068
  995   HD11  ILE 128          3HD1      ILE 128 -24.705   2.211 -19.003
  996   HD12  ILE 128          1HD1      ILE 128 -24.556   2.714 -20.702
  997   HD13  ILE 128          2HD1      ILE 128 -25.090   3.883 -19.474
  998    H    LYS 129           H        LYS 129 -29.527   2.705 -20.167
  999    HA   LYS 129           HA       LYS 129 -30.098   3.281 -23.015
 1000    HB2  LYS 129           2HB      LYS 129 -31.937   1.780 -22.104
 1001    HB3  LYS 129           3HB      LYS 129 -32.328   3.095 -20.970
 1002    HG2  LYS 129           2HG      LYS 129 -32.872   4.591 -22.792
 1003    HG3  LYS 129           3HG      LYS 129 -32.289   3.415 -23.993
 1004    HD2  LYS 129           2HD      LYS 129 -34.719   3.391 -23.976
 1005    HD3  LYS 129           3HD      LYS 129 -34.109   1.857 -23.311
 1006    HE2  LYS 129           2HE      LYS 129 -34.515   2.661 -21.026
 1007    HE3  LYS 129           3HE      LYS 129 -35.065   4.231 -21.659
 1008    HZ1  LYS 129           3HZ      LYS 129 -36.884   3.088 -22.731
 1009    HZ2  LYS 129           1HZ      LYS 129 -36.375   1.633 -22.144
 1010    HZ3  LYS 129           2HZ      LYS 129 -36.910   2.799 -21.108
 1011    H    LYS 130           H        LYS 130 -30.618   5.543 -23.278
 1012    HA   LYS 130           HA       LYS 130 -29.504   7.424 -21.497
 1013    HB2  LYS 130           2HB      LYS 130 -30.082   7.806 -23.901
 1014    HB3  LYS 130           3HB      LYS 130 -31.800   7.856 -23.440
 1015    HG2  LYS 130           2HG      LYS 130 -31.379   9.802 -21.995
 1016    HG3  LYS 130           3HG      LYS 130 -29.643   9.733 -22.381
 1017    HD2  LYS 130           2HD      LYS 130 -30.153  10.178 -24.766
 1018    HD3  LYS 130           3HD      LYS 130 -31.891  10.241 -24.384
 1019    HE2  LYS 130           2HE      LYS 130 -31.485  12.135 -22.850
 1020    HE3  LYS 130           3HE      LYS 130 -29.749  12.074 -23.234
 1021    HZ1  LYS 130           3HZ      LYS 130 -30.299  12.602 -25.508
 1022    HZ2  LYS 130           1HZ      LYS 130 -31.909  12.659 -25.153
 1023    HZ3  LYS 130           2HZ      LYS 130 -30.880  13.769 -24.498